Browse entries in the PDBbind-CN Database
HEADER 5ZAH_COMPLEX COMPND 5ZAH_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 U 245 ILE ILE GLY GLY GLU PHE THR THR ILE GLU ASN GLN PRO SEQRES 2 U 245 TRP PHE ALA ALA ILE TYR ARG ARG HIS ARG GLY GLY SER SEQRES 3 U 245 VAL THR TYR VAL CYS GLY GLY SER LEU ILE SER PRO CYS SEQRES 4 U 245 TRP VAL ILE SER ALA THR HIS CYS PHE ILE ASP TYR PRO SEQRES 5 U 245 LYS LYS GLU ASP TYR ILE VAL TYR LEU GLY ARG SER ARG SEQRES 6 U 245 LEU ASN SER ASN THR GLN GLY GLU MET LYS PHE GLU VAL SEQRES 7 U 245 GLU ASN LEU ILE LEU HIS LYS ASP TYR SER ALA ASP THR SEQRES 8 U 245 LEU ALA HIS HIS ASN ASP ILE ALA LEU LEU LYS ILE ARG SEQRES 9 U 245 SER LYS GLU GLY ARG CYS ALA GLN PRO SER ARG THR ILE SEQRES 10 U 245 GLN THR ILE ALA LEU PRO SER MET TYR ASN ASP PRO GLN SEQRES 11 U 245 PHE GLY THR SER CYS GLU ILE THR GLY PHE GLY LYS GLU SEQRES 12 U 245 GLN SER THR ASP TYR LEU TYR PRO GLU GLN LEU LYS MET SEQRES 13 U 245 THR VAL VAL LYS LEU ILE SER HIS ARG GLU CYS GLN GLN SEQRES 14 U 245 PRO HIS TYR TYR GLY SER GLU VAL THR THR LYS MET LEU SEQRES 15 U 245 CYS ALA ALA ASP PRO GLN TRP LYS THR ASP SER CYS GLN SEQRES 16 U 245 GLY ASP SER GLY GLY PRO LEU VAL CYS SER LEU GLN GLY SEQRES 17 U 245 ARG MET THR LEU THR GLY ILE VAL SER TRP GLY ARG GLY SEQRES 18 U 245 CYS ALA LEU LYS ASP LYS PRO GLY VAL TYR THR ARG VAL SEQRES 19 U 245 SER HIS PHE LEU PRO TRP ILE ARG SER HIS THR HET UNN A 249 52 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 -9.471 34.323 -6.080 1.00 46.44 N ATOM 2 CA ILE U 16 -9.496 35.810 -6.138 1.00 46.51 C ATOM 3 C ILE U 16 -10.273 36.311 -4.926 1.00 46.34 C ATOM 4 O ILE U 16 -11.396 35.874 -4.682 1.00 42.73 O ATOM 5 CB ILE U 16 -10.200 36.344 -7.418 1.00 49.95 C ATOM 6 CG1 ILE U 16 -9.614 35.735 -8.714 1.00 51.07 C ATOM 7 CG2 ILE U 16 -10.151 37.870 -7.477 1.00 48.60 C ATOM 8 CD1 ILE U 16 -8.235 36.237 -9.106 1.00 51.31 C ATOM 9 HN3 ILE U 16 -10.445 33.960 -6.100 1.00 0.00 H ATOM 10 HN2 ILE U 16 -9.005 34.019 -5.201 1.00 0.00 H ATOM 11 HN1 ILE U 16 -8.945 33.954 -6.898 1.00 0.00 H ATOM 12 N ILE U 17 -9.679 37.242 -4.187 1.00 49.32 N ATOM 13 CA ILE U 17 -10.319 37.846 -3.015 1.00 49.81 C ATOM 14 C ILE U 17 -11.213 38.981 -3.484 1.00 51.05 C ATOM 15 O ILE U 17 -10.743 39.904 -4.142 1.00 52.49 O ATOM 16 CB ILE U 17 -9.286 38.434 -2.038 1.00 48.84 C ATOM 17 CG1 ILE U 17 -8.234 37.389 -1.642 1.00 47.98 C ATOM 18 CG2 ILE U 17 -9.989 39.025 -0.819 1.00 49.83 C ATOM 19 CD1 ILE U 17 -8.785 36.066 -1.169 1.00 45.61 C ATOM 20 H ILE U 17 -8.723 37.554 -4.451 1.00 0.00 H ATOM 21 N GLY U 18 -12.495 38.921 -3.154 1.00 49.91 N ATOM 22 CA GLY U 18 -13.427 39.924 -3.648 1.00 52.11 C ATOM 23 C GLY U 18 -13.630 39.800 -5.151 1.00 50.61 C ATOM 24 O GLY U 18 -13.951 38.721 -5.643 1.00 52.09 O ATOM 25 H GLY U 18 -12.836 38.154 -2.540 1.00 0.00 H ATOM 26 N GLY U 19 -13.451 40.892 -5.882 1.00 47.70 N ATOM 27 CA GLY U 19 -13.682 40.882 -7.317 1.00 49.21 C ATOM 28 C GLY U 19 -15.106 40.525 -7.716 1.00 49.83 C ATOM 29 O GLY U 19 -16.052 40.889 -7.034 1.00 52.67 O ATOM 30 H GLY U 19 -13.140 41.771 -5.421 1.00 0.00 H ATOM 31 N GLU U 20 -15.233 39.799 -8.823 1.00 49.85 N ATOM 32 CA GLU U 20 -16.512 39.420 -9.407 1.00 50.74 C ATOM 33 C GLU U 20 -16.363 38.107 -10.149 1.00 50.11 C ATOM 34 O GLU U 20 -15.259 37.742 -10.547 1.00 54.69 O ATOM 35 CB GLU U 20 -16.979 40.488 -10.384 1.00 55.26 C ATOM 36 CG GLU U 20 -15.898 40.937 -11.360 1.00 62.34 C ATOM 37 CD GLU U 20 -16.422 41.830 -12.471 1.00 67.36 C ATOM 38 OE1 GLU U 20 -16.770 41.261 -13.541 1.00 71.13 O ATOM 39 OE2 GLU U 20 -16.476 43.079 -12.271 1.00 61.11 O ATOM 40 H GLU U 20 -14.365 39.482 -9.301 1.00 0.00 H ATOM 41 N PHE U 21 -17.470 37.396 -10.333 1.00 46.86 N ATOM 42 CA PHE U 21 -17.448 36.164 -11.103 1.00 45.69 C ATOM 43 C PHE U 21 -17.489 36.499 -12.574 1.00 46.41 C ATOM 44 O PHE U 21 -17.854 37.600 -12.962 1.00 47.86 O ATOM 45 CB PHE U 21 -18.602 35.249 -10.731 1.00 46.64 C ATOM 46 CG PHE U 21 -18.422 34.563 -9.406 1.00 49.37 C ATOM 47 CD1 PHE U 21 -17.712 33.374 -9.317 1.00 49.71 C ATOM 48 CD2 PHE U 21 -18.968 35.099 -8.240 1.00 51.82 C ATOM 49 CE1 PHE U 21 -17.547 32.727 -8.096 1.00 50.14 C ATOM 50 CE2 PHE U 21 -18.804 34.456 -7.017 1.00 51.91 C ATOM 51 CZ PHE U 21 -18.093 33.267 -6.948 1.00 50.59 C ATOM 52 H PHE U 21 -18.366 37.726 -9.920 1.00 0.00 H ATOM 53 N THR U 22 -17.090 35.535 -13.385 1.00 48.47 N ATOM 54 CA THR U 22 -16.994 35.711 -14.827 1.00 48.70 C ATOM 55 C THR U 22 -17.095 34.358 -15.526 1.00 48.32 C ATOM 56 O THR U 22 -17.162 33.317 -14.876 1.00 48.43 O ATOM 57 CB THR U 22 -15.670 36.402 -15.189 1.00 49.41 C ATOM 58 OG1 THR U 22 -15.538 36.492 -16.609 1.00 50.93 O ATOM 59 CG2 THR U 22 -14.482 35.632 -14.625 1.00 51.21 C ATOM 60 HG1 THR U 22 -15.548 35.582 -16.999 1.00 0.00 H ATOM 61 H THR U 22 -16.834 34.613 -12.977 1.00 0.00 H ATOM 62 N THR U 23 -17.132 34.384 -16.848 1.00 49.89 N ATOM 63 CA THR U 23 -17.034 33.168 -17.647 1.00 51.70 C ATOM 64 C THR U 23 -15.779 33.273 -18.476 1.00 51.59 C ATOM 65 O THR U 23 -15.106 34.321 -18.477 1.00 51.35 O ATOM 66 CB THR U 23 -18.238 32.986 -18.582 1.00 54.40 C ATOM 67 OG1 THR U 23 -18.421 34.180 -19.359 1.00 55.61 O ATOM 68 CG2 THR U 23 -19.506 32.652 -17.791 1.00 53.56 C ATOM 69 HG1 THR U 23 -19.197 34.064 -19.962 1.00 0.00 H ATOM 70 H THR U 23 -17.234 35.299 -17.332 1.00 0.00 H ATOM 71 N ILE U 24 -15.471 32.188 -19.185 1.00 50.36 N ATOM 72 CA ILE U 24 -14.252 32.107 -19.982 1.00 53.05 C ATOM 73 C ILE U 24 -14.290 33.037 -21.193 1.00 52.86 C ATOM 74 O ILE U 24 -13.247 33.392 -21.708 1.00 53.65 O ATOM 75 CB ILE U 24 -13.944 30.649 -20.410 1.00 53.92 C ATOM 76 CG1 ILE U 24 -12.457 30.450 -20.726 1.00 57.09 C ATOM 77 CG2 ILE U 24 -14.796 30.238 -21.590 1.00 53.57 C ATOM 78 CD1 ILE U 24 -11.515 30.689 -19.561 1.00 57.82 C ATOM 79 H ILE U 24 -16.119 31.375 -19.170 1.00 0.00 H ATOM 80 N GLU U 25 -15.481 33.441 -21.632 1.00 53.63 N ATOM 81 CA GLU U 25 -15.601 34.360 -22.754 1.00 54.78 C ATOM 82 C GLU U 25 -14.984 35.736 -22.463 1.00 57.16 C ATOM 83 O GLU U 25 -14.561 36.413 -23.394 1.00 61.81 O ATOM 84 CB GLU U 25 -17.065 34.522 -23.177 1.00 58.40 C ATOM 85 CG GLU U 25 -17.715 33.296 -23.824 1.00 62.48 C ATOM 86 CD GLU U 25 -18.528 32.421 -22.869 1.00 65.28 C ATOM 87 OE1 GLU U 25 -18.384 32.560 -21.634 1.00 61.06 O ATOM 88 OE2 GLU U 25 -19.315 31.578 -23.369 1.00 68.72 O ATOM 89 H GLU U 25 -16.342 33.093 -21.164 1.00 0.00 H ATOM 90 N ASN U 26 -14.940 36.156 -21.195 1.00 57.28 N ATOM 91 CA ASN U 26 -14.282 37.427 -20.820 1.00 58.57 C ATOM 92 C ASN U 26 -12.766 37.350 -20.721 1.00 56.76 C ATOM 93 O ASN U 26 -12.109 38.380 -20.660 1.00 57.82 O ATOM 94 CB ASN U 26 -14.787 37.943 -19.469 1.00 59.60 C ATOM 95 CG ASN U 26 -16.236 38.357 -19.504 1.00 60.15 C ATOM 96 OD1 ASN U 26 -16.725 38.885 -20.499 1.00 61.64 O ATOM 97 ND2 ASN U 26 -16.933 38.125 -18.403 1.00 62.52 N ATOM 98 HD22 ASN U 26 -16.477 37.675 -17.584 1.00 0.00 H ATOM 99 HD21 ASN U 26 -17.937 38.393 -18.357 1.00 0.00 H ATOM 100 H ASN U 26 -15.379 35.575 -20.453 1.00 0.00 H ATOM 101 N GLN U 27 -12.223 36.141 -20.654 1.00 54.94 N ATOM 102 CA GLN U 27 -10.805 35.930 -20.388 1.00 52.22 C ATOM 103 C GLN U 27 -10.372 34.635 -21.097 1.00 47.15 C ATOM 104 O GLN U 27 -9.784 33.759 -20.477 1.00 43.03 O ATOM 105 CB GLN U 27 -10.602 35.856 -18.861 1.00 53.93 C ATOM 106 CG GLN U 27 -9.200 36.190 -18.378 1.00 57.21 C ATOM 107 CD GLN U 27 -8.965 37.669 -18.048 1.00 61.10 C ATOM 108 OE1 GLN U 27 -7.870 38.049 -17.585 1.00 62.56 O ATOM 109 NE2 GLN U 27 -9.985 38.503 -18.253 1.00 60.36 N ATOM 110 HE22 GLN U 27 -10.881 38.144 -18.641 1.00 0.00 H ATOM 111 HE21 GLN U 27 -9.885 39.513 -18.025 1.00 0.00 H ATOM 112 H GLN U 27 -12.833 35.311 -20.797 1.00 0.00 H ATOM 113 N PRO U 28 -10.670 34.519 -22.413 1.00 45.91 N ATOM 114 CA PRO U 28 -10.558 33.243 -23.155 1.00 45.28 C ATOM 115 C PRO U 28 -9.151 32.645 -23.233 1.00 48.69 C ATOM 116 O PRO U 28 -9.020 31.441 -23.420 1.00 56.47 O ATOM 117 CB PRO U 28 -11.086 33.594 -24.542 1.00 42.99 C ATOM 118 CG PRO U 28 -10.803 35.047 -24.671 1.00 44.87 C ATOM 119 CD PRO U 28 -11.034 35.630 -23.313 1.00 44.34 C ATOM 120 N TRP U 29 -8.116 33.468 -23.102 1.00 48.02 N ATOM 121 CA TRP U 29 -6.736 32.975 -22.929 1.00 46.24 C ATOM 122 C TRP U 29 -6.508 32.164 -21.662 1.00 46.92 C ATOM 123 O TRP U 29 -5.596 31.350 -21.636 1.00 50.50 O ATOM 124 CB TRP U 29 -5.731 34.131 -22.950 1.00 46.96 C ATOM 125 CG TRP U 29 -6.112 35.261 -22.058 1.00 49.38 C ATOM 126 CD1 TRP U 29 -5.971 35.335 -20.695 1.00 50.79 C ATOM 127 CD2 TRP U 29 -6.713 36.487 -22.467 1.00 49.89 C ATOM 128 NE1 TRP U 29 -6.449 36.540 -20.240 1.00 50.73 N ATOM 129 CE2 TRP U 29 -6.914 37.263 -21.308 1.00 50.60 C ATOM 130 CE3 TRP U 29 -7.111 37.004 -23.706 1.00 50.68 C ATOM 131 CZ2 TRP U 29 -7.489 38.530 -21.353 1.00 52.10 C ATOM 132 CZ3 TRP U 29 -7.668 38.266 -23.753 1.00 51.65 C ATOM 133 CH2 TRP U 29 -7.857 39.016 -22.584 1.00 52.97 C ATOM 134 HE1 TRP U 29 -6.457 36.852 -19.248 1.00 0.00 H ATOM 135 H TRP U 29 -8.284 34.494 -23.122 1.00 0.00 H ATOM 136 N PHE U 30 -7.304 32.388 -20.613 1.00 46.65 N ATOM 137 CA PHE U 30 -7.114 31.692 -19.344 1.00 43.93 C ATOM 138 C PHE U 30 -7.156 30.176 -19.510 1.00 47.86 C ATOM 139 O PHE U 30 -8.001 29.633 -20.246 1.00 47.74 O ATOM 140 CB PHE U 30 -8.151 32.112 -18.313 1.00 41.95 C ATOM 141 CG PHE U 30 -7.982 31.426 -17.000 1.00 40.78 C ATOM 142 CD1 PHE U 30 -7.070 31.898 -16.075 1.00 40.69 C ATOM 143 CD2 PHE U 30 -8.688 30.277 -16.705 1.00 41.41 C ATOM 144 CE1 PHE U 30 -6.886 31.251 -14.862 1.00 40.59 C ATOM 145 CE2 PHE U 30 -8.497 29.615 -15.497 1.00 42.40 C ATOM 146 CZ PHE U 30 -7.595 30.104 -14.571 1.00 39.98 C ATOM 147 H PHE U 30 -8.079 33.076 -20.703 1.00 0.00 H ATOM 148 N ALA U 31 -6.231 29.518 -18.804 1.00 52.55 N ATOM 149 CA ALA U 31 -6.051 28.063 -18.825 1.00 54.66 C ATOM 150 C ALA U 31 -6.122 27.498 -17.413 1.00 55.00 C ATOM 151 O ALA U 31 -5.774 28.176 -16.444 1.00 57.33 O ATOM 152 CB ALA U 31 -4.712 27.718 -19.439 1.00 56.23 C ATOM 153 H ALA U 31 -5.596 30.076 -18.199 1.00 0.00 H ATOM 154 N ALA U 32 -6.560 26.248 -17.313 1.00 52.43 N ATOM 155 CA ALA U 32 -6.807 25.604 -16.038 1.00 50.31 C ATOM 156 C ALA U 32 -5.986 24.339 -15.992 1.00 52.14 C ATOM 157 O ALA U 32 -6.156 23.465 -16.850 1.00 53.36 O ATOM 158 CB ALA U 32 -8.275 25.272 -15.914 1.00 49.10 C ATOM 159 H ALA U 32 -6.733 25.709 -18.185 1.00 0.00 H ATOM 160 N ILE U 33 -5.111 24.235 -14.991 1.00 51.90 N ATOM 161 CA ILE U 33 -4.162 23.127 -14.919 1.00 51.20 C ATOM 162 C ILE U 33 -4.427 22.238 -13.723 1.00 48.60 C ATOM 163 O ILE U 33 -4.425 22.699 -12.589 1.00 44.30 O ATOM 164 CB ILE U 33 -2.719 23.617 -14.852 1.00 50.72 C ATOM 165 CG1 ILE U 33 -2.456 24.582 -16.009 1.00 53.58 C ATOM 166 CG2 ILE U 33 -1.770 22.435 -14.915 1.00 49.43 C ATOM 167 CD1 ILE U 33 -1.248 25.471 -15.810 1.00 57.08 C ATOM 168 H ILE U 33 -5.104 24.959 -14.245 1.00 0.00 H ATOM 169 N TYR U 34 -4.604 20.965 -14.016 1.00 50.12 N ATOM 170 CA TYR U 34 -4.947 19.961 -13.051 1.00 53.66 C ATOM 171 C TYR U 34 -3.929 18.872 -13.149 1.00 58.06 C ATOM 172 O TYR U 34 -3.279 18.718 -14.153 1.00 52.45 O ATOM 173 CB TYR U 34 -6.285 19.324 -13.366 1.00 54.73 C ATOM 174 CG TYR U 34 -7.506 20.204 -13.344 1.00 55.55 C ATOM 175 CD1 TYR U 34 -7.801 21.027 -14.395 1.00 55.72 C ATOM 176 CD2 TYR U 34 -8.391 20.154 -12.304 1.00 52.53 C ATOM 177 CE1 TYR U 34 -8.916 21.812 -14.391 1.00 53.18 C ATOM 178 CE2 TYR U 34 -9.507 20.934 -12.299 1.00 51.54 C ATOM 179 CZ TYR U 34 -9.755 21.761 -13.349 1.00 52.32 C ATOM 180 OH TYR U 34 -10.865 22.535 -13.355 1.00 49.74 O ATOM 181 HH TYR U 34 -11.668 21.958 -13.310 1.00 0.00 H ATOM 182 H TYR U 34 -4.488 20.671 -15.007 1.00 0.00 H ATOM 183 N ARG U 35 -3.796 18.120 -12.074 1.00 69.10 N ATOM 184 CA ARG U 35 -2.851 17.028 -11.981 1.00 78.92 C ATOM 185 C ARG U 35 -3.534 15.727 -11.676 1.00 78.84 C ATOM 186 O ARG U 35 -4.319 15.667 -10.769 1.00 78.86 O ATOM 187 CB ARG U 35 -1.859 17.298 -10.855 1.00 85.64 C ATOM 188 CG ARG U 35 -0.958 16.121 -10.519 1.00 89.75 C ATOM 189 CD ARG U 35 0.219 16.537 -9.673 1.00 93.51 C ATOM 190 NE ARG U 35 -0.107 16.599 -8.260 1.00 94.51 N ATOM 191 CZ ARG U 35 -0.038 15.561 -7.446 1.00 94.35 C ATOM 192 NH1 ARG U 35 0.345 14.390 -7.920 1.00 94.61 N ATOM 193 NH2 ARG U 35 -0.350 15.696 -6.168 1.00 91.14 N ATOM 194 HE ARG U 35 -0.412 17.512 -7.866 1.00 0.00 H ATOM 195 HH12 ARG U 35 0.403 13.567 -7.287 1.00 0.00 H ATOM 196 HH11 ARG U 35 0.589 14.291 -8.926 1.00 0.00 H ATOM 197 HH22 ARG U 35 -0.295 14.877 -5.530 1.00 0.00 H ATOM 198 HH21 ARG U 35 -0.651 16.621 -5.801 1.00 0.00 H ATOM 199 H ARG U 35 -4.400 18.322 -11.252 1.00 0.00 H ATOM 200 N ARG U 36 -3.194 14.684 -12.415 1.00 85.41 N ATOM 201 CA ARG U 36 -3.654 13.334 -12.141 1.00 87.80 C ATOM 202 C ARG U 36 -2.964 12.747 -10.948 1.00 87.36 C ATOM 203 O ARG U 36 -1.885 13.165 -10.573 1.00 82.22 O ATOM 204 CB ARG U 36 -3.377 12.405 -13.309 1.00 92.26 C ATOM 205 CG ARG U 36 -3.834 12.903 -14.659 1.00 95.07 C ATOM 206 CD ARG U 36 -3.095 12.177 -15.757 1.00 93.22 C ATOM 207 NE ARG U 36 -3.601 12.532 -17.063 1.00 92.56 N ATOM 208 CZ ARG U 36 -2.863 12.557 -18.156 1.00 93.88 C ATOM 209 NH1 ARG U 36 -1.582 12.247 -18.093 1.00 90.00 N ATOM 210 NH2 ARG U 36 -3.414 12.896 -19.310 1.00 94.78 N ATOM 211 HE ARG U 36 -4.607 12.783 -17.146 1.00 0.00 H ATOM 212 HH12 ARG U 36 -0.999 12.266 -18.954 1.00 0.00 H ATOM 213 HH11 ARG U 36 -1.155 11.983 -17.182 1.00 0.00 H ATOM 214 HH22 ARG U 36 -2.837 12.918 -20.175 1.00 0.00 H ATOM 215 HH21 ARG U 36 -4.424 13.141 -19.352 1.00 0.00 H ATOM 216 H ARG U 36 -2.568 14.838 -13.231 1.00 0.00 H ATOM 217 N HIS U 37 -3.607 11.754 -10.365 1.00 93.44 N ATOM 218 CA HIS U 37 -3.058 11.013 -9.238 1.00 96.30 C ATOM 219 C HIS U 37 -2.699 9.584 -9.762 1.00 98.60 C ATOM 220 O HIS U 37 -3.185 9.215 -10.843 1.00 99.64 O ATOM 221 CB HIS U 37 -4.078 11.070 -8.083 1.00 95.37 C ATOM 222 CG HIS U 37 -4.038 12.350 -7.289 1.00 89.38 C ATOM 223 ND1 HIS U 37 -3.556 13.542 -7.792 1.00 83.23 N ATOM 224 CD2 HIS U 37 -4.440 12.618 -6.024 1.00 86.26 C ATOM 225 CE1 HIS U 37 -3.651 14.480 -6.868 1.00 81.03 C ATOM 226 NE2 HIS U 37 -4.187 13.946 -5.787 1.00 81.43 N ATOM 227 H HIS U 37 -4.546 11.489 -10.725 1.00 0.00 H ATOM 228 N ARG U 37A -1.901 8.749 -9.072 1.00 97.37 N ATOM 229 CA ARG U 37A -1.769 8.598 -7.603 1.00 97.95 C ATOM 230 C ARG U 37A -3.096 8.060 -7.010 1.00 98.95 C ATOM 231 O ARG U 37A -3.462 8.362 -5.865 1.00101.50 O ATOM 232 CB ARG U 37A -1.267 9.863 -6.874 1.00 96.35 C ATOM 233 CG ARG U 37A 0.240 10.051 -6.780 1.00 97.15 C ATOM 234 CD ARG U 37A 0.604 11.252 -5.906 1.00 93.51 C ATOM 235 NE ARG U 37A -0.556 11.769 -5.159 1.00 89.88 N ATOM 236 CZ ARG U 37A -0.516 12.363 -3.967 1.00 88.99 C ATOM 237 NH1 ARG U 37A 0.631 12.615 -3.341 1.00 88.75 N ATOM 238 NH2 ARG U 37A -1.659 12.749 -3.410 1.00 91.98 N ATOM 239 HE ARG U 37A -1.491 11.660 -5.602 1.00 0.00 H ATOM 240 HH12 ARG U 37A 0.624 13.080 -2.411 1.00 0.00 H ATOM 241 HH11 ARG U 37A 1.534 12.346 -3.782 1.00 0.00 H ATOM 242 HH22 ARG U 37A -1.653 13.215 -2.480 1.00 0.00 H ATOM 243 HH21 ARG U 37A -2.559 12.585 -3.904 1.00 0.00 H ATOM 244 H ARG U 37A -1.296 8.127 -9.645 1.00 0.00 H ATOM 245 N GLY U 37B -3.802 7.255 -7.804 1.00 94.95 N ATOM 246 CA GLY U 37B -5.119 6.755 -7.444 1.00 96.85 C ATOM 247 C GLY U 37B -6.244 7.590 -8.022 1.00100.92 C ATOM 248 O GLY U 37B -7.063 8.123 -7.269 1.00102.83 O ATOM 249 H GLY U 37B -3.394 6.973 -8.718 1.00 0.00 H ATOM 250 N GLY U 37C -6.253 7.746 -9.351 1.00102.02 N ATOM 251 CA GLY U 37C -7.430 8.213 -10.116 1.00100.36 C ATOM 252 C GLY U 37C -7.979 9.635 -9.938 1.00101.65 C ATOM 253 O GLY U 37C -8.714 10.128 -10.811 1.00 94.25 O ATOM 254 H GLY U 37C -5.383 7.526 -9.876 1.00 0.00 H ATOM 255 N SER U 37D -7.650 10.287 -8.818 1.00 99.07 N ATOM 256 CA SER U 37D -8.162 11.619 -8.493 1.00 94.07 C ATOM 257 C SER U 37D -7.505 12.693 -9.371 1.00 93.06 C ATOM 258 O SER U 37D -6.318 12.598 -9.703 1.00 93.26 O ATOM 259 CB SER U 37D -7.916 11.945 -7.009 1.00 91.83 C ATOM 260 OG SER U 37D -8.375 10.906 -6.162 1.00 91.38 O ATOM 261 HG SER U 37D -7.897 10.067 -6.381 1.00 0.00 H ATOM 262 H SER U 37D -7.001 9.827 -8.148 1.00 0.00 H ATOM 263 N VAL U 38 -8.290 13.710 -9.732 1.00 87.48 N ATOM 264 CA VAL U 38 -7.831 14.850 -10.544 1.00 77.89 C ATOM 265 C VAL U 38 -8.135 16.180 -9.830 1.00 70.32 C ATOM 266 O VAL U 38 -9.279 16.625 -9.825 1.00 65.38 O ATOM 267 CB VAL U 38 -8.488 14.827 -11.946 1.00 72.86 C ATOM 268 CG1 VAL U 38 -8.062 16.042 -12.769 1.00 68.84 C ATOM 269 CG2 VAL U 38 -8.156 13.518 -12.662 1.00 71.47 C ATOM 270 H VAL U 38 -9.283 13.697 -9.422 1.00 0.00 H ATOM 271 N THR U 39 -7.105 16.797 -9.242 1.00 66.50 N ATOM 272 CA THR U 39 -7.246 18.041 -8.471 1.00 63.55 C ATOM 273 C THR U 39 -6.631 19.238 -9.200 1.00 63.51 C ATOM 274 O THR U 39 -5.713 19.076 -10.008 1.00 65.47 O ATOM 275 CB THR U 39 -6.624 17.900 -7.069 1.00 60.88 C ATOM 276 OG1 THR U 39 -5.208 17.668 -7.165 1.00 58.13 O ATOM 277 CG2 THR U 39 -7.295 16.746 -6.325 1.00 60.79 C ATOM 278 HG1 THR U 39 -4.827 17.580 -6.256 1.00 0.00 H ATOM 279 H THR U 39 -6.158 16.377 -9.334 1.00 0.00 H ATOM 280 N TYR U 40 -7.150 20.432 -8.914 1.00 61.75 N ATOM 281 CA TYR U 40 -6.677 21.644 -9.565 1.00 59.73 C ATOM 282 C TYR U 40 -5.373 22.072 -8.925 1.00 61.02 C ATOM 283 O TYR U 40 -5.198 21.955 -7.705 1.00 64.28 O ATOM 284 CB TYR U 40 -7.706 22.760 -9.458 1.00 57.94 C ATOM 285 CG TYR U 40 -7.365 24.049 -10.208 1.00 58.87 C ATOM 286 CD1 TYR U 40 -7.470 24.141 -11.611 1.00 58.05 C ATOM 287 CD2 TYR U 40 -6.973 25.195 -9.510 1.00 59.34 C ATOM 288 CE1 TYR U 40 -7.178 25.336 -12.282 1.00 57.32 C ATOM 289 CE2 TYR U 40 -6.682 26.388 -10.172 1.00 60.03 C ATOM 290 CZ TYR U 40 -6.788 26.467 -11.552 1.00 59.46 C ATOM 291 OH TYR U 40 -6.496 27.678 -12.163 1.00 60.04 O ATOM 292 HH TYR U 40 -6.613 27.589 -13.142 1.00 0.00 H ATOM 293 H TYR U 40 -7.911 20.499 -8.209 1.00 0.00 H ATOM 294 N VAL U 41 -4.482 22.579 -9.773 1.00 58.37 N ATOM 295 CA VAL U 41 -3.143 22.975 -9.403 1.00 54.95 C ATOM 296 C VAL U 41 -2.977 24.491 -9.532 1.00 54.81 C ATOM 297 O VAL U 41 -2.761 25.189 -8.535 1.00 49.16 O ATOM 298 CB VAL U 41 -2.134 22.259 -10.319 1.00 55.79 C ATOM 299 CG1 VAL U 41 -0.702 22.629 -9.944 1.00 57.44 C ATOM 300 CG2 VAL U 41 -2.366 20.750 -10.271 1.00 55.45 C ATOM 301 H VAL U 41 -4.768 22.698 -10.766 1.00 0.00 H ATOM 302 N CYS U 42 -3.085 24.984 -10.768 1.00 57.19 N ATOM 303 CA CYS U 42 -2.734 26.365 -11.106 1.00 55.59 C ATOM 304 C CYS U 42 -3.385 26.825 -12.390 1.00 52.41 C ATOM 305 O CYS U 42 -3.899 26.039 -13.192 1.00 46.90 O ATOM 306 CB CYS U 42 -1.211 26.524 -11.259 1.00 57.78 C ATOM 307 SG CYS U 42 -0.355 26.947 -9.726 1.00 63.14 S ATOM 308 H CYS U 42 -3.434 24.360 -11.524 1.00 0.00 H ATOM 309 N GLY U 43 -3.334 28.137 -12.560 1.00 54.98 N ATOM 310 CA GLY U 43 -3.789 28.802 -13.760 1.00 55.47 C ATOM 311 C GLY U 43 -2.656 28.983 -14.742 1.00 53.74 C ATOM 312 O GLY U 43 -1.496 28.700 -14.447 1.00 56.03 O ATOM 313 H GLY U 43 -2.947 28.719 -11.790 1.00 0.00 H ATOM 314 N GLY U 44 -3.021 29.457 -15.920 1.00 51.93 N ATOM 315 CA GLY U 44 -2.087 29.689 -16.999 1.00 50.41 C ATOM 316 C GLY U 44 -2.738 30.559 -18.038 1.00 47.94 C ATOM 317 O GLY U 44 -3.927 30.860 -17.952 1.00 46.97 O ATOM 318 H GLY U 44 -4.026 29.673 -16.078 1.00 0.00 H ATOM 319 N SER U 45 -1.955 30.956 -19.027 1.00 48.22 N ATOM 320 CA SER U 45 -2.446 31.798 -20.108 1.00 47.67 C ATOM 321 C SER U 45 -1.925 31.242 -21.418 1.00 46.51 C ATOM 322 O SER U 45 -0.732 31.012 -21.578 1.00 45.60 O ATOM 323 CB SER U 45 -1.988 33.239 -19.895 1.00 48.16 C ATOM 324 OG SER U 45 -1.790 33.494 -18.507 1.00 50.31 O ATOM 325 HG SER U 45 -1.494 34.431 -18.384 1.00 0.00 H ATOM 326 H SER U 45 -0.959 30.658 -19.033 1.00 0.00 H ATOM 327 N LEU U 46 -2.836 30.994 -22.343 1.00 48.63 N ATOM 328 CA LEU U 46 -2.478 30.573 -23.690 1.00 49.48 C ATOM 329 C LEU U 46 -1.881 31.755 -24.430 1.00 49.13 C ATOM 330 O LEU U 46 -2.576 32.705 -24.759 1.00 48.77 O ATOM 331 CB LEU U 46 -3.718 30.079 -24.429 1.00 50.62 C ATOM 332 CG LEU U 46 -3.500 29.394 -25.774 1.00 50.99 C ATOM 333 CD1 LEU U 46 -2.872 28.015 -25.580 1.00 50.63 C ATOM 334 CD2 LEU U 46 -4.836 29.314 -26.513 1.00 50.31 C ATOM 335 H LEU U 46 -3.841 31.103 -22.101 1.00 0.00 H ATOM 336 N ILE U 47 -0.579 31.706 -24.646 1.00 51.85 N ATOM 337 CA ILE U 47 0.114 32.756 -25.391 1.00 54.16 C ATOM 338 C ILE U 47 0.220 32.416 -26.867 1.00 54.27 C ATOM 339 O ILE U 47 0.410 33.302 -27.690 1.00 59.15 O ATOM 340 CB ILE U 47 1.521 33.053 -24.830 1.00 56.41 C ATOM 341 CG1 ILE U 47 2.358 31.772 -24.662 1.00 59.31 C ATOM 342 CG2 ILE U 47 1.398 33.784 -23.502 1.00 59.34 C ATOM 343 CD1 ILE U 47 3.835 32.024 -24.436 1.00 58.74 C ATOM 344 H ILE U 47 -0.033 30.901 -24.277 1.00 0.00 H ATOM 345 N SER U 48 0.103 31.135 -27.190 1.00 52.72 N ATOM 346 CA SER U 48 0.224 30.662 -28.550 1.00 53.47 C ATOM 347 C SER U 48 -0.511 29.325 -28.633 1.00 51.54 C ATOM 348 O SER U 48 -0.682 28.676 -27.608 1.00 49.79 O ATOM 349 CB SER U 48 1.703 30.519 -28.908 1.00 54.64 C ATOM 350 OG SER U 48 1.945 29.393 -29.740 1.00 60.17 O ATOM 351 HG SER U 48 2.912 29.339 -29.947 1.00 0.00 H ATOM 352 H SER U 48 -0.083 30.444 -26.435 1.00 0.00 H ATOM 353 N PRO U 49 -0.945 28.912 -29.839 1.00 49.79 N ATOM 354 CA PRO U 49 -1.752 27.704 -29.999 1.00 50.90 C ATOM 355 C PRO U 49 -1.249 26.479 -29.246 1.00 56.39 C ATOM 356 O PRO U 49 -2.050 25.762 -28.648 1.00 60.69 O ATOM 357 CB PRO U 49 -1.691 27.447 -31.494 1.00 50.94 C ATOM 358 CG PRO U 49 -1.567 28.803 -32.087 1.00 51.41 C ATOM 359 CD PRO U 49 -0.825 29.655 -31.107 1.00 49.55 C ATOM 360 N CYS U 50 0.060 26.244 -29.267 1.00 60.72 N ATOM 361 CA CYS U 50 0.643 25.075 -28.593 1.00 60.63 C ATOM 362 C CYS U 50 1.252 25.375 -27.222 1.00 57.68 C ATOM 363 O CYS U 50 1.623 24.448 -26.510 1.00 58.56 O ATOM 364 CB CYS U 50 1.687 24.426 -29.507 1.00 61.44 C ATOM 365 SG CYS U 50 0.992 23.920 -31.093 1.00 60.95 S ATOM 366 H CYS U 50 0.686 26.903 -29.772 1.00 0.00 H ATOM 367 N TRP U 51 1.319 26.649 -26.844 1.00 56.15 N ATOM 368 CA TRP U 51 2.034 27.071 -25.656 1.00 56.86 C ATOM 369 C TRP U 51 1.175 27.802 -24.650 1.00 53.63 C ATOM 370 O TRP U 51 0.612 28.853 -24.955 1.00 47.74 O ATOM 371 CB TRP U 51 3.178 27.974 -26.067 1.00 62.11 C ATOM 372 CG TRP U 51 4.304 27.206 -26.652 1.00 68.59 C ATOM 373 CD1 TRP U 51 4.698 27.192 -27.955 1.00 68.94 C ATOM 374 CD2 TRP U 51 5.190 26.317 -25.950 1.00 74.04 C ATOM 375 NE1 TRP U 51 5.784 26.365 -28.111 1.00 73.52 N ATOM 376 CE2 TRP U 51 6.105 25.811 -26.897 1.00 74.73 C ATOM 377 CE3 TRP U 51 5.301 25.904 -24.609 1.00 73.25 C ATOM 378 CZ2 TRP U 51 7.121 24.909 -26.549 1.00 71.60 C ATOM 379 CZ3 TRP U 51 6.312 25.006 -24.266 1.00 70.43 C ATOM 380 CH2 TRP U 51 7.210 24.526 -25.234 1.00 69.88 C ATOM 381 HE1 TRP U 51 6.283 26.187 -29.006 1.00 0.00 H ATOM 382 H TRP U 51 0.841 27.369 -27.423 1.00 0.00 H ATOM 383 N VAL U 52 1.096 27.229 -23.449 1.00 53.73 N ATOM 384 CA VAL U 52 0.557 27.911 -22.280 1.00 55.37 C ATOM 385 C VAL U 52 1.701 28.274 -21.365 1.00 51.73 C ATOM 386 O VAL U 52 2.658 27.526 -21.251 1.00 49.79 O ATOM 387 CB VAL U 52 -0.410 27.017 -21.486 1.00 59.46 C ATOM 388 CG1 VAL U 52 -0.913 27.728 -20.218 1.00 58.55 C ATOM 389 CG2 VAL U 52 -1.567 26.571 -22.381 1.00 61.93 C ATOM 390 H VAL U 52 1.434 26.251 -23.342 1.00 0.00 H ATOM 391 N ILE U 53 1.560 29.413 -20.699 1.00 51.97 N ATOM 392 CA ILE U 53 2.541 29.915 -19.760 1.00 53.60 C ATOM 393 C ILE U 53 1.957 29.958 -18.353 1.00 53.22 C ATOM 394 O ILE U 53 0.819 30.362 -18.145 1.00 53.63 O ATOM 395 CB ILE U 53 3.041 31.307 -20.199 1.00 58.07 C ATOM 396 CG1 ILE U 53 4.405 31.612 -19.581 1.00 61.88 C ATOM 397 CG2 ILE U 53 2.044 32.427 -19.881 1.00 59.42 C ATOM 398 CD1 ILE U 53 5.104 32.806 -20.210 1.00 62.15 C ATOM 399 H ILE U 53 0.700 29.975 -20.860 1.00 0.00 H ATOM 400 N SER U 54 2.750 29.532 -17.388 1.00 54.50 N ATOM 401 CA SER U 54 2.295 29.413 -16.016 1.00 56.50 C ATOM 402 C SER U 54 3.417 29.869 -15.095 1.00 54.87 C ATOM 403 O SER U 54 4.372 30.506 -15.550 1.00 55.62 O ATOM 404 CB SER U 54 1.910 27.956 -15.742 1.00 60.35 C ATOM 405 OG SER U 54 1.239 27.828 -14.493 1.00 66.58 O ATOM 406 HG SER U 54 0.415 28.377 -14.505 1.00 0.00 H ATOM 407 H SER U 54 3.731 29.274 -17.618 1.00 0.00 H ATOM 408 N ALA U 55 3.290 29.561 -13.807 1.00 52.39 N ATOM 409 CA ALA U 55 4.377 29.722 -12.852 1.00 51.64 C ATOM 410 C ALA U 55 5.073 28.386 -12.624 1.00 50.59 C ATOM 411 O ALA U 55 4.463 27.322 -12.749 1.00 48.01 O ATOM 412 CB ALA U 55 3.851 30.273 -11.538 1.00 53.17 C ATOM 413 H ALA U 55 2.379 29.191 -13.469 1.00 0.00 H ATOM 414 N THR U 56 6.354 28.455 -12.269 1.00 48.50 N ATOM 415 CA THR U 56 7.152 27.261 -12.003 1.00 45.51 C ATOM 416 C THR U 56 6.802 26.675 -10.640 1.00 44.45 C ATOM 417 O THR U 56 6.636 25.472 -10.535 1.00 41.96 O ATOM 418 CB THR U 56 8.665 27.541 -12.137 1.00 43.71 C ATOM 419 OG1 THR U 56 9.003 27.579 -13.518 1.00 41.76 O ATOM 420 CG2 THR U 56 9.497 26.460 -11.510 1.00 44.10 C ATOM 421 HG1 THR U 56 8.487 28.297 -13.963 1.00 0.00 H ATOM 422 H THR U 56 6.801 29.390 -12.178 1.00 0.00 H ATOM 423 N HIS U 57 6.653 27.505 -9.609 1.00 45.78 N ATOM 424 CA HIS U 57 6.417 26.963 -8.267 1.00 48.47 C ATOM 425 C HIS U 57 5.229 25.997 -8.263 1.00 49.45 C ATOM 426 O HIS U 57 5.150 25.114 -7.415 1.00 52.81 O ATOM 427 CB HIS U 57 6.278 28.060 -7.187 1.00 49.03 C ATOM 428 CG HIS U 57 4.916 28.684 -7.097 1.00 51.65 C ATOM 429 ND1 HIS U 57 3.799 28.003 -6.665 1.00 54.77 N ATOM 430 CD2 HIS U 57 4.503 29.949 -7.338 1.00 54.07 C ATOM 431 CE1 HIS U 57 2.754 28.813 -6.671 1.00 55.63 C ATOM 432 NE2 HIS U 57 3.156 30.003 -7.074 1.00 55.12 N ATOM 433 H HIS U 57 6.704 28.533 -9.755 1.00 0.00 H ATOM 434 N CYS U 58 4.312 26.170 -9.208 1.00 50.30 N ATOM 435 CA CYS U 58 3.171 25.281 -9.356 1.00 52.97 C ATOM 436 C CYS U 58 3.508 23.795 -9.540 1.00 53.69 C ATOM 437 O CYS U 58 2.751 22.946 -9.090 1.00 57.87 O ATOM 438 CB CYS U 58 2.303 25.767 -10.524 1.00 56.11 C ATOM 439 SG CYS U 58 1.556 27.409 -10.284 1.00 56.64 S ATOM 440 H CYS U 58 4.414 26.970 -9.865 1.00 0.00 H ATOM 441 N PHE U 59 4.633 23.486 -10.184 1.00 55.55 N ATOM 442 CA PHE U 59 4.966 22.108 -10.600 1.00 56.69 C ATOM 443 C PHE U 59 6.181 21.450 -9.915 1.00 61.78 C ATOM 444 O PHE U 59 6.327 20.230 -9.986 1.00 63.42 O ATOM 445 CB PHE U 59 5.193 22.095 -12.113 1.00 55.64 C ATOM 446 CG PHE U 59 4.141 22.846 -12.887 1.00 58.10 C ATOM 447 CD1 PHE U 59 2.969 22.213 -13.266 1.00 60.13 C ATOM 448 CD2 PHE U 59 4.307 24.188 -13.226 1.00 59.08 C ATOM 449 CE1 PHE U 59 1.982 22.880 -13.967 1.00 57.62 C ATOM 450 CE2 PHE U 59 3.321 24.858 -13.937 1.00 60.02 C ATOM 451 CZ PHE U 59 2.160 24.206 -14.305 1.00 58.87 C ATOM 452 H PHE U 59 5.306 24.248 -10.403 1.00 0.00 H ATOM 453 N ILE U 60 7.021 22.224 -9.240 1.00 63.74 N ATOM 454 CA ILE U 60 8.297 21.716 -8.747 1.00 65.86 C ATOM 455 C ILE U 60 8.258 20.511 -7.840 1.00 68.82 C ATOM 456 O ILE U 60 9.188 19.711 -7.836 1.00 65.08 O ATOM 457 CB ILE U 60 9.173 22.771 -8.045 1.00 64.64 C ATOM 458 CG1 ILE U 60 8.349 23.765 -7.247 1.00 67.68 C ATOM 459 CG2 ILE U 60 10.016 23.524 -9.040 1.00 63.18 C ATOM 460 CD1 ILE U 60 7.737 23.153 -6.024 1.00 70.36 C ATOM 461 H ILE U 60 6.764 23.215 -9.058 1.00 0.00 H ATOM 462 N ASP U 60A 7.213 20.377 -7.043 1.00 69.21 N ATOM 463 CA ASP U 60A 7.049 19.213 -6.205 1.00 70.57 C ATOM 464 C ASP U 60A 6.780 17.966 -6.996 1.00 69.58 C ATOM 465 O ASP U 60A 7.304 16.904 -6.670 1.00 75.27 O ATOM 466 CB ASP U 60A 6.010 19.467 -5.160 1.00 73.07 C ATOM 467 CG ASP U 60A 6.395 20.581 -4.235 1.00 75.91 C ATOM 468 OD1 ASP U 60A 7.560 20.626 -3.824 1.00 74.97 O ATOM 469 OD2 ASP U 60A 5.554 21.432 -3.922 1.00 79.76 O ATOM 470 H ASP U 60A 6.493 21.127 -7.019 1.00 0.00 H ATOM 471 N TYR U 60B 5.974 18.089 -8.038 1.00 66.95 N ATOM 472 CA TYR U 60B 5.699 16.943 -8.912 1.00 69.75 C ATOM 473 C TYR U 60B 5.958 17.324 -10.334 1.00 67.26 C ATOM 474 O TYR U 60B 5.048 17.559 -11.115 1.00 72.10 O ATOM 475 CB TYR U 60B 4.283 16.463 -8.773 1.00 72.41 C ATOM 476 CG TYR U 60B 3.811 16.129 -7.377 1.00 79.66 C ATOM 477 CD1 TYR U 60B 3.499 17.113 -6.493 1.00 80.18 C ATOM 478 CD2 TYR U 60B 3.616 14.833 -6.977 1.00 84.32 C ATOM 479 CE1 TYR U 60B 3.032 16.817 -5.239 1.00 80.66 C ATOM 480 CE2 TYR U 60B 3.151 14.543 -5.719 1.00 85.17 C ATOM 481 CZ TYR U 60B 2.867 15.546 -4.871 1.00 84.75 C ATOM 482 OH TYR U 60B 2.406 15.261 -3.630 1.00 93.62 O ATOM 483 HH TYR U 60B 2.247 16.104 -3.136 1.00 0.00 H ATOM 484 H TYR U 60B 5.531 19.008 -8.240 1.00 0.00 H ATOM 485 N PRO U 60C 7.311 17.341 -10.665 1.00 62.12 N ATOM 486 CA PRO U 60C 7.571 18.001 -11.923 1.00 61.84 C ATOM 487 C PRO U 60C 7.520 17.180 -13.185 1.00 61.96 C ATOM 488 O PRO U 60C 8.205 17.472 -14.119 1.00 61.30 O ATOM 489 CB PRO U 60C 8.977 18.557 -11.751 1.00 62.73 C ATOM 490 CG PRO U 60C 9.695 17.696 -10.831 1.00 62.89 C ATOM 491 CD PRO U 60C 8.680 16.868 -10.107 1.00 60.78 C ATOM 492 N LYS U 61 6.693 16.152 -13.161 1.00 65.70 N ATOM 493 CA LYS U 61 6.558 15.276 -14.321 1.00 72.28 C ATOM 494 C LYS U 61 5.319 15.533 -15.179 1.00 70.20 C ATOM 495 O LYS U 61 4.214 15.437 -14.708 1.00 68.75 O ATOM 496 CB LYS U 61 6.500 13.832 -13.808 1.00 80.34 C ATOM 497 CG LYS U 61 6.462 12.730 -14.871 1.00 87.39 C ATOM 498 CD LYS U 61 6.705 11.340 -14.291 1.00 89.61 C ATOM 499 CE LYS U 61 5.488 10.832 -13.530 1.00 92.08 C ATOM 500 NZ LYS U 61 5.615 9.415 -13.100 1.00 92.33 N ATOM 501 HZ1 LYS U 61 5.738 8.810 -13.937 1.00 0.00 H ATOM 502 HZ2 LYS U 61 6.440 9.316 -12.475 1.00 0.00 H ATOM 503 HZ3 LYS U 61 4.755 9.131 -12.588 1.00 0.00 H ATOM 504 H LYS U 61 6.131 15.964 -12.306 1.00 0.00 H ATOM 505 N LYS U 62 5.507 15.774 -16.460 1.00 68.33 N ATOM 506 CA LYS U 62 4.444 16.256 -17.314 1.00 70.21 C ATOM 507 C LYS U 62 3.220 15.368 -17.433 1.00 72.44 C ATOM 508 O LYS U 62 2.138 15.799 -17.625 1.00 78.18 O ATOM 509 CB LYS U 62 5.017 16.588 -18.678 1.00 72.00 C ATOM 510 CG LYS U 62 5.278 15.414 -19.596 1.00 76.61 C ATOM 511 CD LYS U 62 6.763 15.146 -19.733 1.00 80.40 C ATOM 512 CE LYS U 62 7.359 15.773 -20.967 1.00 80.77 C ATOM 513 NZ LYS U 62 7.148 14.920 -22.162 1.00 80.90 N ATOM 514 HZ1 LYS U 62 7.599 13.995 -22.010 1.00 0.00 H ATOM 515 HZ2 LYS U 62 6.128 14.789 -22.317 1.00 0.00 H ATOM 516 HZ3 LYS U 62 7.570 15.380 -22.994 1.00 0.00 H ATOM 517 H LYS U 62 6.449 15.613 -16.870 1.00 0.00 H ATOM 518 N GLU U 62A 3.482 14.068 -17.309 1.00 75.66 N ATOM 519 CA GLU U 62A 2.432 13.054 -17.463 1.00 74.58 C ATOM 520 C GLU U 62A 1.420 13.137 -16.328 1.00 71.30 C ATOM 521 O GLU U 62A 0.283 12.709 -16.480 1.00 73.58 O ATOM 522 CB GLU U 62A 3.019 11.636 -17.543 1.00 74.65 C ATOM 523 CG GLU U 62A 3.894 11.382 -18.766 1.00 79.56 C ATOM 524 CD GLU U 62A 5.370 11.749 -18.576 1.00 88.73 C ATOM 525 OE1 GLU U 62A 5.719 12.486 -17.623 1.00 88.53 O ATOM 526 OE2 GLU U 62A 6.201 11.304 -19.400 1.00100.42 O ATOM 527 H GLU U 62A 4.454 13.764 -17.098 1.00 0.00 H ATOM 528 N ASP U 63 1.828 13.705 -15.199 1.00 72.06 N ATOM 529 CA ASP U 63 0.896 14.003 -14.121 1.00 74.55 C ATOM 530 C ASP U 63 -0.190 14.988 -14.521 1.00 72.14 C ATOM 531 O ASP U 63 -1.260 14.928 -13.954 1.00 78.18 O ATOM 532 CB ASP U 63 1.625 14.586 -12.904 1.00 77.63 C ATOM 533 CG ASP U 63 2.533 13.588 -12.231 1.00 79.38 C ATOM 534 OD1 ASP U 63 2.094 12.436 -12.029 1.00 76.01 O ATOM 535 OD2 ASP U 63 3.678 13.965 -11.890 1.00 85.00 O ATOM 536 H ASP U 63 2.834 13.942 -15.083 1.00 0.00 H ATOM 537 N TYR U 64 0.071 15.873 -15.489 1.00 67.38 N ATOM 538 CA TYR U 64 -0.726 17.089 -15.667 1.00 59.81 C ATOM 539 C TYR U 64 -1.659 17.116 -16.853 1.00 61.31 C ATOM 540 O TYR U 64 -1.323 16.630 -17.948 1.00 63.23 O ATOM 541 CB TYR U 64 0.200 18.274 -15.804 1.00 56.76 C ATOM 542 CG TYR U 64 0.986 18.473 -14.577 1.00 52.94 C ATOM 543 CD1 TYR U 64 0.446 19.157 -13.516 1.00 53.18 C ATOM 544 CD2 TYR U 64 2.251 17.931 -14.449 1.00 51.54 C ATOM 545 CE1 TYR U 64 1.157 19.331 -12.354 1.00 53.66 C ATOM 546 CE2 TYR U 64 2.976 18.099 -13.296 1.00 51.44 C ATOM 547 CZ TYR U 64 2.420 18.799 -12.246 1.00 51.29 C ATOM 548 OH TYR U 64 3.103 19.007 -11.078 1.00 53.02 O ATOM 549 HH TYR U 64 3.331 18.134 -10.670 1.00 0.00 H ATOM 550 H TYR U 64 0.865 15.692 -16.136 1.00 0.00 H ATOM 551 N ILE U 65 -2.811 17.743 -16.610 1.00 60.54 N ATOM 552 CA ILE U 65 -3.839 17.990 -17.605 1.00 64.12 C ATOM 553 C ILE U 65 -4.118 19.487 -17.649 1.00 61.37 C ATOM 554 O ILE U 65 -4.147 20.159 -16.616 1.00 58.20 O ATOM 555 CB ILE U 65 -5.158 17.269 -17.253 1.00 70.71 C ATOM 556 CG1 ILE U 65 -4.954 15.751 -17.193 1.00 75.43 C ATOM 557 CG2 ILE U 65 -6.260 17.602 -18.261 1.00 72.07 C ATOM 558 CD1 ILE U 65 -6.031 15.038 -16.395 1.00 78.58 C ATOM 559 H ILE U 65 -2.985 18.078 -15.641 1.00 0.00 H ATOM 560 N VAL U 66 -4.347 19.982 -18.860 1.00 60.88 N ATOM 561 CA VAL U 66 -4.638 21.381 -19.101 1.00 61.48 C ATOM 562 C VAL U 66 -5.920 21.486 -19.911 1.00 60.70 C ATOM 563 O VAL U 66 -6.041 20.871 -20.971 1.00 59.75 O ATOM 564 CB VAL U 66 -3.506 22.050 -19.889 1.00 61.67 C ATOM 565 CG1 VAL U 66 -3.786 23.539 -20.069 1.00 61.54 C ATOM 566 CG2 VAL U 66 -2.178 21.808 -19.187 1.00 62.99 C ATOM 567 H VAL U 66 -4.316 19.335 -19.674 1.00 0.00 H ATOM 568 N TYR U 67 -6.859 22.277 -19.406 1.00 56.70 N ATOM 569 CA TYR U 67 -8.128 22.496 -20.056 1.00 53.43 C ATOM 570 C TYR U 67 -8.139 23.931 -20.518 1.00 49.17 C ATOM 571 O TYR U 67 -7.517 24.773 -19.882 1.00 46.89 O ATOM 572 CB TYR U 67 -9.263 22.311 -19.058 1.00 58.57 C ATOM 573 CG TYR U 67 -9.677 20.888 -18.714 1.00 59.87 C ATOM 574 CD1 TYR U 67 -10.720 20.260 -19.414 1.00 61.18 C ATOM 575 CD2 TYR U 67 -9.095 20.202 -17.638 1.00 58.29 C ATOM 576 CE1 TYR U 67 -11.145 18.978 -19.080 1.00 61.99 C ATOM 577 CE2 TYR U 67 -9.512 18.912 -17.294 1.00 60.00 C ATOM 578 CZ TYR U 67 -10.542 18.301 -18.014 1.00 61.65 C ATOM 579 OH TYR U 67 -10.979 17.025 -17.695 1.00 57.15 O ATOM 580 HH TYR U 67 -11.709 16.764 -18.311 1.00 0.00 H ATOM 581 H TYR U 67 -6.672 22.759 -18.504 1.00 0.00 H ATOM 582 N LEU U 68 -8.851 24.197 -21.613 1.00 49.52 N ATOM 583 CA LEU U 68 -9.107 25.559 -22.116 1.00 52.54 C ATOM 584 C LEU U 68 -10.585 25.742 -22.395 1.00 52.81 C ATOM 585 O LEU U 68 -11.301 24.767 -22.538 1.00 52.57 O ATOM 586 CB LEU U 68 -8.354 25.814 -23.412 1.00 56.73 C ATOM 587 CG LEU U 68 -6.827 25.813 -23.345 1.00 61.43 C ATOM 588 CD1 LEU U 68 -6.274 25.904 -24.755 1.00 63.30 C ATOM 589 CD2 LEU U 68 -6.287 26.955 -22.487 1.00 63.61 C ATOM 590 H LEU U 68 -9.250 23.396 -22.144 1.00 0.00 H ATOM 591 N GLY U 69 -11.037 26.993 -22.492 1.00 55.25 N ATOM 592 CA GLY U 69 -12.468 27.301 -22.622 1.00 54.29 C ATOM 593 C GLY U 69 -13.298 26.720 -21.488 1.00 55.67 C ATOM 594 O GLY U 69 -14.410 26.244 -21.721 1.00 58.84 O ATOM 595 H GLY U 69 -10.354 27.777 -22.475 1.00 0.00 H ATOM 596 N ARG U 70 -12.743 26.753 -20.273 1.00 57.21 N ATOM 597 CA ARG U 70 -13.351 26.182 -19.073 1.00 56.31 C ATOM 598 C ARG U 70 -13.600 27.294 -18.043 1.00 54.83 C ATOM 599 O ARG U 70 -12.638 27.847 -17.495 1.00 56.19 O ATOM 600 CB ARG U 70 -12.430 25.107 -18.488 1.00 59.45 C ATOM 601 CG ARG U 70 -13.019 24.347 -17.302 1.00 63.11 C ATOM 602 CD ARG U 70 -12.110 23.228 -16.798 1.00 63.50 C ATOM 603 NE ARG U 70 -12.760 22.367 -15.796 1.00 64.86 N ATOM 604 CZ ARG U 70 -13.378 21.198 -16.027 1.00 65.21 C ATOM 605 NH1 ARG U 70 -13.468 20.678 -17.254 1.00 66.37 N ATOM 606 NH2 ARG U 70 -13.923 20.531 -15.006 1.00 63.66 N ATOM 607 HE ARG U 70 -12.738 22.698 -14.810 1.00 0.00 H ATOM 608 HH12 ARG U 70 -13.954 19.770 -17.400 1.00 0.00 H ATOM 609 HH11 ARG U 70 -13.052 21.181 -18.064 1.00 0.00 H ATOM 610 HH22 ARG U 70 -14.404 19.624 -15.175 1.00 0.00 H ATOM 611 HH21 ARG U 70 -13.866 20.918 -14.042 1.00 0.00 H ATOM 612 H ARG U 70 -11.817 27.216 -20.175 1.00 0.00 H ATOM 613 N SER U 71 -14.884 27.604 -17.800 1.00 50.96 N ATOM 614 CA SER U 71 -15.336 28.602 -16.807 1.00 50.16 C ATOM 615 C SER U 71 -15.612 28.000 -15.432 1.00 49.51 C ATOM 616 O SER U 71 -15.925 28.738 -14.506 1.00 50.23 O ATOM 617 CB SER U 71 -16.627 29.298 -17.265 1.00 51.22 C ATOM 618 OG SER U 71 -16.417 30.128 -18.385 1.00 52.29 O ATOM 619 HG SER U 71 -17.272 30.554 -18.644 1.00 0.00 H ATOM 620 H SER U 71 -15.613 27.106 -18.350 1.00 0.00 H ATOM 621 N ARG U 72 -15.505 26.681 -15.287 1.00 50.10 N ATOM 622 CA ARG U 72 -15.834 26.030 -14.029 1.00 52.00 C ATOM 623 C ARG U 72 -14.843 24.955 -13.616 1.00 49.39 C ATOM 624 O ARG U 72 -14.245 24.296 -14.445 1.00 47.22 O ATOM 625 CB ARG U 72 -17.247 25.463 -14.091 1.00 56.37 C ATOM 626 CG ARG U 72 -18.307 26.516 -13.824 1.00 59.92 C ATOM 627 CD ARG U 72 -19.706 25.921 -13.775 1.00 64.96 C ATOM 628 NE ARG U 72 -20.103 25.445 -12.442 1.00 71.27 N ATOM 629 CZ ARG U 72 -20.470 26.223 -11.411 1.00 75.25 C ATOM 630 NH1 ARG U 72 -20.473 27.555 -11.505 1.00 71.48 N ATOM 631 NH2 ARG U 72 -20.834 25.661 -10.256 1.00 78.71 N ATOM 632 HE ARG U 72 -20.099 24.417 -12.284 1.00 0.00 H ATOM 633 HH12 ARG U 72 -20.762 28.133 -10.690 1.00 0.00 H ATOM 634 HH11 ARG U 72 -20.186 28.014 -12.393 1.00 0.00 H ATOM 635 HH22 ARG U 72 -21.119 26.259 -9.454 1.00 0.00 H ATOM 636 HH21 ARG U 72 -20.832 24.626 -10.158 1.00 0.00 H ATOM 637 H ARG U 72 -15.180 26.105 -16.089 1.00 0.00 H ATOM 638 N LEU U 73 -14.742 24.765 -12.307 1.00 48.36 N ATOM 639 CA LEU U 73 -13.648 24.045 -11.679 1.00 49.38 C ATOM 640 C LEU U 73 -13.766 22.519 -11.800 1.00 49.31 C ATOM 641 O LEU U 73 -12.850 21.875 -12.311 1.00 45.59 O ATOM 642 CB LEU U 73 -13.551 24.474 -10.205 1.00 50.96 C ATOM 643 CG LEU U 73 -12.329 24.100 -9.353 1.00 50.81 C ATOM 644 CD1 LEU U 73 -11.037 24.586 -9.976 1.00 50.79 C ATOM 645 CD2 LEU U 73 -12.452 24.674 -7.948 1.00 51.94 C ATOM 646 H LEU U 73 -15.488 25.154 -11.696 1.00 0.00 H ATOM 647 N ASN U 74 -14.879 21.949 -11.332 1.00 51.54 N ATOM 648 CA ASN U 74 -15.111 20.487 -11.379 1.00 52.10 C ATOM 649 C ASN U 74 -16.247 20.083 -12.312 1.00 55.47 C ATOM 650 O ASN U 74 -16.662 18.912 -12.329 1.00 59.58 O ATOM 651 CB ASN U 74 -15.390 19.947 -9.984 1.00 49.71 C ATOM 652 CG ASN U 74 -14.381 20.424 -8.973 1.00 49.25 C ATOM 653 OD1 ASN U 74 -13.309 19.842 -8.841 1.00 49.37 O ATOM 654 ND2 ASN U 74 -14.720 21.485 -8.244 1.00 48.52 N ATOM 655 HD22 ASN U 74 -15.641 21.945 -8.392 1.00 0.00 H ATOM 656 HD21 ASN U 74 -14.064 21.854 -7.526 1.00 0.00 H ATOM 657 H ASN U 74 -15.614 22.557 -10.917 1.00 0.00 H ATOM 658 N SER U 75 -16.724 21.050 -13.094 1.00 56.03 N ATOM 659 CA SER U 75 -17.782 20.847 -14.064 1.00 58.50 C ATOM 660 C SER U 75 -17.274 21.197 -15.471 1.00 61.15 C ATOM 661 O SER U 75 -16.658 22.248 -15.691 1.00 65.41 O ATOM 662 CB SER U 75 -19.001 21.693 -13.689 1.00 59.60 C ATOM 663 OG SER U 75 -19.618 22.244 -14.840 1.00 62.54 O ATOM 664 HG SER U 75 -18.969 22.819 -15.317 1.00 0.00 H ATOM 665 H SER U 75 -16.315 22.002 -13.004 1.00 0.00 H ATOM 666 N ASN U 76 -17.574 20.305 -16.411 1.00 63.51 N ATOM 667 CA ASN U 76 -17.138 20.407 -17.798 1.00 64.76 C ATOM 668 C ASN U 76 -17.893 21.494 -18.556 1.00 63.25 C ATOM 669 O ASN U 76 -19.013 21.271 -18.995 1.00 67.93 O ATOM 670 CB ASN U 76 -17.359 19.063 -18.524 1.00 68.38 C ATOM 671 CG ASN U 76 -16.328 18.004 -18.154 1.00 72.28 C ATOM 672 OD1 ASN U 76 -15.797 17.307 -19.027 1.00 75.35 O ATOM 673 ND2 ASN U 76 -16.047 17.869 -16.863 1.00 74.16 N ATOM 674 HD22 ASN U 76 -16.517 18.477 -16.162 1.00 0.00 H ATOM 675 HD21 ASN U 76 -15.357 17.156 -16.553 1.00 0.00 H ATOM 676 H ASN U 76 -18.154 19.486 -16.140 1.00 0.00 H ATOM 677 N THR U 77 -17.281 22.662 -18.712 1.00 62.11 N ATOM 678 CA THR U 77 -17.879 23.776 -19.467 1.00 60.42 C ATOM 679 C THR U 77 -18.056 23.484 -20.962 1.00 58.97 C ATOM 680 O THR U 77 -17.164 22.913 -21.593 1.00 56.91 O ATOM 681 CB THR U 77 -16.987 25.014 -19.358 1.00 60.40 C ATOM 682 OG1 THR U 77 -16.759 25.307 -17.971 1.00 63.59 O ATOM 683 CG2 THR U 77 -17.604 26.218 -20.080 1.00 59.33 C ATOM 684 HG1 THR U 77 -16.182 26.108 -17.895 1.00 0.00 H ATOM 685 H THR U 77 -16.342 22.795 -18.284 1.00 0.00 H ATOM 686 N GLN U 78 -19.192 23.904 -21.524 1.00 58.61 N ATOM 687 CA GLN U 78 -19.483 23.664 -22.943 1.00 61.76 C ATOM 688 C GLN U 78 -18.525 24.472 -23.818 1.00 62.09 C ATOM 689 O GLN U 78 -18.252 25.641 -23.543 1.00 63.51 O ATOM 690 CB GLN U 78 -20.937 24.012 -23.301 1.00 62.19 C ATOM 691 CG GLN U 78 -21.386 23.504 -24.676 1.00 60.39 C ATOM 692 CD GLN U 78 -22.619 24.217 -25.230 1.00 61.42 C ATOM 693 OE1 GLN U 78 -22.680 25.450 -25.269 1.00 57.01 O ATOM 694 NE2 GLN U 78 -23.600 23.434 -25.689 1.00 62.03 N ATOM 695 HE22 GLN U 78 -23.507 22.399 -25.637 1.00 0.00 H ATOM 696 HE21 GLN U 78 -24.456 23.859 -26.099 1.00 0.00 H ATOM 697 H GLN U 78 -19.888 24.414 -20.943 1.00 0.00 H ATOM 698 N GLY U 79 -18.022 23.826 -24.866 1.00 61.88 N ATOM 699 CA GLY U 79 -17.007 24.403 -25.730 1.00 64.61 C ATOM 700 C GLY U 79 -15.568 24.264 -25.251 1.00 66.01 C ATOM 701 O GLY U 79 -14.659 24.772 -25.903 1.00 70.21 O ATOM 702 H GLY U 79 -18.370 22.868 -25.075 1.00 0.00 H ATOM 703 N GLU U 80 -15.331 23.571 -24.141 1.00 64.10 N ATOM 704 CA GLU U 80 -13.960 23.404 -23.650 1.00 65.12 C ATOM 705 C GLU U 80 -13.119 22.390 -24.472 1.00 63.49 C ATOM 706 O GLU U 80 -13.657 21.640 -25.293 1.00 60.22 O ATOM 707 CB GLU U 80 -13.965 23.051 -22.154 1.00 65.44 C ATOM 708 CG GLU U 80 -14.308 21.615 -21.820 1.00 63.47 C ATOM 709 CD GLU U 80 -14.452 21.384 -20.340 1.00 62.57 C ATOM 710 OE1 GLU U 80 -13.917 22.176 -19.536 1.00 62.61 O ATOM 711 OE2 GLU U 80 -15.088 20.386 -19.983 1.00 63.83 O ATOM 712 H GLU U 80 -16.123 23.145 -23.618 1.00 0.00 H ATOM 713 N MET U 81 -11.802 22.412 -24.237 1.00 62.84 N ATOM 714 CA MET U 81 -10.836 21.476 -24.825 1.00 60.86 C ATOM 715 C MET U 81 -9.795 21.069 -23.801 1.00 59.06 C ATOM 716 O MET U 81 -9.233 21.921 -23.128 1.00 59.29 O ATOM 717 CB MET U 81 -10.089 22.120 -25.977 1.00 63.54 C ATOM 718 CG MET U 81 -10.777 22.030 -27.325 1.00 64.56 C ATOM 719 SD MET U 81 -9.614 22.383 -28.666 1.00 67.49 S ATOM 720 CE MET U 81 -9.335 24.127 -28.372 1.00 68.18 C ATOM 721 H MET U 81 -11.437 23.143 -23.593 1.00 0.00 H ATOM 722 N LYS U 82 -9.505 19.772 -23.751 1.00 60.38 N ATOM 723 CA LYS U 82 -8.638 19.156 -22.741 1.00 62.35 C ATOM 724 C LYS U 82 -7.318 18.766 -23.398 1.00 61.93 C ATOM 725 O LYS U 82 -7.310 18.249 -24.521 1.00 61.69 O ATOM 726 CB LYS U 82 -9.347 17.921 -22.171 1.00 65.38 C ATOM 727 CG LYS U 82 -8.594 17.074 -21.157 1.00 67.98 C ATOM 728 CD LYS U 82 -9.380 15.797 -20.864 1.00 72.64 C ATOM 729 CE LYS U 82 -8.847 15.077 -19.634 1.00 78.84 C ATOM 730 NZ LYS U 82 -9.521 13.775 -19.363 1.00 82.36 N ATOM 731 HZ1 LYS U 82 -10.537 13.937 -19.212 1.00 0.00 H ATOM 732 HZ2 LYS U 82 -9.387 13.141 -20.176 1.00 0.00 H ATOM 733 HZ3 LYS U 82 -9.107 13.342 -18.513 1.00 0.00 H ATOM 734 H LYS U 82 -9.921 19.153 -24.476 1.00 0.00 H ATOM 735 N PHE U 83 -6.212 19.004 -22.691 1.00 61.78 N ATOM 736 CA PHE U 83 -4.872 18.805 -23.234 1.00 59.20 C ATOM 737 C PHE U 83 -3.940 18.142 -22.248 1.00 60.63 C ATOM 738 O PHE U 83 -4.005 18.390 -21.048 1.00 57.28 O ATOM 739 CB PHE U 83 -4.251 20.132 -23.632 1.00 57.01 C ATOM 740 CG PHE U 83 -4.954 20.814 -24.752 1.00 55.84 C ATOM 741 CD1 PHE U 83 -4.603 20.552 -26.073 1.00 54.97 C ATOM 742 CD2 PHE U 83 -5.973 21.727 -24.493 1.00 56.63 C ATOM 743 CE1 PHE U 83 -5.257 21.194 -27.116 1.00 56.52 C ATOM 744 CE2 PHE U 83 -6.635 22.367 -25.532 1.00 56.43 C ATOM 745 CZ PHE U 83 -6.276 22.099 -26.845 1.00 56.78 C ATOM 746 H PHE U 83 -6.309 19.345 -21.713 1.00 0.00 H ATOM 747 N GLU U 84 -3.050 17.324 -22.793 1.00 68.80 N ATOM 748 CA GLU U 84 -1.958 16.734 -22.047 1.00 73.76 C ATOM 749 C GLU U 84 -0.754 17.610 -22.276 1.00 75.12 C ATOM 750 O GLU U 84 -0.651 18.308 -23.297 1.00 76.29 O ATOM 751 CB GLU U 84 -1.668 15.342 -22.563 1.00 79.44 C ATOM 752 CG GLU U 84 -2.902 14.464 -22.592 1.00 88.14 C ATOM 753 CD GLU U 84 -2.624 13.097 -23.163 1.00 96.65 C ATOM 754 OE1 GLU U 84 -3.061 12.102 -22.539 1.00104.61 O ATOM 755 OE2 GLU U 84 -1.973 13.022 -24.234 1.00100.58 O ATOM 756 H GLU U 84 -3.140 17.095 -23.804 1.00 0.00 H ATOM 757 N VAL U 85 0.170 17.555 -21.331 1.00 72.65 N ATOM 758 CA VAL U 85 1.366 18.370 -21.400 1.00 68.93 C ATOM 759 C VAL U 85 2.412 17.593 -22.189 1.00 64.36 C ATOM 760 O VAL U 85 2.924 16.583 -21.709 1.00 62.76 O ATOM 761 CB VAL U 85 1.876 18.701 -19.993 1.00 70.32 C ATOM 762 CG1 VAL U 85 3.104 19.603 -20.074 1.00 72.94 C ATOM 763 CG2 VAL U 85 0.764 19.348 -19.174 1.00 69.89 C ATOM 764 H VAL U 85 0.035 16.914 -20.523 1.00 0.00 H ATOM 765 N GLU U 86 2.689 18.039 -23.410 1.00 60.55 N ATOM 766 CA GLU U 86 3.717 17.421 -24.245 1.00 62.33 C ATOM 767 C GLU U 86 5.104 17.701 -23.684 1.00 69.44 C ATOM 768 O GLU U 86 5.991 16.847 -23.775 1.00 73.83 O ATOM 769 CB GLU U 86 3.633 17.931 -25.677 1.00 59.94 C ATOM 770 CG GLU U 86 4.689 17.377 -26.617 1.00 58.39 C ATOM 771 CD GLU U 86 4.545 17.895 -28.035 1.00 61.20 C ATOM 772 OE1 GLU U 86 3.510 18.521 -28.345 1.00 62.55 O ATOM 773 OE2 GLU U 86 5.469 17.674 -28.852 1.00 64.54 O ATOM 774 H GLU U 86 2.158 18.852 -23.782 1.00 0.00 H ATOM 775 N ASN U 87 5.287 18.902 -23.129 1.00 70.41 N ATOM 776 CA ASN U 87 6.547 19.307 -22.502 1.00 67.79 C ATOM 777 C ASN U 87 6.298 20.272 -21.368 1.00 62.16 C ATOM 778 O ASN U 87 5.501 21.190 -21.500 1.00 59.99 O ATOM 779 CB ASN U 87 7.451 19.998 -23.511 1.00 70.84 C ATOM 780 CG ASN U 87 7.871 19.082 -24.632 1.00 74.23 C ATOM 781 OD1 ASN U 87 8.359 17.961 -24.403 1.00 72.91 O ATOM 782 ND2 ASN U 87 7.683 19.547 -25.857 1.00 76.34 N ATOM 783 HD22 ASN U 87 7.271 20.492 -25.997 1.00 0.00 H ATOM 784 HD21 ASN U 87 7.947 18.968 -26.679 1.00 0.00 H ATOM 785 H ASN U 87 4.499 19.580 -23.143 1.00 0.00 H ATOM 786 N LEU U 88 7.002 20.073 -20.264 1.00 58.48 N ATOM 787 CA LEU U 88 6.921 20.966 -19.126 1.00 53.90 C ATOM 788 C LEU U 88 8.294 21.599 -18.959 1.00 53.77 C ATOM 789 O LEU U 88 9.279 20.899 -18.729 1.00 54.14 O ATOM 790 CB LEU U 88 6.512 20.179 -17.886 1.00 51.49 C ATOM 791 CG LEU U 88 6.462 20.916 -16.553 1.00 51.21 C ATOM 792 CD1 LEU U 88 5.609 22.177 -16.642 1.00 52.01 C ATOM 793 CD2 LEU U 88 5.929 19.963 -15.494 1.00 51.18 C ATOM 794 H LEU U 88 7.634 19.249 -20.212 1.00 0.00 H ATOM 795 N ILE U 89 8.352 22.922 -19.087 1.00 52.74 N ATOM 796 CA ILE U 89 9.611 23.655 -19.081 1.00 51.67 C ATOM 797 C ILE U 89 9.629 24.648 -17.923 1.00 51.34 C ATOM 798 O ILE U 89 9.028 25.712 -18.020 1.00 51.69 O ATOM 799 CB ILE U 89 9.837 24.383 -20.430 1.00 51.19 C ATOM 800 CG1 ILE U 89 9.909 23.362 -21.572 1.00 50.60 C ATOM 801 CG2 ILE U 89 11.120 25.212 -20.389 1.00 52.49 C ATOM 802 CD1 ILE U 89 9.890 23.967 -22.956 1.00 49.64 C ATOM 803 H ILE U 89 7.465 23.453 -19.196 1.00 0.00 H ATOM 804 N LEU U 90 10.337 24.292 -16.848 1.00 51.92 N ATOM 805 CA LEU U 90 10.503 25.160 -15.669 1.00 53.02 C ATOM 806 C LEU U 90 11.759 26.007 -15.838 1.00 56.18 C ATOM 807 O LEU U 90 12.640 25.643 -16.611 1.00 64.99 O ATOM 808 CB LEU U 90 10.582 24.328 -14.398 1.00 51.32 C ATOM 809 CG LEU U 90 9.568 23.180 -14.315 1.00 54.04 C ATOM 810 CD1 LEU U 90 9.481 22.626 -12.894 1.00 52.37 C ATOM 811 CD2 LEU U 90 8.180 23.577 -14.830 1.00 54.64 C ATOM 812 H LEU U 90 10.793 23.357 -16.843 1.00 0.00 H ATOM 813 N HIS U 91 11.840 27.140 -15.144 1.00 55.95 N ATOM 814 CA HIS U 91 12.897 28.117 -15.416 1.00 56.04 C ATOM 815 C HIS U 91 14.134 27.749 -14.633 1.00 60.67 C ATOM 816 O HIS U 91 14.109 27.777 -13.406 1.00 63.63 O ATOM 817 CB HIS U 91 12.452 29.528 -15.047 1.00 54.97 C ATOM 818 CG HIS U 91 13.358 30.596 -15.567 1.00 52.02 C ATOM 819 ND1 HIS U 91 14.550 30.918 -14.963 1.00 50.92 N ATOM 820 CD2 HIS U 91 13.242 31.421 -16.629 1.00 51.30 C ATOM 821 CE1 HIS U 91 15.134 31.891 -15.635 1.00 50.58 C ATOM 822 NE2 HIS U 91 14.365 32.208 -16.658 1.00 51.40 N ATOM 823 H HIS U 91 11.142 27.334 -14.398 1.00 0.00 H ATOM 824 N LYS U 92 15.207 27.415 -15.348 1.00 66.06 N ATOM 825 CA LYS U 92 16.455 26.902 -14.748 1.00 69.99 C ATOM 826 C LYS U 92 16.927 27.663 -13.494 1.00 67.19 C ATOM 827 O LYS U 92 17.246 27.057 -12.471 1.00 71.09 O ATOM 828 CB LYS U 92 17.580 26.798 -15.807 1.00 75.92 C ATOM 829 CG LYS U 92 17.934 28.090 -16.547 1.00 81.56 C ATOM 830 CD LYS U 92 18.734 27.832 -17.826 1.00 84.94 C ATOM 831 CE LYS U 92 18.484 28.903 -18.885 1.00 84.86 C ATOM 832 NZ LYS U 92 18.680 30.274 -18.336 1.00 86.89 N ATOM 833 HZ1 LYS U 92 18.018 30.429 -17.549 1.00 0.00 H ATOM 834 HZ2 LYS U 92 19.657 30.372 -17.993 1.00 0.00 H ATOM 835 HZ3 LYS U 92 18.502 30.974 -19.084 1.00 0.00 H ATOM 836 H LYS U 92 15.164 27.521 -16.382 1.00 0.00 H ATOM 837 N ASP U 93 16.933 28.983 -13.562 1.00 63.67 N ATOM 838 CA ASP U 93 17.344 29.814 -12.424 1.00 65.44 C ATOM 839 C ASP U 93 16.260 30.077 -11.367 1.00 60.81 C ATOM 840 O ASP U 93 16.415 30.965 -10.541 1.00 55.54 O ATOM 841 CB ASP U 93 17.905 31.144 -12.948 1.00 70.58 C ATOM 842 CG ASP U 93 19.028 30.940 -13.951 1.00 72.76 C ATOM 843 OD1 ASP U 93 19.941 30.158 -13.620 1.00 74.46 O ATOM 844 OD2 ASP U 93 18.988 31.532 -15.060 1.00 70.31 O ATOM 845 H ASP U 93 16.639 29.445 -14.446 1.00 0.00 H ATOM 846 N TYR U 94 15.178 29.305 -11.368 1.00 62.56 N ATOM 847 CA TYR U 94 14.146 29.441 -10.342 1.00 64.49 C ATOM 848 C TYR U 94 14.709 29.236 -8.929 1.00 68.06 C ATOM 849 O TYR U 94 15.659 28.477 -8.742 1.00 70.74 O ATOM 850 CB TYR U 94 12.988 28.465 -10.594 1.00 64.56 C ATOM 851 CG TYR U 94 12.037 28.347 -9.427 1.00 64.99 C ATOM 852 CD1 TYR U 94 11.068 29.316 -9.199 1.00 66.79 C ATOM 853 CD2 TYR U 94 12.127 27.279 -8.532 1.00 63.75 C ATOM 854 CE1 TYR U 94 10.207 29.225 -8.119 1.00 70.82 C ATOM 855 CE2 TYR U 94 11.268 27.172 -7.452 1.00 65.11 C ATOM 856 CZ TYR U 94 10.308 28.149 -7.247 1.00 70.64 C ATOM 857 OH TYR U 94 9.441 28.062 -6.180 1.00 72.49 O ATOM 858 HH TYR U 94 8.829 28.840 -6.190 1.00 0.00 H ATOM 859 H TYR U 94 15.063 28.590 -12.114 1.00 0.00 H ATOM 860 N SER U 95 14.134 29.934 -7.950 1.00 73.57 N ATOM 861 CA SER U 95 14.472 29.713 -6.540 1.00 75.12 C ATOM 862 C SER U 95 13.346 30.136 -5.600 1.00 73.15 C ATOM 863 O SER U 95 12.675 31.134 -5.834 1.00 69.19 O ATOM 864 CB SER U 95 15.754 30.455 -6.152 1.00 78.34 C ATOM 865 OG SER U 95 15.457 31.754 -5.668 1.00 83.43 O ATOM 866 HG SER U 95 14.875 31.683 -4.870 1.00 0.00 H ATOM 867 H SER U 95 13.426 30.656 -8.193 1.00 0.00 H ATOM 868 N ALA U 96 13.173 29.419 -4.515 1.00 76.45 N ATOM 869 CA ALA U 96 12.170 29.811 -3.580 1.00 77.71 C ATOM 870 C ALA U 96 12.804 30.413 -2.358 1.00 83.42 C ATOM 871 O ALA U 96 13.527 29.761 -1.624 1.00 83.09 O ATOM 872 CB ALA U 96 11.352 28.617 -3.197 1.00 78.34 C ATOM 873 H ALA U 96 13.758 28.578 -4.339 1.00 0.00 H ATOM 874 N ASP U 97 12.498 31.681 -2.155 1.00 89.60 N ATOM 875 CA ASP U 97 12.876 32.418 -0.980 1.00 92.95 C ATOM 876 C ASP U 97 11.797 32.013 -0.054 1.00 90.88 C ATOM 877 O ASP U 97 10.916 31.288 -0.472 1.00 86.71 O ATOM 878 CB ASP U 97 12.806 33.907 -1.253 1.00 96.51 C ATOM 879 CG ASP U 97 13.122 34.724 -0.048 1.00 97.89 C ATOM 880 OD1 ASP U 97 12.815 34.254 1.064 1.00101.67 O ATOM 881 OD2 ASP U 97 13.669 35.829 -0.217 1.00 89.19 O ATOM 882 H ASP U 97 11.951 32.176 -2.888 1.00 0.00 H ATOM 883 N THR U 97A 11.848 32.441 1.196 1.00 95.28 N ATOM 884 CA THR U 97A 10.836 32.000 2.128 1.00102.96 C ATOM 885 C THR U 97A 9.500 32.440 1.587 1.00104.12 C ATOM 886 O THR U 97A 8.551 31.670 1.547 1.00108.41 O ATOM 887 CB THR U 97A 10.986 32.685 3.477 1.00102.25 C ATOM 888 OG1 THR U 97A 12.324 33.170 3.613 1.00109.04 O ATOM 889 CG2 THR U 97A 10.665 31.720 4.587 1.00 97.15 C ATOM 890 HG1 THR U 97A 12.514 33.817 2.888 1.00 0.00 H ATOM 891 H THR U 97A 12.605 33.085 1.503 1.00 0.00 H ATOM 892 N LEU U 97B 9.439 33.681 1.142 1.00 96.44 N ATOM 893 CA LEU U 97B 8.225 34.215 0.579 1.00 86.93 C ATOM 894 C LEU U 97B 8.314 34.275 -0.915 1.00 76.44 C ATOM 895 O LEU U 97B 7.405 33.921 -1.610 1.00 70.27 O ATOM 896 CB LEU U 97B 8.014 35.612 1.117 1.00 90.13 C ATOM 897 CG LEU U 97B 6.629 35.982 1.619 1.00 93.33 C ATOM 898 CD1 LEU U 97B 5.862 34.763 2.087 1.00 90.74 C ATOM 899 CD2 LEU U 97B 6.754 37.021 2.710 1.00 92.83 C ATOM 900 H LEU U 97B 10.284 34.285 1.199 1.00 0.00 H ATOM 901 N ALA U 98 9.445 34.733 -1.399 1.00 70.70 N ATOM 902 CA ALA U 98 9.598 35.063 -2.776 1.00 69.85 C ATOM 903 C ALA U 98 9.823 33.870 -3.616 1.00 69.00 C ATOM 904 O ALA U 98 10.309 32.875 -3.150 1.00 74.60 O ATOM 905 CB ALA U 98 10.768 35.991 -2.924 1.00 74.83 C ATOM 906 H ALA U 98 10.254 34.859 -0.757 1.00 0.00 H ATOM 907 N HIS U 99 9.473 33.987 -4.880 1.00 68.76 N ATOM 908 CA HIS U 99 9.777 32.959 -5.865 1.00 69.62 C ATOM 909 C HIS U 99 10.444 33.658 -7.036 1.00 71.65 C ATOM 910 O HIS U 99 9.847 34.534 -7.661 1.00 80.95 O ATOM 911 CB HIS U 99 8.507 32.281 -6.341 1.00 69.22 C ATOM 912 CG HIS U 99 7.851 31.442 -5.299 1.00 71.86 C ATOM 913 ND1 HIS U 99 8.193 30.128 -5.082 1.00 77.43 N ATOM 914 CD2 HIS U 99 6.866 31.726 -4.417 1.00 71.41 C ATOM 915 CE1 HIS U 99 7.446 29.636 -4.110 1.00 76.63 C ATOM 916 NE2 HIS U 99 6.632 30.587 -3.689 1.00 71.90 N ATOM 917 H HIS U 99 8.963 34.841 -5.184 1.00 0.00 H ATOM 918 N HIS U 100 11.675 33.269 -7.330 1.00 69.72 N ATOM 919 CA HIS U 100 12.509 33.980 -8.281 1.00 66.28 C ATOM 920 C HIS U 100 12.408 33.243 -9.587 1.00 62.38 C ATOM 921 O HIS U 100 12.464 32.028 -9.586 1.00 58.61 O ATOM 922 CB HIS U 100 13.946 34.002 -7.777 1.00 70.37 C ATOM 923 CG HIS U 100 14.118 34.793 -6.518 1.00 75.12 C ATOM 924 ND1 HIS U 100 15.102 35.745 -6.368 1.00 77.64 N ATOM 925 CD2 HIS U 100 13.409 34.799 -5.361 1.00 78.21 C ATOM 926 CE1 HIS U 100 14.997 36.297 -5.172 1.00 80.59 C ATOM 927 NE2 HIS U 100 13.979 35.740 -4.540 1.00 79.31 N ATOM 928 H HIS U 100 12.058 32.423 -6.862 1.00 0.00 H ATOM 929 N ASN U 101 12.237 33.984 -10.685 1.00 62.56 N ATOM 930 CA ASN U 101 12.047 33.419 -12.040 1.00 59.55 C ATOM 931 C ASN U 101 10.922 32.420 -12.084 1.00 55.30 C ATOM 932 O ASN U 101 11.062 31.314 -12.602 1.00 55.90 O ATOM 933 CB ASN U 101 13.336 32.787 -12.544 1.00 59.82 C ATOM 934 CG ASN U 101 14.513 33.686 -12.336 1.00 58.85 C ATOM 935 OD1 ASN U 101 14.583 34.758 -12.923 1.00 59.68 O ATOM 936 ND2 ASN U 101 15.420 33.282 -11.463 1.00 58.71 N ATOM 937 HD22 ASN U 101 15.314 32.361 -10.991 1.00 0.00 H ATOM 938 HD21 ASN U 101 16.240 33.885 -11.248 1.00 0.00 H ATOM 939 H ASN U 101 12.237 35.019 -10.582 1.00 0.00 H ATOM 940 N ASP U 102 9.805 32.827 -11.507 1.00 52.00 N ATOM 941 CA ASP U 102 8.722 31.921 -11.215 1.00 49.01 C ATOM 942 C ASP U 102 7.887 31.914 -12.469 1.00 46.52 C ATOM 943 O ASP U 102 6.903 32.649 -12.588 1.00 47.46 O ATOM 944 CB ASP U 102 7.966 32.426 -9.987 1.00 49.09 C ATOM 945 CG ASP U 102 6.891 31.476 -9.510 1.00 50.38 C ATOM 946 OD1 ASP U 102 6.979 30.241 -9.729 1.00 50.02 O ATOM 947 OD2 ASP U 102 5.945 31.994 -8.880 1.00 51.47 O ATOM 948 H ASP U 102 9.704 33.831 -11.256 1.00 0.00 H ATOM 949 N ILE U 103 8.330 31.102 -13.422 1.00 43.62 N ATOM 950 CA ILE U 103 7.796 31.124 -14.778 1.00 44.02 C ATOM 951 C ILE U 103 7.959 29.758 -15.419 1.00 41.96 C ATOM 952 O ILE U 103 9.027 29.162 -15.344 1.00 39.54 O ATOM 953 CB ILE U 103 8.467 32.239 -15.642 1.00 46.93 C ATOM 954 CG1 ILE U 103 7.722 32.422 -16.976 1.00 49.54 C ATOM 955 CG2 ILE U 103 9.956 31.985 -15.896 1.00 46.29 C ATOM 956 CD1 ILE U 103 8.004 33.733 -17.692 1.00 48.91 C ATOM 957 H ILE U 103 9.086 30.426 -13.192 1.00 0.00 H ATOM 958 N ALA U 104 6.894 29.273 -16.048 1.00 41.25 N ATOM 959 CA ALA U 104 6.871 27.937 -16.622 1.00 41.17 C ATOM 960 C ALA U 104 6.233 27.979 -18.000 1.00 42.43 C ATOM 961 O ALA U 104 5.344 28.785 -18.234 1.00 40.70 O ATOM 962 CB ALA U 104 6.102 26.999 -15.705 1.00 39.80 C ATOM 963 H ALA U 104 6.047 29.870 -16.133 1.00 0.00 H ATOM 964 N LEU U 105 6.692 27.111 -18.900 1.00 47.06 N ATOM 965 CA LEU U 105 6.048 26.900 -20.204 1.00 52.08 C ATOM 966 C LEU U 105 5.562 25.470 -20.343 1.00 52.83 C ATOM 967 O LEU U 105 6.307 24.527 -20.057 1.00 54.98 O ATOM 968 CB LEU U 105 7.011 27.204 -21.357 1.00 56.53 C ATOM 969 CG LEU U 105 7.214 28.681 -21.724 1.00 59.66 C ATOM 970 CD1 LEU U 105 8.427 28.887 -22.639 1.00 58.66 C ATOM 971 CD2 LEU U 105 5.941 29.265 -22.337 1.00 60.34 C ATOM 972 H LEU U 105 7.543 26.559 -18.670 1.00 0.00 H ATOM 973 N LEU U 106 4.319 25.325 -20.798 1.00 52.53 N ATOM 974 CA LEU U 106 3.729 24.030 -21.063 1.00 53.93 C ATOM 975 C LEU U 106 3.382 23.939 -22.529 1.00 55.64 C ATOM 976 O LEU U 106 2.644 24.780 -23.050 1.00 55.56 O ATOM 977 CB LEU U 106 2.469 23.828 -20.234 1.00 54.73 C ATOM 978 CG LEU U 106 2.661 23.637 -18.727 1.00 57.34 C ATOM 979 CD1 LEU U 106 2.873 24.953 -17.980 1.00 60.38 C ATOM 980 CD2 LEU U 106 1.464 22.897 -18.155 1.00 57.00 C ATOM 981 H LEU U 106 3.749 26.177 -20.970 1.00 0.00 H ATOM 982 N LYS U 107 3.928 22.926 -23.194 1.00 59.64 N ATOM 983 CA LYS U 107 3.504 22.572 -24.541 1.00 61.42 C ATOM 984 C LYS U 107 2.316 21.632 -24.435 1.00 61.15 C ATOM 985 O LYS U 107 2.416 20.564 -23.818 1.00 61.28 O ATOM 986 CB LYS U 107 4.622 21.900 -25.340 1.00 61.43 C ATOM 987 CG LYS U 107 4.274 21.756 -26.812 1.00 61.04 C ATOM 988 CD LYS U 107 5.501 21.679 -27.697 1.00 61.51 C ATOM 989 CE LYS U 107 5.200 22.226 -29.076 1.00 63.00 C ATOM 990 NZ LYS U 107 6.282 21.896 -30.033 1.00 65.59 N ATOM 991 HZ1 LYS U 107 7.176 22.310 -29.700 1.00 0.00 H ATOM 992 HZ2 LYS U 107 6.381 20.863 -30.100 1.00 0.00 H ATOM 993 HZ3 LYS U 107 6.046 22.284 -30.968 1.00 0.00 H ATOM 994 H LYS U 107 4.680 22.370 -22.739 1.00 0.00 H ATOM 995 N ILE U 108 1.207 22.028 -25.054 1.00 60.33 N ATOM 996 CA ILE U 108 -0.036 21.274 -24.974 1.00 61.39 C ATOM 997 C ILE U 108 -0.284 20.484 -26.258 1.00 65.02 C ATOM 998 O ILE U 108 0.010 20.957 -27.357 1.00 60.93 O ATOM 999 CB ILE U 108 -1.248 22.190 -24.655 1.00 60.95 C ATOM 1000 CG1 ILE U 108 -1.532 23.201 -25.778 1.00 63.56 C ATOM 1001 CG2 ILE U 108 -1.043 22.914 -23.333 1.00 59.82 C ATOM 1002 CD1 ILE U 108 -2.717 24.102 -25.515 1.00 64.85 C ATOM 1003 H ILE U 108 1.229 22.905 -25.613 1.00 0.00 H ATOM 1004 N ARG U 109 -0.790 19.265 -26.104 1.00 73.40 N ATOM 1005 CA ARG U 109 -1.416 18.548 -27.216 1.00 82.71 C ATOM 1006 C ARG U 109 -2.438 17.547 -26.671 1.00 81.19 C ATOM 1007 O ARG U 109 -2.266 16.968 -25.583 1.00 72.44 O ATOM 1008 CB ARG U 109 -0.382 17.868 -28.150 1.00 91.40 C ATOM 1009 CG ARG U 109 -0.050 16.411 -27.824 1.00101.67 C ATOM 1010 CD ARG U 109 1.160 15.877 -28.581 1.00110.39 C ATOM 1011 NE ARG U 109 1.875 14.867 -27.787 1.00122.32 N ATOM 1012 CZ ARG U 109 3.118 14.424 -28.018 1.00130.67 C ATOM 1013 NH1 ARG U 109 3.842 14.874 -29.047 1.00135.67 N ATOM 1014 NH2 ARG U 109 3.653 13.514 -27.204 1.00128.49 N ATOM 1015 HE ARG U 109 1.371 14.460 -26.973 1.00 0.00 H ATOM 1016 HH12 ARG U 109 4.805 14.513 -29.203 1.00 0.00 H ATOM 1017 HH11 ARG U 109 3.443 15.586 -29.692 1.00 0.00 H ATOM 1018 HH22 ARG U 109 4.617 13.165 -27.376 1.00 0.00 H ATOM 1019 HH21 ARG U 109 3.106 13.153 -26.396 1.00 0.00 H ATOM 1020 H ARG U 109 -0.740 18.809 -25.171 1.00 0.00 H ATOM 1021 N SER U 110 -3.487 17.355 -27.462 1.00 80.31 N ATOM 1022 CA SER U 110 -4.605 16.489 -27.126 1.00 78.82 C ATOM 1023 C SER U 110 -4.251 15.026 -27.348 1.00 79.39 C ATOM 1024 O SER U 110 -3.156 14.710 -27.825 1.00 79.08 O ATOM 1025 CB SER U 110 -5.785 16.858 -28.020 1.00 79.46 C ATOM 1026 OG SER U 110 -5.388 16.792 -29.381 1.00 79.72 O ATOM 1027 HG SER U 110 -4.644 17.426 -29.538 1.00 0.00 H ATOM 1028 H SER U 110 -3.510 17.853 -28.375 1.00 0.00 H ATOM 1029 N LYS U 110A -5.192 14.137 -27.030 1.00 80.86 N ATOM 1030 CA LYS U 110A -5.059 12.710 -27.366 1.00 81.29 C ATOM 1031 C LYS U 110A -4.947 12.482 -28.880 1.00 78.00 C ATOM 1032 O LYS U 110A -4.291 11.541 -29.309 1.00 80.70 O ATOM 1033 CB LYS U 110A -6.208 11.866 -26.771 1.00 86.30 C ATOM 1034 CG LYS U 110A -5.975 11.407 -25.328 1.00 92.29 C ATOM 1035 CD LYS U 110A -7.001 10.371 -24.858 1.00 96.59 C ATOM 1036 CE LYS U 110A -6.637 9.749 -23.504 1.00 96.70 C ATOM 1037 NZ LYS U 110A -7.347 8.458 -23.241 1.00 96.05 N ATOM 1038 HZ1 LYS U 110A -8.374 8.621 -23.248 1.00 0.00 H ATOM 1039 HZ2 LYS U 110A -7.099 7.771 -23.981 1.00 0.00 H ATOM 1040 HZ3 LYS U 110A -7.059 8.088 -22.312 1.00 0.00 H ATOM 1041 H LYS U 110A -6.045 14.461 -26.530 1.00 0.00 H ATOM 1042 N GLU U 110B -5.543 13.364 -29.681 1.00 76.27 N ATOM 1043 CA GLU U 110B -5.430 13.286 -31.145 1.00 79.55 C ATOM 1044 C GLU U 110B -4.178 14.016 -31.654 1.00 75.82 C ATOM 1045 O GLU U 110B -3.993 14.149 -32.868 1.00 75.26 O ATOM 1046 CB GLU U 110B -6.676 13.854 -31.860 1.00 85.27 C ATOM 1047 CG GLU U 110B -8.023 13.625 -31.170 1.00 87.43 C ATOM 1048 CD GLU U 110B -8.425 14.774 -30.243 1.00 88.05 C ATOM 1049 OE1 GLU U 110B -8.392 15.949 -30.681 1.00 84.50 O ATOM 1050 OE2 GLU U 110B -8.781 14.498 -29.073 1.00 87.17 O ATOM 1051 H GLU U 110B -6.105 14.130 -29.258 1.00 0.00 H ATOM 1052 N GLY U 110C -3.340 14.499 -30.735 1.00 71.24 N ATOM 1053 CA GLY U 110C -2.084 15.133 -31.073 1.00 70.13 C ATOM 1054 C GLY U 110C -2.248 16.440 -31.806 1.00 69.44 C ATOM 1055 O GLY U 110C -1.580 16.672 -32.801 1.00 67.68 O ATOM 1056 H GLY U 110C -3.601 14.416 -29.732 1.00 0.00 H ATOM 1057 N ARG U 110D -3.152 17.289 -31.334 1.00 74.26 N ATOM 1058 CA ARG U 110D -3.307 18.625 -31.907 1.00 79.22 C ATOM 1059 C ARG U 110D -3.349 19.684 -30.810 1.00 75.36 C ATOM 1060 O ARG U 110D -3.736 19.403 -29.665 1.00 68.22 O ATOM 1061 CB ARG U 110D -4.557 18.717 -32.792 1.00 85.94 C ATOM 1062 CG ARG U 110D -4.736 17.549 -33.758 1.00 93.54 C ATOM 1063 CD ARG U 110D -5.501 17.925 -35.023 1.00101.38 C ATOM 1064 NE ARG U 110D -6.512 16.924 -35.377 1.00109.96 N ATOM 1065 CZ ARG U 110D -6.271 15.689 -35.834 1.00116.96 C ATOM 1066 NH1 ARG U 110D -5.027 15.237 -36.012 1.00118.91 N ATOM 1067 NH2 ARG U 110D -7.297 14.885 -36.114 1.00117.15 N ATOM 1068 HE ARG U 110D -7.508 17.199 -35.263 1.00 0.00 H ATOM 1069 HH12 ARG U 110D -4.870 14.273 -36.369 1.00 0.00 H ATOM 1070 HH11 ARG U 110D -4.215 15.849 -35.794 1.00 0.00 H ATOM 1071 HH22 ARG U 110D -7.122 13.923 -36.470 1.00 0.00 H ATOM 1072 HH21 ARG U 110D -8.272 15.219 -35.977 1.00 0.00 H ATOM 1073 H ARG U 110D -3.761 16.999 -30.542 1.00 0.00 H ATOM 1074 N CYS U 111 -2.928 20.894 -31.184 1.00 69.60 N ATOM 1075 CA CYS U 111 -2.954 22.059 -30.302 1.00 66.17 C ATOM 1076 C CYS U 111 -4.365 22.663 -30.269 1.00 66.50 C ATOM 1077 O CYS U 111 -5.313 22.064 -30.774 1.00 64.85 O ATOM 1078 CB CYS U 111 -1.914 23.075 -30.771 1.00 61.31 C ATOM 1079 SG CYS U 111 -0.268 22.404 -30.609 1.00 58.00 S ATOM 1080 H CYS U 111 -2.564 21.014 -32.151 1.00 0.00 H ATOM 1081 N ALA U 112 -4.508 23.835 -29.701 1.00 67.26 N ATOM 1082 CA ALA U 112 -5.801 24.468 -29.639 1.00 68.78 C ATOM 1083 C ALA U 112 -6.319 25.028 -30.945 1.00 68.92 C ATOM 1084 O ALA U 112 -5.569 25.434 -31.816 1.00 59.23 O ATOM 1085 CB ALA U 112 -5.797 25.541 -28.584 1.00 68.26 C ATOM 1086 H ALA U 112 -3.680 24.313 -29.291 1.00 0.00 H ATOM 1087 N GLN U 113 -7.639 25.061 -31.038 1.00 73.54 N ATOM 1088 CA GLN U 113 -8.352 25.752 -32.089 1.00 78.44 C ATOM 1089 C GLN U 113 -9.046 26.954 -31.480 1.00 71.99 C ATOM 1090 O GLN U 113 -9.792 26.814 -30.524 1.00 62.34 O ATOM 1091 CB GLN U 113 -9.387 24.821 -32.699 1.00 87.94 C ATOM 1092 CG GLN U 113 -8.895 23.393 -32.842 1.00 99.27 C ATOM 1093 CD GLN U 113 -9.918 22.463 -33.472 1.00108.45 C ATOM 1094 OE1 GLN U 113 -10.776 21.904 -32.784 1.00109.50 O ATOM 1095 NE2 GLN U 113 -9.823 22.283 -34.788 1.00108.02 N ATOM 1096 HE22 GLN U 113 -9.083 22.775 -35.328 1.00 0.00 H ATOM 1097 HE21 GLN U 113 -10.489 21.650 -35.276 1.00 0.00 H ATOM 1098 H GLN U 113 -8.195 24.562 -30.314 1.00 0.00 H ATOM 1099 N PRO U 114 -8.738 28.193 -32.066 1.00 67.94 N ATOM 1100 CA PRO U 114 -9.386 29.330 -31.407 1.00 66.82 C ATOM 1101 C PRO U 114 -10.858 29.476 -31.690 1.00 65.59 C ATOM 1102 O PRO U 114 -11.313 29.390 -32.806 1.00 66.17 O ATOM 1103 CB PRO U 114 -8.631 30.543 -31.942 1.00 67.31 C ATOM 1104 CG PRO U 114 -7.360 30.021 -32.455 1.00 66.97 C ATOM 1105 CD PRO U 114 -7.832 28.811 -33.139 1.00 67.58 C ATOM 1106 N SER U 115 -11.590 29.743 -30.633 1.00 63.36 N ATOM 1107 CA SER U 115 -13.030 29.809 -30.646 1.00 62.35 C ATOM 1108 C SER U 115 -13.450 31.074 -29.924 1.00 63.08 C ATOM 1109 O SER U 115 -12.606 31.884 -29.552 1.00 61.27 O ATOM 1110 CB SER U 115 -13.586 28.571 -29.936 1.00 64.47 C ATOM 1111 OG SER U 115 -13.310 28.582 -28.546 1.00 63.85 O ATOM 1112 HG SER U 115 -13.686 27.766 -28.130 1.00 0.00 H ATOM 1113 H SER U 115 -11.101 29.917 -29.732 1.00 0.00 H ATOM 1114 N ARG U 116 -14.756 31.241 -29.733 1.00 68.89 N ATOM 1115 CA ARG U 116 -15.305 32.321 -28.905 1.00 71.98 C ATOM 1116 C ARG U 116 -14.781 32.237 -27.457 1.00 68.76 C ATOM 1117 O ARG U 116 -14.421 33.261 -26.867 1.00 64.93 O ATOM 1118 CB ARG U 116 -16.848 32.278 -28.938 1.00 76.22 C ATOM 1119 CG ARG U 116 -17.547 33.386 -28.147 1.00 78.07 C ATOM 1120 CD ARG U 116 -18.982 33.640 -28.609 1.00 78.74 C ATOM 1121 NE ARG U 116 -19.974 32.760 -27.985 1.00 80.66 N ATOM 1122 CZ ARG U 116 -21.268 32.712 -28.314 1.00 79.40 C ATOM 1123 NH1 ARG U 116 -21.766 33.490 -29.276 1.00 80.27 N ATOM 1124 NH2 ARG U 116 -22.079 31.869 -27.678 1.00 77.32 N ATOM 1125 HE ARG U 116 -19.646 32.125 -27.229 1.00 0.00 H ATOM 1126 HH12 ARG U 116 -22.776 33.437 -29.517 1.00 0.00 H ATOM 1127 HH11 ARG U 116 -21.144 34.150 -29.785 1.00 0.00 H ATOM 1128 HH22 ARG U 116 -23.087 31.827 -27.930 1.00 0.00 H ATOM 1129 HH21 ARG U 116 -21.704 31.252 -26.929 1.00 0.00 H ATOM 1130 H ARG U 116 -15.415 30.579 -30.189 1.00 0.00 H ATOM 1131 N THR U 117 -14.717 31.014 -26.918 1.00 63.29 N ATOM 1132 CA THR U 117 -14.288 30.767 -25.542 1.00 58.21 C ATOM 1133 C THR U 117 -12.779 30.521 -25.367 1.00 58.46 C ATOM 1134 O THR U 117 -12.324 30.324 -24.236 1.00 55.26 O ATOM 1135 CB THR U 117 -15.054 29.569 -24.963 1.00 58.01 C ATOM 1136 OG1 THR U 117 -14.858 28.417 -25.785 1.00 56.46 O ATOM 1137 CG2 THR U 117 -16.539 29.896 -24.861 1.00 57.87 C ATOM 1138 HG1 THR U 117 -15.356 27.652 -25.403 1.00 0.00 H ATOM 1139 H THR U 117 -14.985 30.199 -27.506 1.00 0.00 H ATOM 1140 N ILE U 118 -12.015 30.551 -26.469 1.00 60.06 N ATOM 1141 CA ILE U 118 -10.573 30.223 -26.483 1.00 59.62 C ATOM 1142 C ILE U 118 -9.790 31.123 -27.448 1.00 58.98 C ATOM 1143 O ILE U 118 -9.967 31.018 -28.655 1.00 61.52 O ATOM 1144 CB ILE U 118 -10.352 28.749 -26.911 1.00 61.67 C ATOM 1145 CG1 ILE U 118 -11.067 27.797 -25.930 1.00 59.65 C ATOM 1146 CG2 ILE U 118 -8.855 28.450 -27.053 1.00 64.83 C ATOM 1147 CD1 ILE U 118 -10.911 26.324 -26.226 1.00 58.26 C ATOM 1148 H ILE U 118 -12.464 30.821 -27.368 1.00 0.00 H ATOM 1149 N GLN U 119 -8.907 31.970 -26.919 1.00 60.75 N ATOM 1150 CA GLN U 119 -8.151 32.957 -27.718 1.00 62.23 C ATOM 1151 C GLN U 119 -6.843 33.291 -27.025 1.00 64.24 C ATOM 1152 O GLN U 119 -6.809 33.362 -25.811 1.00 70.78 O ATOM 1153 CB GLN U 119 -8.946 34.263 -27.876 1.00 63.23 C ATOM 1154 CG GLN U 119 -10.122 34.227 -28.846 1.00 66.62 C ATOM 1155 CD GLN U 119 -9.722 33.848 -30.269 1.00 69.13 C ATOM 1156 OE1 GLN U 119 -8.600 34.112 -30.708 1.00 70.30 O ATOM 1157 NE2 GLN U 119 -10.645 33.219 -30.993 1.00 70.21 N ATOM 1158 HE22 GLN U 119 -11.579 33.016 -30.583 1.00 0.00 H ATOM 1159 HE21 GLN U 119 -10.432 32.930 -31.969 1.00 0.00 H ATOM 1160 H GLN U 119 -8.742 31.934 -25.893 1.00 0.00 H ATOM 1161 N THR U 120 -5.773 33.519 -27.782 1.00 64.77 N ATOM 1162 CA THR U 120 -4.468 33.869 -27.184 1.00 62.05 C ATOM 1163 C THR U 120 -4.366 35.328 -26.681 1.00 57.67 C ATOM 1164 O THR U 120 -5.124 36.217 -27.093 1.00 57.63 O ATOM 1165 CB THR U 120 -3.297 33.594 -28.158 1.00 62.95 C ATOM 1166 OG1 THR U 120 -3.596 34.148 -29.445 1.00 68.97 O ATOM 1167 CG2 THR U 120 -3.053 32.106 -28.307 1.00 62.93 C ATOM 1168 HG1 THR U 120 -2.844 33.969 -30.063 1.00 0.00 H ATOM 1169 H THR U 120 -5.857 33.449 -28.816 1.00 0.00 H ATOM 1170 N ILE U 121 -3.398 35.545 -25.799 1.00 52.79 N ATOM 1171 CA ILE U 121 -3.090 36.858 -25.242 1.00 53.01 C ATOM 1172 C ILE U 121 -1.736 37.261 -25.786 1.00 53.11 C ATOM 1173 O ILE U 121 -0.855 36.423 -25.941 1.00 57.96 O ATOM 1174 CB ILE U 121 -3.071 36.843 -23.681 1.00 56.06 C ATOM 1175 CG1 ILE U 121 -2.907 38.257 -23.087 1.00 57.34 C ATOM 1176 CG2 ILE U 121 -1.984 35.925 -23.111 1.00 55.29 C ATOM 1177 CD1 ILE U 121 -4.128 39.145 -23.234 1.00 58.10 C ATOM 1178 H ILE U 121 -2.827 34.734 -25.487 1.00 0.00 H ATOM 1179 N ALA U 122 -1.559 38.539 -26.071 1.00 53.09 N ATOM 1180 CA ALA U 122 -0.283 39.020 -26.564 1.00 55.37 C ATOM 1181 C ALA U 122 0.661 39.324 -25.406 1.00 57.69 C ATOM 1182 O ALA U 122 0.229 39.596 -24.285 1.00 64.41 O ATOM 1183 CB ALA U 122 -0.481 40.249 -27.426 1.00 58.57 C ATOM 1184 H ALA U 122 -2.344 39.208 -25.940 1.00 0.00 H ATOM 1185 N LEU U 123 1.955 39.275 -25.703 1.00 58.01 N ATOM 1186 CA LEU U 123 3.013 39.544 -24.743 1.00 58.64 C ATOM 1187 C LEU U 123 3.500 40.952 -24.963 1.00 57.50 C ATOM 1188 O LEU U 123 3.415 41.447 -26.084 1.00 54.55 O ATOM 1189 CB LEU U 123 4.189 38.612 -24.998 1.00 62.92 C ATOM 1190 CG LEU U 123 3.933 37.121 -24.807 1.00 63.52 C ATOM 1191 CD1 LEU U 123 4.897 36.316 -25.664 1.00 62.19 C ATOM 1192 CD2 LEU U 123 4.062 36.764 -23.330 1.00 66.19 C ATOM 1193 H LEU U 123 2.226 39.031 -26.677 1.00 0.00 H ATOM 1194 N PRO U 124 4.069 41.584 -23.919 1.00 59.72 N ATOM 1195 CA PRO U 124 4.563 42.949 -24.077 1.00 60.77 C ATOM 1196 C PRO U 124 5.763 43.025 -25.019 1.00 65.96 C ATOM 1197 O PRO U 124 6.373 41.993 -25.333 1.00 66.01 O ATOM 1198 CB PRO U 124 4.988 43.323 -22.652 1.00 59.64 C ATOM 1199 CG PRO U 124 5.384 42.020 -22.046 1.00 59.35 C ATOM 1200 CD PRO U 124 4.353 41.067 -22.567 1.00 59.67 C ATOM 1201 N SER U 125 6.065 44.229 -25.462 1.00 70.36 N ATOM 1202 CA SER U 125 7.329 44.539 -26.059 1.00 69.60 C ATOM 1203 C SER U 125 8.277 44.720 -24.910 1.00 70.11 C ATOM 1204 O SER U 125 7.869 44.985 -23.805 1.00 62.75 O ATOM 1205 CB SER U 125 7.214 45.770 -26.921 1.00 70.50 C ATOM 1206 OG SER U 125 6.233 45.557 -27.917 1.00 72.60 O ATOM 1207 HG SER U 125 6.158 46.366 -28.483 1.00 0.00 H ATOM 1208 H SER U 125 5.356 44.985 -25.374 1.00 0.00 H ATOM 1209 N MET U 126 9.552 44.542 -25.163 1.00 78.77 N ATOM 1210 CA MET U 126 10.473 44.315 -24.089 1.00 86.00 C ATOM 1211 C MET U 126 10.549 45.470 -23.123 1.00 83.47 C ATOM 1212 O MET U 126 10.665 46.609 -23.498 1.00 79.94 O ATOM 1213 CB MET U 126 11.846 43.930 -24.664 1.00 94.91 C ATOM 1214 CG MET U 126 12.934 44.989 -24.617 1.00 98.83 C ATOM 1215 SD MET U 126 14.186 44.802 -25.898 1.00 97.14 S ATOM 1216 CE MET U 126 13.166 44.779 -27.353 1.00 96.15 C ATOM 1217 H MET U 126 9.895 44.566 -26.145 1.00 0.00 H ATOM 1218 N TYR U 127 10.428 45.135 -21.856 1.00 85.45 N ATOM 1219 CA TYR U 127 10.697 46.023 -20.756 1.00 84.94 C ATOM 1220 C TYR U 127 9.671 47.126 -20.719 1.00 89.01 C ATOM 1221 O TYR U 127 9.770 48.068 -19.952 1.00 90.89 O ATOM 1222 CB TYR U 127 12.106 46.543 -20.848 1.00 79.74 C ATOM 1223 CG TYR U 127 13.107 45.586 -20.279 1.00 75.86 C ATOM 1224 CD1 TYR U 127 13.236 44.328 -20.782 1.00 72.06 C ATOM 1225 CD2 TYR U 127 13.914 45.942 -19.232 1.00 72.65 C ATOM 1226 CE1 TYR U 127 14.151 43.453 -20.262 1.00 69.86 C ATOM 1227 CE2 TYR U 127 14.831 45.071 -18.714 1.00 67.70 C ATOM 1228 CZ TYR U 127 14.936 43.833 -19.235 1.00 65.81 C ATOM 1229 OH TYR U 127 15.835 42.975 -18.704 1.00 66.64 O ATOM 1230 HH TYR U 127 15.794 42.113 -19.190 1.00 0.00 H ATOM 1231 H TYR U 127 10.118 44.167 -21.636 1.00 0.00 H ATOM 1232 N ASN U 128 8.633 46.944 -21.514 1.00 92.18 N ATOM 1233 CA ASN U 128 7.650 47.987 -21.773 1.00 92.70 C ATOM 1234 C ASN U 128 6.436 47.722 -20.894 1.00 85.94 C ATOM 1235 O ASN U 128 5.472 47.089 -21.319 1.00 81.18 O ATOM 1236 CB ASN U 128 7.283 47.994 -23.273 1.00 98.63 C ATOM 1237 CG ASN U 128 6.323 49.108 -23.658 1.00101.06 C ATOM 1238 OD1 ASN U 128 5.948 49.944 -22.837 1.00108.36 O ATOM 1239 ND2 ASN U 128 5.916 49.117 -24.926 1.00 99.79 N ATOM 1240 HD22 ASN U 128 6.258 48.391 -25.587 1.00 0.00 H ATOM 1241 HD21 ASN U 128 5.256 49.850 -25.255 1.00 0.00 H ATOM 1242 H ASN U 128 8.512 46.019 -21.974 1.00 0.00 H ATOM 1243 N ASP U 129 6.519 48.194 -19.653 1.00 85.73 N ATOM 1244 CA ASP U 129 5.450 48.033 -18.666 1.00 84.78 C ATOM 1245 C ASP U 129 4.605 49.313 -18.597 1.00 83.37 C ATOM 1246 O ASP U 129 5.125 50.405 -18.825 1.00 89.69 O ATOM 1247 CB ASP U 129 6.040 47.725 -17.287 1.00 83.88 C ATOM 1248 CG ASP U 129 6.824 46.429 -17.267 1.00 81.93 C ATOM 1249 OD1 ASP U 129 6.191 45.347 -17.316 1.00 80.35 O ATOM 1250 OD2 ASP U 129 8.074 46.495 -17.203 1.00 77.68 O ATOM 1251 H ASP U 129 7.383 48.700 -19.371 1.00 0.00 H ATOM 1252 N PRO U 130 3.383 49.184 -18.143 1.00 81.26 N ATOM 1253 CA PRO U 130 2.469 50.301 -18.003 1.00 81.44 C ATOM 1254 C PRO U 130 2.794 51.205 -16.844 1.00 76.08 C ATOM 1255 O PRO U 130 3.557 50.857 -15.982 1.00 73.41 O ATOM 1256 CB PRO U 130 1.156 49.607 -17.757 1.00 84.99 C ATOM 1257 CG PRO U 130 1.265 48.370 -18.563 1.00 86.21 C ATOM 1258 CD PRO U 130 2.706 47.996 -18.656 1.00 84.81 C ATOM 1259 N GLN U 131 2.231 52.394 -16.867 1.00 74.53 N ATOM 1260 CA GLN U 131 2.443 53.336 -15.805 1.00 79.03 C ATOM 1261 C GLN U 131 1.849 52.803 -14.541 1.00 75.65 C ATOM 1262 O GLN U 131 0.792 52.202 -14.546 1.00 73.71 O ATOM 1263 CB GLN U 131 1.790 54.665 -16.140 1.00 83.80 C ATOM 1264 CG GLN U 131 2.551 55.482 -17.152 1.00 89.59 C ATOM 1265 CD GLN U 131 4.022 55.600 -16.821 1.00 97.32 C ATOM 1266 OE1 GLN U 131 4.483 55.106 -15.800 1.00 96.51 O ATOM 1267 NE2 GLN U 131 4.769 56.267 -17.689 1.00100.70 N ATOM 1268 HE22 GLN U 131 4.337 56.671 -18.544 1.00 0.00 H ATOM 1269 HE21 GLN U 131 5.787 56.386 -17.515 1.00 0.00 H ATOM 1270 H GLN U 131 1.622 52.656 -17.668 1.00 0.00 H ATOM 1271 N PHE U 132 2.517 53.065 -13.444 1.00 73.74 N ATOM 1272 CA PHE U 132 2.092 52.545 -12.191 1.00 79.86 C ATOM 1273 C PHE U 132 0.787 53.235 -11.888 1.00 74.88 C ATOM 1274 O PHE U 132 0.492 54.218 -12.501 1.00 75.12 O ATOM 1275 CB PHE U 132 3.191 52.746 -11.157 1.00 89.94 C ATOM 1276 CG PHE U 132 3.055 53.976 -10.331 1.00100.61 C ATOM 1277 CD1 PHE U 132 2.276 53.972 -9.210 1.00105.68 C ATOM 1278 CD2 PHE U 132 3.725 55.126 -10.666 1.00108.70 C ATOM 1279 CE1 PHE U 132 2.151 55.105 -8.441 1.00111.02 C ATOM 1280 CE2 PHE U 132 3.610 56.268 -9.900 1.00107.32 C ATOM 1281 CZ PHE U 132 2.818 56.258 -8.787 1.00107.98 C ATOM 1282 H PHE U 132 3.368 53.661 -13.491 1.00 0.00 H ATOM 1283 N GLY U 133 -0.034 52.673 -11.020 1.00 71.35 N ATOM 1284 CA GLY U 133 -1.419 53.110 -10.911 1.00 65.78 C ATOM 1285 C GLY U 133 -2.311 52.658 -12.057 1.00 63.91 C ATOM 1286 O GLY U 133 -3.524 52.914 -12.015 1.00 62.49 O ATOM 1287 H GLY U 133 0.313 51.908 -10.406 1.00 0.00 H ATOM 1288 N THR U 134 -1.745 51.987 -13.071 1.00 59.83 N ATOM 1289 CA THR U 134 -2.551 51.454 -14.167 1.00 56.28 C ATOM 1290 C THR U 134 -3.452 50.380 -13.597 1.00 57.33 C ATOM 1291 O THR U 134 -2.999 49.538 -12.833 1.00 56.17 O ATOM 1292 CB THR U 134 -1.697 50.846 -15.300 1.00 52.30 C ATOM 1293 OG1 THR U 134 -0.893 51.869 -15.891 1.00 49.41 O ATOM 1294 CG2 THR U 134 -2.581 50.203 -16.398 1.00 49.55 C ATOM 1295 HG1 THR U 134 -0.299 52.259 -15.202 1.00 0.00 H ATOM 1296 H THR U 134 -0.715 51.844 -13.077 1.00 0.00 H ATOM 1297 N SER U 135 -4.731 50.441 -13.947 1.00 62.20 N ATOM 1298 CA SER U 135 -5.658 49.375 -13.603 1.00 64.83 C ATOM 1299 C SER U 135 -5.451 48.220 -14.552 1.00 66.93 C ATOM 1300 O SER U 135 -5.360 48.387 -15.768 1.00 68.66 O ATOM 1301 CB SER U 135 -7.113 49.835 -13.619 1.00 65.14 C ATOM 1302 OG SER U 135 -7.474 50.236 -12.312 1.00 67.47 O ATOM 1303 HG SER U 135 -8.417 50.537 -12.309 1.00 0.00 H ATOM 1304 H SER U 135 -5.076 51.266 -14.477 1.00 0.00 H ATOM 1305 N CYS U 136 -5.392 47.041 -13.964 1.00 71.16 N ATOM 1306 CA CYS U 136 -5.000 45.861 -14.662 1.00 70.69 C ATOM 1307 C CYS U 136 -5.850 44.694 -14.144 1.00 68.32 C ATOM 1308 O CYS U 136 -6.430 44.801 -13.053 1.00 69.22 O ATOM 1309 CB CYS U 136 -3.527 45.677 -14.390 1.00 74.07 C ATOM 1310 SG CYS U 136 -2.792 44.668 -15.660 1.00 97.61 S ATOM 1311 H CYS U 136 -5.640 46.969 -12.957 1.00 0.00 H ATOM 1312 N GLU U 137 -5.936 43.603 -14.913 1.00 64.35 N ATOM 1313 CA GLU U 137 -6.909 42.507 -14.651 1.00 63.35 C ATOM 1314 C GLU U 137 -6.310 41.141 -14.293 1.00 61.09 C ATOM 1315 O GLU U 137 -5.577 40.552 -15.098 1.00 59.64 O ATOM 1316 CB GLU U 137 -7.775 42.268 -15.880 1.00 64.16 C ATOM 1317 CG GLU U 137 -8.714 43.392 -16.250 1.00 66.87 C ATOM 1318 CD GLU U 137 -9.646 43.007 -17.387 1.00 69.66 C ATOM 1319 OE1 GLU U 137 -9.339 42.037 -18.127 1.00 70.62 O ATOM 1320 OE2 GLU U 137 -10.695 43.670 -17.534 1.00 67.23 O ATOM 1321 H GLU U 137 -5.296 43.517 -15.728 1.00 0.00 H ATOM 1322 N ILE U 138 -6.697 40.613 -13.127 1.00 59.08 N ATOM 1323 CA ILE U 138 -6.313 39.257 -12.693 1.00 57.62 C ATOM 1324 C ILE U 138 -7.503 38.294 -12.716 1.00 54.38 C ATOM 1325 O ILE U 138 -8.622 38.702 -12.456 1.00 53.45 O ATOM 1326 CB ILE U 138 -5.642 39.253 -11.297 1.00 58.85 C ATOM 1327 CG1 ILE U 138 -6.614 39.648 -10.181 1.00 59.78 C ATOM 1328 CG2 ILE U 138 -4.452 40.192 -11.295 1.00 59.37 C ATOM 1329 CD1 ILE U 138 -6.055 39.486 -8.787 1.00 60.47 C ATOM 1330 H ILE U 138 -7.296 41.185 -12.498 1.00 0.00 H ATOM 1331 N THR U 139 -7.236 37.018 -13.011 1.00 53.48 N ATOM 1332 CA THR U 139 -8.267 35.988 -13.194 1.00 50.37 C ATOM 1333 C THR U 139 -7.794 34.639 -12.647 1.00 50.14 C ATOM 1334 O THR U 139 -6.614 34.292 -12.753 1.00 50.18 O ATOM 1335 CB THR U 139 -8.659 35.868 -14.687 1.00 50.10 C ATOM 1336 OG1 THR U 139 -9.247 37.106 -15.122 1.00 50.88 O ATOM 1337 CG2 THR U 139 -9.657 34.734 -14.932 1.00 49.45 C ATOM 1338 HG1 THR U 139 -9.499 37.033 -16.077 1.00 0.00 H ATOM 1339 H THR U 139 -6.240 36.738 -13.117 1.00 0.00 H ATOM 1340 N GLY U 140 -8.721 33.896 -12.038 1.00 52.92 N ATOM 1341 CA GLY U 140 -8.434 32.550 -11.525 1.00 52.82 C ATOM 1342 C GLY U 140 -9.499 31.944 -10.623 1.00 51.17 C ATOM 1343 O GLY U 140 -10.353 32.647 -10.070 1.00 54.61 O ATOM 1344 H GLY U 140 -9.679 34.284 -11.923 1.00 0.00 H ATOM 1345 N PHE U 141 -9.411 30.626 -10.452 1.00 49.63 N ATOM 1346 CA PHE U 141 -10.264 29.871 -9.530 1.00 48.44 C ATOM 1347 C PHE U 141 -9.665 29.849 -8.110 1.00 47.37 C ATOM 1348 O PHE U 141 -9.863 28.883 -7.366 1.00 42.58 O ATOM 1349 CB PHE U 141 -10.416 28.406 -10.003 1.00 48.77 C ATOM 1350 CG PHE U 141 -11.184 28.212 -11.287 1.00 47.51 C ATOM 1351 CD1 PHE U 141 -12.570 28.168 -11.283 1.00 49.02 C ATOM 1352 CD2 PHE U 141 -10.517 27.963 -12.482 1.00 47.60 C ATOM 1353 CE1 PHE U 141 -13.278 27.936 -12.453 1.00 50.69 C ATOM 1354 CE2 PHE U 141 -11.216 27.732 -13.659 1.00 48.80 C ATOM 1355 CZ PHE U 141 -12.597 27.712 -13.644 1.00 51.01 C ATOM 1356 H PHE U 141 -8.699 30.105 -11.002 1.00 0.00 H ATOM 1357 N GLY U 142 -8.918 30.880 -7.725 1.00 50.35 N ATOM 1358 CA GLY U 142 -8.280 30.898 -6.411 1.00 55.26 C ATOM 1359 C GLY U 142 -9.278 31.147 -5.293 1.00 58.49 C ATOM 1360 O GLY U 142 -10.417 31.559 -5.545 1.00 60.57 O ATOM 1361 H GLY U 142 -8.786 31.686 -8.369 1.00 0.00 H ATOM 1362 N LYS U 143 -8.829 30.898 -4.063 1.00 58.28 N ATOM 1363 CA LYS U 143 -9.626 31.101 -2.856 1.00 57.17 C ATOM 1364 C LYS U 143 -10.319 32.459 -2.825 1.00 55.47 C ATOM 1365 O LYS U 143 -9.731 33.468 -3.211 1.00 53.43 O ATOM 1366 CB LYS U 143 -8.736 30.994 -1.620 1.00 57.66 C ATOM 1367 CG LYS U 143 -8.397 29.578 -1.220 1.00 60.13 C ATOM 1368 CD LYS U 143 -7.902 29.553 0.217 1.00 65.36 C ATOM 1369 CE LYS U 143 -7.434 28.172 0.654 1.00 69.14 C ATOM 1370 NZ LYS U 143 -6.096 27.807 0.135 1.00 70.51 N ATOM 1371 HZ1 LYS U 143 -6.115 27.814 -0.905 1.00 0.00 H ATOM 1372 HZ2 LYS U 143 -5.394 28.495 0.475 1.00 0.00 H ATOM 1373 HZ3 LYS U 143 -5.842 26.856 0.472 1.00 0.00 H ATOM 1374 H LYS U 143 -7.858 30.540 -3.957 1.00 0.00 H ATOM 1375 N GLU U 144 -11.568 32.468 -2.366 1.00 55.59 N ATOM 1376 CA GLU U 144 -12.342 33.706 -2.264 1.00 57.90 C ATOM 1377 C GLU U 144 -11.976 34.482 -1.016 1.00 57.75 C ATOM 1378 O GLU U 144 -12.164 35.705 -0.968 1.00 51.26 O ATOM 1379 CB GLU U 144 -13.841 33.421 -2.287 1.00 58.95 C ATOM 1380 CG GLU U 144 -14.318 32.861 -3.613 1.00 59.69 C ATOM 1381 CD GLU U 144 -15.824 32.807 -3.700 1.00 63.14 C ATOM 1382 OE1 GLU U 144 -16.374 31.693 -3.555 1.00 65.53 O ATOM 1383 OE2 GLU U 144 -16.455 33.878 -3.885 1.00 63.78 O ATOM 1384 H GLU U 144 -12.006 31.572 -2.072 1.00 0.00 H ATOM 1385 N GLN U 145 -11.500 33.745 -0.007 1.00 59.58 N ATOM 1386 CA GLN U 145 -10.975 34.294 1.237 1.00 62.27 C ATOM 1387 C GLN U 145 -9.888 33.342 1.750 1.00 60.46 C ATOM 1388 O GLN U 145 -9.951 32.141 1.491 1.00 57.14 O ATOM 1389 CB GLN U 145 -12.114 34.457 2.250 1.00 69.76 C ATOM 1390 CG GLN U 145 -13.188 35.440 1.781 1.00 76.65 C ATOM 1391 CD GLN U 145 -14.257 35.752 2.803 1.00 86.01 C ATOM 1392 OE1 GLN U 145 -14.729 36.892 2.889 1.00 93.05 O ATOM 1393 NE2 GLN U 145 -14.683 34.739 3.550 1.00 90.37 N ATOM 1394 HE22 GLN U 145 -14.255 33.797 3.442 1.00 0.00 H ATOM 1395 HE21 GLN U 145 -15.444 34.888 4.243 1.00 0.00 H ATOM 1396 H GLN U 145 -11.505 32.711 -0.117 1.00 0.00 H ATOM 1397 N SER U 146 -8.897 33.876 2.468 1.00 62.23 N ATOM 1398 CA SER U 146 -7.723 33.093 2.924 1.00 61.43 C ATOM 1399 C SER U 146 -8.070 31.978 3.928 1.00 66.17 C ATOM 1400 O SER U 146 -7.339 30.998 4.029 1.00 75.53 O ATOM 1401 CB SER U 146 -6.651 34.001 3.543 1.00 58.28 C ATOM 1402 OG SER U 146 -6.606 35.279 2.930 1.00 56.86 O ATOM 1403 HG SER U 146 -5.903 35.826 3.361 1.00 0.00 H ATOM 1404 H SER U 146 -8.951 34.884 2.718 1.00 0.00 H ATOM 1405 N THR U 147 -9.168 32.135 4.670 1.00 67.45 N ATOM 1406 CA THR U 147 -9.658 31.092 5.588 1.00 66.90 C ATOM 1407 C THR U 147 -10.338 29.911 4.873 1.00 65.62 C ATOM 1408 O THR U 147 -10.414 28.829 5.437 1.00 66.94 O ATOM 1409 CB THR U 147 -10.675 31.645 6.626 1.00 66.90 C ATOM 1410 OG1 THR U 147 -11.887 32.041 5.970 1.00 62.53 O ATOM 1411 CG2 THR U 147 -10.091 32.824 7.403 1.00 66.63 C ATOM 1412 HG1 THR U 147 -12.525 32.391 6.641 1.00 0.00 H ATOM 1413 H THR U 147 -9.698 33.027 4.598 1.00 0.00 H ATOM 1414 N ASP U 148 -10.768 30.100 3.643 1.00 61.40 N ATOM 1415 CA ASP U 148 -11.469 29.079 2.930 1.00 57.11 C ATOM 1416 C ASP U 148 -10.578 27.912 2.694 1.00 56.65 C ATOM 1417 O ASP U 148 -9.420 28.069 2.444 1.00 51.27 O ATOM 1418 CB ASP U 148 -11.935 29.624 1.599 1.00 60.17 C ATOM 1419 CG ASP U 148 -13.059 30.600 1.732 1.00 61.87 C ATOM 1420 OD1 ASP U 148 -13.524 30.834 2.842 1.00 61.84 O ATOM 1421 OD2 ASP U 148 -13.495 31.141 0.722 1.00 64.14 O ATOM 1422 H ASP U 148 -10.593 31.014 3.179 1.00 0.00 H ATOM 1423 N TYR U 149 -11.131 26.727 2.874 1.00 64.68 N ATOM 1424 CA TYR U 149 -10.624 25.453 2.386 1.00 70.60 C ATOM 1425 C TYR U 149 -10.741 25.277 0.888 1.00 69.50 C ATOM 1426 O TYR U 149 -9.876 24.721 0.236 1.00 71.46 O ATOM 1427 CB TYR U 149 -11.383 24.326 3.059 1.00 77.05 C ATOM 1428 CG TYR U 149 -10.805 22.941 2.886 1.00 84.73 C ATOM 1429 CD1 TYR U 149 -9.462 22.739 2.670 1.00 87.33 C ATOM 1430 CD2 TYR U 149 -11.615 21.830 2.968 1.00 88.66 C ATOM 1431 CE1 TYR U 149 -8.949 21.467 2.528 1.00 88.71 C ATOM 1432 CE2 TYR U 149 -11.108 20.561 2.824 1.00 87.80 C ATOM 1433 CZ TYR U 149 -9.778 20.386 2.605 1.00 87.25 C ATOM 1434 OH TYR U 149 -9.292 19.113 2.467 1.00 83.95 O ATOM 1435 HH TYR U 149 -8.315 19.149 2.314 1.00 0.00 H ATOM 1436 H TYR U 149 -12.017 26.701 3.418 1.00 0.00 H ATOM 1437 N LEU U 150 -11.859 25.733 0.361 1.00 63.68 N ATOM 1438 CA LEU U 150 -12.274 25.423 -0.973 1.00 60.39 C ATOM 1439 C LEU U 150 -12.005 26.513 -1.953 1.00 57.29 C ATOM 1440 O LEU U 150 -11.963 27.673 -1.618 1.00 55.87 O ATOM 1441 CB LEU U 150 -13.766 25.184 -0.975 1.00 62.91 C ATOM 1442 CG LEU U 150 -14.289 24.005 -0.195 1.00 67.98 C ATOM 1443 CD1 LEU U 150 -15.794 24.079 -0.094 1.00 70.10 C ATOM 1444 CD2 LEU U 150 -13.889 22.757 -0.929 1.00 70.64 C ATOM 1445 H LEU U 150 -12.467 26.346 0.941 1.00 0.00 H ATOM 1446 N TYR U 151 -11.853 26.122 -3.195 1.00 52.78 N ATOM 1447 CA TYR U 151 -11.782 27.073 -4.264 1.00 53.47 C ATOM 1448 C TYR U 151 -13.188 27.218 -4.836 1.00 52.31 C ATOM 1449 O TYR U 151 -13.974 26.279 -4.788 1.00 49.97 O ATOM 1450 CB TYR U 151 -10.811 26.582 -5.339 1.00 55.70 C ATOM 1451 CG TYR U 151 -9.341 26.417 -4.928 1.00 55.04 C ATOM 1452 CD1 TYR U 151 -8.823 26.917 -3.716 1.00 55.28 C ATOM 1453 CD2 TYR U 151 -8.461 25.774 -5.780 1.00 55.97 C ATOM 1454 CE1 TYR U 151 -7.480 26.749 -3.377 1.00 53.64 C ATOM 1455 CE2 TYR U 151 -7.122 25.611 -5.456 1.00 58.61 C ATOM 1456 CZ TYR U 151 -6.632 26.095 -4.259 1.00 57.03 C ATOM 1457 OH TYR U 151 -5.294 25.891 -3.985 1.00 55.56 O ATOM 1458 HH TYR U 151 -5.075 26.284 -3.103 1.00 0.00 H ATOM 1459 H TYR U 151 -11.783 25.106 -3.407 1.00 0.00 H ATOM 1460 N PRO U 152 -13.517 28.400 -5.384 1.00 56.40 N ATOM 1461 CA PRO U 152 -14.832 28.617 -5.983 1.00 57.60 C ATOM 1462 C PRO U 152 -15.022 27.771 -7.212 1.00 56.90 C ATOM 1463 O PRO U 152 -14.051 27.450 -7.909 1.00 52.91 O ATOM 1464 CB PRO U 152 -14.797 30.084 -6.395 1.00 58.13 C ATOM 1465 CG PRO U 152 -13.358 30.323 -6.680 1.00 61.45 C ATOM 1466 CD PRO U 152 -12.647 29.565 -5.596 1.00 59.90 C ATOM 1467 N GLU U 153 -16.274 27.428 -7.468 1.00 57.45 N ATOM 1468 CA GLU U 153 -16.610 26.542 -8.566 1.00 60.16 C ATOM 1469 C GLU U 153 -16.614 27.328 -9.879 1.00 56.32 C ATOM 1470 O GLU U 153 -16.239 26.814 -10.928 1.00 52.96 O ATOM 1471 CB GLU U 153 -17.961 25.867 -8.281 1.00 64.60 C ATOM 1472 CG GLU U 153 -18.237 24.581 -9.060 1.00 68.72 C ATOM 1473 CD GLU U 153 -17.230 23.473 -8.814 1.00 72.07 C ATOM 1474 OE1 GLU U 153 -16.604 23.414 -7.719 1.00 67.51 O ATOM 1475 OE2 GLU U 153 -17.080 22.647 -9.741 1.00 77.60 O ATOM 1476 H GLU U 153 -17.036 27.803 -6.867 1.00 0.00 H ATOM 1477 N GLN U 154 -17.019 28.587 -9.796 1.00 55.83 N ATOM 1478 CA GLN U 154 -17.094 29.469 -10.938 1.00 56.48 C ATOM 1479 C GLN U 154 -15.848 30.349 -10.979 1.00 61.48 C ATOM 1480 O GLN U 154 -15.314 30.746 -9.932 1.00 64.24 O ATOM 1481 CB GLN U 154 -18.347 30.331 -10.806 1.00 56.90 C ATOM 1482 CG GLN U 154 -18.632 31.277 -11.966 1.00 58.10 C ATOM 1483 CD GLN U 154 -19.035 30.557 -13.238 1.00 58.88 C ATOM 1484 OE1 GLN U 154 -19.390 29.381 -13.212 1.00 59.86 O ATOM 1485 NE2 GLN U 154 -18.976 31.261 -14.363 1.00 61.26 N ATOM 1486 HE22 GLN U 154 -18.670 32.255 -14.339 1.00 0.00 H ATOM 1487 HE21 GLN U 154 -19.236 30.819 -15.268 1.00 0.00 H ATOM 1488 H GLN U 154 -17.296 28.958 -8.865 1.00 0.00 H ATOM 1489 N LEU U 155 -15.403 30.660 -12.197 1.00 64.04 N ATOM 1490 CA LEU U 155 -14.213 31.485 -12.433 1.00 60.26 C ATOM 1491 C LEU U 155 -14.456 32.888 -11.915 1.00 55.79 C ATOM 1492 O LEU U 155 -15.588 33.366 -11.976 1.00 50.93 O ATOM 1493 CB LEU U 155 -13.899 31.535 -13.938 1.00 61.19 C ATOM 1494 CG LEU U 155 -12.607 32.228 -14.387 1.00 61.87 C ATOM 1495 CD1 LEU U 155 -11.399 31.456 -13.887 1.00 63.43 C ATOM 1496 CD2 LEU U 155 -12.556 32.365 -15.902 1.00 61.55 C ATOM 1497 H LEU U 155 -15.926 30.300 -13.021 1.00 0.00 H ATOM 1498 N LYS U 156 -13.400 33.532 -11.412 1.00 56.16 N ATOM 1499 CA LYS U 156 -13.469 34.927 -10.919 1.00 60.45 C ATOM 1500 C LYS U 156 -12.392 35.814 -11.520 1.00 58.88 C ATOM 1501 O LYS U 156 -11.343 35.330 -11.932 1.00 55.80 O ATOM 1502 CB LYS U 156 -13.359 34.988 -9.387 1.00 61.44 C ATOM 1503 CG LYS U 156 -14.625 34.547 -8.667 1.00 61.37 C ATOM 1504 CD LYS U 156 -14.466 34.596 -7.170 1.00 60.88 C ATOM 1505 CE LYS U 156 -14.552 36.021 -6.663 1.00 62.98 C ATOM 1506 NZ LYS U 156 -14.026 36.128 -5.271 1.00 64.56 N ATOM 1507 HZ1 LYS U 156 -14.585 35.516 -4.643 1.00 0.00 H ATOM 1508 HZ2 LYS U 156 -13.030 35.828 -5.254 1.00 0.00 H ATOM 1509 HZ3 LYS U 156 -14.097 37.115 -4.950 1.00 0.00 H ATOM 1510 H LYS U 156 -12.489 33.032 -11.364 1.00 0.00 H ATOM 1511 N MET U 157 -12.676 37.116 -11.558 1.00 58.85 N ATOM 1512 CA MET U 157 -11.704 38.131 -11.961 1.00 58.87 C ATOM 1513 C MET U 157 -11.945 39.455 -11.242 1.00 54.76 C ATOM 1514 O MET U 157 -13.047 39.733 -10.800 1.00 53.81 O ATOM 1515 CB MET U 157 -11.710 38.343 -13.480 1.00 62.63 C ATOM 1516 CG MET U 157 -12.960 38.990 -14.045 1.00 68.15 C ATOM 1517 SD MET U 157 -12.687 39.585 -15.716 1.00 75.27 S ATOM 1518 CE MET U 157 -14.369 39.962 -16.211 1.00 76.15 C ATOM 1519 H MET U 157 -13.632 37.424 -11.289 1.00 0.00 H ATOM 1520 N THR U 158 -10.897 40.262 -11.140 1.00 53.11 N ATOM 1521 CA THR U 158 -10.943 41.511 -10.393 1.00 52.72 C ATOM 1522 C THR U 158 -9.924 42.488 -10.961 1.00 56.04 C ATOM 1523 O THR U 158 -9.228 42.168 -11.932 1.00 54.30 O ATOM 1524 CB THR U 158 -10.698 41.281 -8.886 1.00 51.16 C ATOM 1525 OG1 THR U 158 -11.069 42.453 -8.169 1.00 50.23 O ATOM 1526 CG2 THR U 158 -9.246 40.962 -8.584 1.00 50.90 C ATOM 1527 HG1 THR U 158 -10.913 42.310 -7.202 1.00 0.00 H ATOM 1528 H THR U 158 -10.010 39.993 -11.611 1.00 0.00 H ATOM 1529 N VAL U 159 -9.855 43.674 -10.353 1.00 60.90 N ATOM 1530 CA VAL U 159 -8.987 44.752 -10.816 1.00 65.58 C ATOM 1531 C VAL U 159 -7.988 45.087 -9.730 1.00 70.74 C ATOM 1532 O VAL U 159 -8.325 45.085 -8.541 1.00 70.56 O ATOM 1533 CB VAL U 159 -9.775 46.038 -11.132 1.00 66.21 C ATOM 1534 CG1 VAL U 159 -8.968 46.958 -12.039 1.00 65.32 C ATOM 1535 CG2 VAL U 159 -11.100 45.697 -11.781 1.00 69.87 C ATOM 1536 H VAL U 159 -10.446 43.837 -9.513 1.00 0.00 H ATOM 1537 N VAL U 160 -6.761 45.377 -10.152 1.00 72.67 N ATOM 1538 CA VAL U 160 -5.712 45.824 -9.247 1.00 73.60 C ATOM 1539 C VAL U 160 -4.905 46.889 -9.955 1.00 70.25 C ATOM 1540 O VAL U 160 -4.741 46.841 -11.188 1.00 65.75 O ATOM 1541 CB VAL U 160 -4.789 44.669 -8.795 1.00 78.14 C ATOM 1542 CG1 VAL U 160 -5.564 43.660 -7.951 1.00 75.68 C ATOM 1543 CG2 VAL U 160 -4.136 43.973 -9.990 1.00 82.68 C ATOM 1544 H VAL U 160 -6.543 45.281 -11.164 1.00 0.00 H ATOM 1545 N LYS U 161 -4.418 47.842 -9.164 1.00 67.22 N ATOM 1546 CA LYS U 161 -3.625 48.942 -9.670 1.00 66.06 C ATOM 1547 C LYS U 161 -2.157 48.644 -9.431 1.00 61.60 C ATOM 1548 O LYS U 161 -1.785 48.155 -8.364 1.00 59.60 O ATOM 1549 CB LYS U 161 -4.041 50.251 -9.008 1.00 71.33 C ATOM 1550 CG LYS U 161 -5.466 50.665 -9.357 1.00 78.41 C ATOM 1551 CD LYS U 161 -5.703 52.168 -9.222 1.00 85.69 C ATOM 1552 CE LYS U 161 -7.035 52.585 -9.847 1.00 90.06 C ATOM 1553 NZ LYS U 161 -7.285 54.061 -9.870 1.00 91.25 N ATOM 1554 HZ1 LYS U 161 -7.283 54.427 -8.896 1.00 0.00 H ATOM 1555 HZ2 LYS U 161 -6.536 54.530 -10.419 1.00 0.00 H ATOM 1556 HZ3 LYS U 161 -8.208 54.248 -10.310 1.00 0.00 H ATOM 1557 H LYS U 161 -4.615 47.795 -8.144 1.00 0.00 H ATOM 1558 N LEU U 162 -1.337 48.934 -10.437 1.00 58.38 N ATOM 1559 CA LEU U 162 0.094 48.665 -10.372 1.00 58.29 C ATOM 1560 C LEU U 162 0.789 49.607 -9.407 1.00 63.49 C ATOM 1561 O LEU U 162 0.315 50.715 -9.142 1.00 66.84 O ATOM 1562 CB LEU U 162 0.745 48.775 -11.749 1.00 56.87 C ATOM 1563 CG LEU U 162 0.676 47.519 -12.616 1.00 55.44 C ATOM 1564 CD1 LEU U 162 -0.731 46.957 -12.777 1.00 56.79 C ATOM 1565 CD2 LEU U 162 1.257 47.857 -13.974 1.00 54.84 C ATOM 1566 H LEU U 162 -1.729 49.367 -11.298 1.00 0.00 H ATOM 1567 N ILE U 163 1.927 49.146 -8.903 1.00 66.69 N ATOM 1568 CA ILE U 163 2.670 49.811 -7.845 1.00 65.75 C ATOM 1569 C ILE U 163 4.105 49.896 -8.324 1.00 66.96 C ATOM 1570 O ILE U 163 4.656 48.901 -8.810 1.00 64.49 O ATOM 1571 CB ILE U 163 2.582 48.991 -6.534 1.00 65.10 C ATOM 1572 CG1 ILE U 163 1.173 49.103 -5.953 1.00 64.04 C ATOM 1573 CG2 ILE U 163 3.630 49.437 -5.514 1.00 65.65 C ATOM 1574 CD1 ILE U 163 0.915 48.185 -4.779 1.00 65.77 C ATOM 1575 H ILE U 163 2.309 48.258 -9.287 1.00 0.00 H ATOM 1576 N SER U 164 4.707 51.074 -8.178 1.00 72.15 N ATOM 1577 CA SER U 164 6.090 51.277 -8.608 1.00 75.01 C ATOM 1578 C SER U 164 7.022 50.400 -7.775 1.00 72.03 C ATOM 1579 O SER U 164 6.792 50.192 -6.577 1.00 63.98 O ATOM 1580 CB SER U 164 6.500 52.749 -8.483 1.00 76.92 C ATOM 1581 OG SER U 164 6.707 53.108 -7.125 1.00 80.61 O ATOM 1582 HG SER U 164 7.425 52.545 -6.742 1.00 0.00 H ATOM 1583 H SER U 164 4.184 51.865 -7.750 1.00 0.00 H ATOM 1584 N HIS U 165 8.150 50.014 -8.330 1.00 73.09 N ATOM 1585 CA HIS U 165 9.079 49.223 -7.571 1.00 74.83 C ATOM 1586 C HIS U 165 9.515 49.995 -6.380 1.00 73.20 C ATOM 1587 O HIS U 165 9.657 49.440 -5.318 1.00 66.14 O ATOM 1588 CB HIS U 165 10.303 48.897 -8.401 1.00 80.46 C ATOM 1589 CG HIS U 165 11.020 47.659 -7.967 1.00 82.54 C ATOM 1590 ND1 HIS U 165 12.121 47.686 -7.146 1.00 83.36 N ATOM 1591 CD2 HIS U 165 10.797 46.358 -8.250 1.00 82.38 C ATOM 1592 CE1 HIS U 165 12.542 46.456 -6.936 1.00 83.42 C ATOM 1593 NE2 HIS U 165 11.760 45.631 -7.602 1.00 82.88 N ATOM 1594 H HIS U 165 8.368 50.279 -9.312 1.00 0.00 H ATOM 1595 N ARG U 166 9.748 51.271 -6.576 1.00 80.81 N ATOM 1596 CA ARG U 166 10.267 52.097 -5.525 1.00 86.83 C ATOM 1597 C ARG U 166 9.345 51.966 -4.350 1.00 84.06 C ATOM 1598 O ARG U 166 9.771 51.827 -3.223 1.00 78.16 O ATOM 1599 CB ARG U 166 10.352 53.539 -6.006 1.00 92.51 C ATOM 1600 CG ARG U 166 10.309 54.594 -4.911 1.00 99.87 C ATOM 1601 CD ARG U 166 11.522 54.552 -3.991 1.00104.87 C ATOM 1602 NE ARG U 166 12.057 55.883 -3.746 1.00108.76 N ATOM 1603 CZ ARG U 166 13.211 56.317 -4.234 1.00108.73 C ATOM 1604 NH1 ARG U 166 13.951 55.516 -4.978 1.00109.68 N ATOM 1605 NH2 ARG U 166 13.624 57.547 -3.980 1.00108.59 N ATOM 1606 HE ARG U 166 11.501 56.532 -3.153 1.00 0.00 H ATOM 1607 HH12 ARG U 166 14.857 55.853 -5.363 1.00 0.00 H ATOM 1608 HH11 ARG U 166 13.628 54.548 -5.180 1.00 0.00 H ATOM 1609 HH22 ARG U 166 14.530 57.881 -4.366 1.00 0.00 H ATOM 1610 HH21 ARG U 166 13.043 58.180 -3.394 1.00 0.00 H ATOM 1611 H ARG U 166 9.553 51.690 -7.508 1.00 0.00 H ATOM 1612 N GLU U 167 8.062 52.005 -4.635 1.00 84.01 N ATOM 1613 CA GLU U 167 7.054 51.871 -3.619 1.00 88.35 C ATOM 1614 C GLU U 167 7.022 50.519 -2.952 1.00 84.87 C ATOM 1615 O GLU U 167 6.916 50.427 -1.753 1.00 89.77 O ATOM 1616 CB GLU U 167 5.699 52.146 -4.218 1.00 90.95 C ATOM 1617 CG GLU U 167 4.590 52.087 -3.197 1.00 93.79 C ATOM 1618 CD GLU U 167 3.265 52.507 -3.766 1.00 98.04 C ATOM 1619 OE1 GLU U 167 3.237 53.029 -4.895 1.00 96.28 O ATOM 1620 OE2 GLU U 167 2.248 52.319 -3.079 1.00 98.90 O ATOM 1621 H GLU U 167 7.768 52.137 -5.624 1.00 0.00 H ATOM 1622 N CYS U 168 7.122 49.465 -3.735 1.00 78.98 N ATOM 1623 CA CYS U 168 6.974 48.096 -3.203 1.00 77.13 C ATOM 1624 C CYS U 168 8.187 47.632 -2.361 1.00 75.71 C ATOM 1625 O CYS U 168 8.042 46.848 -1.412 1.00 64.57 O ATOM 1626 CB CYS U 168 6.705 47.109 -4.354 1.00 74.41 C ATOM 1627 SG CYS U 168 5.667 45.712 -3.890 1.00 68.15 S ATOM 1628 H CYS U 168 7.309 49.600 -4.749 1.00 0.00 H ATOM 1629 N GLN U 169 9.368 48.118 -2.760 1.00 78.39 N ATOM 1630 CA GLN U 169 10.623 48.020 -2.007 1.00 74.90 C ATOM 1631 C GLN U 169 10.584 48.458 -0.553 1.00 75.02 C ATOM 1632 O GLN U 169 11.439 48.028 0.198 1.00 73.36 O ATOM 1633 CB GLN U 169 11.678 48.909 -2.646 1.00 79.07 C ATOM 1634 CG GLN U 169 12.446 48.322 -3.799 1.00 82.81 C ATOM 1635 CD GLN U 169 13.476 49.322 -4.259 1.00 88.61 C ATOM 1636 OE1 GLN U 169 13.320 49.967 -5.297 1.00 91.68 O ATOM 1637 NE2 GLN U 169 14.501 49.518 -3.440 1.00 93.99 N ATOM 1638 HE22 GLN U 169 14.591 48.949 -2.574 1.00 0.00 H ATOM 1639 HE21 GLN U 169 15.214 50.241 -3.664 1.00 0.00 H ATOM 1640 H GLN U 169 9.399 48.605 -3.679 1.00 0.00 H ATOM 1641 N GLN U 170 9.683 49.371 -0.175 1.00 76.92 N ATOM 1642 CA GLN U 170 9.510 49.769 1.236 1.00 80.35 C ATOM 1643 C GLN U 170 9.578 48.570 2.191 1.00 82.89 C ATOM 1644 O GLN U 170 9.030 47.521 1.875 1.00 84.44 O ATOM 1645 CB GLN U 170 8.150 50.426 1.451 1.00 83.64 C ATOM 1646 CG GLN U 170 8.087 51.914 1.174 1.00 90.94 C ATOM 1647 CD GLN U 170 6.692 52.483 1.440 1.00 98.35 C ATOM 1648 OE1 GLN U 170 6.223 52.521 2.587 1.00 96.70 O ATOM 1649 NE2 GLN U 170 6.018 52.921 0.375 1.00 99.13 N ATOM 1650 HE22 GLN U 170 6.449 52.871 -0.570 1.00 0.00 H ATOM 1651 HE21 GLN U 170 5.062 53.313 0.490 1.00 0.00 H ATOM 1652 H GLN U 170 9.084 49.816 -0.900 1.00 0.00 H ATOM 1653 N PRO U 170A 10.218 48.722 3.372 1.00 88.62 N ATOM 1654 CA PRO U 170A 10.152 47.642 4.383 1.00 87.24 C ATOM 1655 C PRO U 170A 8.730 47.410 4.893 1.00 81.88 C ATOM 1656 O PRO U 170A 8.377 46.302 5.310 1.00 75.95 O ATOM 1657 CB PRO U 170A 11.038 48.170 5.521 1.00 89.51 C ATOM 1658 CG PRO U 170A 11.017 49.650 5.363 1.00 92.68 C ATOM 1659 CD PRO U 170A 10.954 49.896 3.881 1.00 91.92 C ATOM 1660 N HIS U 170B 7.944 48.481 4.828 1.00 80.60 N ATOM 1661 CA HIS U 170B 6.534 48.504 5.189 1.00 85.90 C ATOM 1662 C HIS U 170B 5.774 47.528 4.283 1.00 82.86 C ATOM 1663 O HIS U 170B 4.900 46.801 4.755 1.00 80.71 O ATOM 1664 CB HIS U 170B 5.986 49.948 5.079 1.00 88.21 C ATOM 1665 CG HIS U 170B 6.927 50.983 5.628 1.00 94.34 C ATOM 1666 ND1 HIS U 170B 6.935 51.358 6.955 1.00100.31 N ATOM 1667 CD2 HIS U 170B 7.937 51.670 5.039 1.00 94.28 C ATOM 1668 CE1 HIS U 170B 7.893 52.247 7.153 1.00 97.01 C ATOM 1669 NE2 HIS U 170B 8.518 52.449 6.007 1.00 94.21 N ATOM 1670 H HIS U 170B 8.369 49.369 4.494 1.00 0.00 H ATOM 1671 N TYR U 171 6.156 47.505 2.999 1.00 77.62 N ATOM 1672 CA TYR U 171 5.617 46.579 1.988 1.00 70.73 C ATOM 1673 C TYR U 171 6.377 45.236 1.967 1.00 69.62 C ATOM 1674 O TYR U 171 6.230 44.465 2.911 1.00 69.29 O ATOM 1675 CB TYR U 171 5.561 47.259 0.612 1.00 70.55 C ATOM 1676 CG TYR U 171 4.427 48.259 0.472 1.00 72.92 C ATOM 1677 CD1 TYR U 171 4.145 49.193 1.485 1.00 72.31 C ATOM 1678 CD2 TYR U 171 3.627 48.276 -0.681 1.00 72.16 C ATOM 1679 CE1 TYR U 171 3.106 50.099 1.351 1.00 74.41 C ATOM 1680 CE2 TYR U 171 2.588 49.187 -0.823 1.00 72.20 C ATOM 1681 CZ TYR U 171 2.332 50.094 0.195 1.00 72.80 C ATOM 1682 OH TYR U 171 1.311 51.003 0.070 1.00 68.78 O ATOM 1683 HH TYR U 171 1.474 51.574 -0.722 1.00 0.00 H ATOM 1684 H TYR U 171 6.881 48.186 2.696 1.00 0.00 H ATOM 1685 N TYR U 172 7.177 44.946 0.935 1.00 72.02 N ATOM 1686 CA TYR U 172 7.935 43.677 0.872 1.00 75.20 C ATOM 1687 C TYR U 172 9.431 43.823 1.102 1.00 76.58 C ATOM 1688 O TYR U 172 10.161 42.833 1.061 1.00 76.91 O ATOM 1689 CB TYR U 172 7.677 42.956 -0.459 1.00 75.36 C ATOM 1690 CG TYR U 172 6.301 42.360 -0.522 1.00 75.68 C ATOM 1691 CD1 TYR U 172 5.832 41.544 0.513 1.00 78.30 C ATOM 1692 CD2 TYR U 172 5.451 42.606 -1.605 1.00 77.11 C ATOM 1693 CE1 TYR U 172 4.564 40.992 0.483 1.00 78.36 C ATOM 1694 CE2 TYR U 172 4.174 42.053 -1.647 1.00 79.32 C ATOM 1695 CZ TYR U 172 3.740 41.244 -0.593 1.00 80.05 C ATOM 1696 OH TYR U 172 2.495 40.667 -0.581 1.00 78.16 O ATOM 1697 HH TYR U 172 1.804 41.375 -0.615 1.00 0.00 H ATOM 1698 H TYR U 172 7.269 45.630 0.157 1.00 0.00 H ATOM 1699 N GLY U 173 9.884 45.042 1.367 1.00 77.16 N ATOM 1700 CA GLY U 173 11.285 45.285 1.632 1.00 78.79 C ATOM 1701 C GLY U 173 12.153 44.817 0.479 1.00 79.26 C ATOM 1702 O GLY U 173 11.852 45.063 -0.694 1.00 78.85 O ATOM 1703 H GLY U 173 9.217 45.840 1.384 1.00 0.00 H ATOM 1704 N SER U 174 13.217 44.107 0.841 1.00 83.00 N ATOM 1705 CA SER U 174 14.174 43.536 -0.102 1.00 80.11 C ATOM 1706 C SER U 174 13.545 42.523 -1.059 1.00 78.24 C ATOM 1707 O SER U 174 13.917 42.482 -2.235 1.00 73.28 O ATOM 1708 CB SER U 174 15.317 42.872 0.686 1.00 77.96 C ATOM 1709 OG SER U 174 14.815 42.037 1.722 1.00 72.78 O ATOM 1710 HG SER U 174 15.572 41.626 2.209 1.00 0.00 H ATOM 1711 H SER U 174 13.377 43.949 1.856 1.00 0.00 H ATOM 1712 N GLU U 175 12.580 41.746 -0.547 1.00 78.28 N ATOM 1713 CA GLU U 175 12.040 40.546 -1.220 1.00 76.74 C ATOM 1714 C GLU U 175 11.695 40.767 -2.692 1.00 75.00 C ATOM 1715 O GLU U 175 11.938 39.891 -3.525 1.00 79.01 O ATOM 1716 CB GLU U 175 10.808 39.990 -0.475 1.00 76.26 C ATOM 1717 CG GLU U 175 11.113 39.356 0.881 1.00 79.32 C ATOM 1718 CD GLU U 175 9.906 39.272 1.822 1.00 84.60 C ATOM 1719 OE1 GLU U 175 9.656 38.175 2.364 1.00 85.54 O ATOM 1720 OE2 GLU U 175 9.211 40.293 2.045 1.00 85.02 O ATOM 1721 H GLU U 175 12.187 42.003 0.381 1.00 0.00 H ATOM 1722 N VAL U 176 11.146 41.937 -3.008 1.00 70.08 N ATOM 1723 CA VAL U 176 10.749 42.237 -4.378 1.00 66.14 C ATOM 1724 C VAL U 176 11.934 42.734 -5.224 1.00 62.07 C ATOM 1725 O VAL U 176 12.682 43.623 -4.822 1.00 59.65 O ATOM 1726 CB VAL U 176 9.523 43.185 -4.437 1.00 69.94 C ATOM 1727 CG1 VAL U 176 9.732 44.472 -3.627 1.00 71.37 C ATOM 1728 CG2 VAL U 176 9.145 43.467 -5.892 1.00 71.68 C ATOM 1729 H VAL U 176 10.998 42.649 -2.265 1.00 0.00 H ATOM 1730 N THR U 177 12.070 42.149 -6.409 1.00 60.40 N ATOM 1731 CA THR U 177 13.106 42.492 -7.379 1.00 60.61 C ATOM 1732 C THR U 177 12.475 43.183 -8.592 1.00 63.90 C ATOM 1733 O THR U 177 11.253 43.378 -8.634 1.00 65.51 O ATOM 1734 CB THR U 177 13.826 41.219 -7.857 1.00 60.76 C ATOM 1735 OG1 THR U 177 13.003 40.512 -8.799 1.00 60.13 O ATOM 1736 CG2 THR U 177 14.146 40.308 -6.684 1.00 60.24 C ATOM 1737 HG1 THR U 177 13.475 39.695 -9.100 1.00 0.00 H ATOM 1738 H THR U 177 11.395 41.399 -6.662 1.00 0.00 H ATOM 1739 N THR U 178 13.301 43.554 -9.573 1.00 69.58 N ATOM 1740 CA THR U 178 12.829 44.285 -10.767 1.00 74.24 C ATOM 1741 C THR U 178 12.385 43.360 -11.902 1.00 73.74 C ATOM 1742 O THR U 178 11.901 43.839 -12.936 1.00 69.23 O ATOM 1743 CB THR U 178 13.883 45.267 -11.322 1.00 73.32 C ATOM 1744 OG1 THR U 178 14.889 44.537 -12.036 1.00 79.11 O ATOM 1745 CG2 THR U 178 14.513 46.092 -10.198 1.00 71.15 C ATOM 1746 HG1 THR U 178 14.469 44.045 -12.786 1.00 0.00 H ATOM 1747 H THR U 178 14.311 43.320 -9.494 1.00 0.00 H ATOM 1748 N LYS U 179 12.577 42.053 -11.716 1.00 73.16 N ATOM 1749 CA LYS U 179 11.902 41.046 -12.539 1.00 74.41 C ATOM 1750 C LYS U 179 10.514 40.694 -11.993 1.00 69.01 C ATOM 1751 O LYS U 179 9.803 39.912 -12.603 1.00 67.13 O ATOM 1752 CB LYS U 179 12.765 39.790 -12.659 1.00 78.78 C ATOM 1753 CG LYS U 179 14.017 39.984 -13.509 1.00 83.96 C ATOM 1754 CD LYS U 179 15.256 39.326 -12.907 1.00 88.64 C ATOM 1755 CE LYS U 179 15.194 37.802 -12.872 1.00 88.37 C ATOM 1756 NZ LYS U 179 15.455 37.180 -14.199 1.00 90.36 N ATOM 1757 HZ1 LYS U 179 14.743 37.511 -14.881 1.00 0.00 H ATOM 1758 HZ2 LYS U 179 16.404 37.451 -14.527 1.00 0.00 H ATOM 1759 HZ3 LYS U 179 15.399 36.145 -14.112 1.00 0.00 H ATOM 1760 H LYS U 179 13.225 41.740 -10.965 1.00 0.00 H ATOM 1761 N MET U 180 10.141 41.265 -10.849 1.00 67.90 N ATOM 1762 CA MET U 180 8.812 41.117 -10.276 1.00 68.36 C ATOM 1763 C MET U 180 8.048 42.436 -10.388 1.00 67.84 C ATOM 1764 O MET U 180 8.655 43.516 -10.347 1.00 66.69 O ATOM 1765 CB MET U 180 8.923 40.743 -8.792 1.00 70.45 C ATOM 1766 CG MET U 180 9.664 39.444 -8.488 1.00 70.95 C ATOM 1767 SD MET U 180 9.967 39.247 -6.715 1.00 75.46 S ATOM 1768 CE MET U 180 10.666 37.600 -6.609 1.00 73.28 C ATOM 1769 H MET U 180 10.836 41.847 -10.339 1.00 0.00 H ATOM 1770 N LEU U 181 6.722 42.330 -10.533 1.00 68.94 N ATOM 1771 CA LEU U 181 5.786 43.463 -10.384 1.00 69.39 C ATOM 1772 C LEU U 181 4.946 43.312 -9.127 1.00 68.40 C ATOM 1773 O LEU U 181 4.668 42.198 -8.699 1.00 69.93 O ATOM 1774 CB LEU U 181 4.803 43.537 -11.552 1.00 69.62 C ATOM 1775 CG LEU U 181 5.261 44.090 -12.886 1.00 71.08 C ATOM 1776 CD1 LEU U 181 4.079 44.066 -13.838 1.00 70.42 C ATOM 1777 CD2 LEU U 181 5.815 45.498 -12.723 1.00 74.86 C ATOM 1778 H LEU U 181 6.328 41.396 -10.764 1.00 0.00 H ATOM 1779 N CYS U 182 4.520 44.442 -8.569 1.00 66.44 N ATOM 1780 CA CYS U 182 3.536 44.468 -7.493 1.00 63.45 C ATOM 1781 C CYS U 182 2.231 45.017 -8.010 1.00 61.13 C ATOM 1782 O CYS U 182 2.220 45.835 -8.926 1.00 65.14 O ATOM 1783 CB CYS U 182 4.021 45.357 -6.366 1.00 62.57 C ATOM 1784 SG CYS U 182 5.480 44.670 -5.612 1.00 63.77 S ATOM 1785 H CYS U 182 4.905 45.344 -8.914 1.00 0.00 H ATOM 1786 N ALA U 183 1.129 44.588 -7.415 1.00 58.05 N ATOM 1787 CA ALA U 183 -0.158 45.230 -7.685 1.00 60.95 C ATOM 1788 C ALA U 183 -1.083 45.077 -6.506 1.00 58.01 C ATOM 1789 O ALA U 183 -0.905 44.177 -5.693 1.00 58.05 O ATOM 1790 CB ALA U 183 -0.806 44.665 -8.940 1.00 61.97 C ATOM 1791 H ALA U 183 1.178 43.789 -6.751 1.00 0.00 H ATOM 1792 N ALA U 184 -2.056 45.974 -6.417 1.00 55.05 N ATOM 1793 CA ALA U 184 -2.984 45.973 -5.310 1.00 53.74 C ATOM 1794 C ALA U 184 -4.113 46.936 -5.561 1.00 57.33 C ATOM 1795 O ALA U 184 -4.034 47.814 -6.428 1.00 55.77 O ATOM 1796 CB ALA U 184 -2.288 46.341 -4.007 1.00 52.92 C ATOM 1797 H ALA U 184 -2.153 46.694 -7.161 1.00 0.00 H ATOM 1798 N ASP U 185 -5.170 46.731 -4.782 1.00 63.44 N ATOM 1799 CA ASP U 185 -6.291 47.650 -4.687 1.00 66.34 C ATOM 1800 C ASP U 185 -5.916 48.677 -3.621 1.00 67.58 C ATOM 1801 O ASP U 185 -5.437 48.291 -2.538 1.00 62.74 O ATOM 1802 CB ASP U 185 -7.556 46.898 -4.253 1.00 64.82 C ATOM 1803 CG ASP U 185 -8.777 47.780 -4.230 1.00 64.04 C ATOM 1804 OD1 ASP U 185 -9.276 48.101 -5.325 1.00 66.79 O ATOM 1805 OD2 ASP U 185 -9.230 48.161 -3.131 1.00 62.97 O ATOM 1806 H ASP U 185 -5.196 45.864 -4.208 1.00 0.00 H ATOM 1807 N PRO U 185A -6.145 49.980 -3.894 1.00 70.64 N ATOM 1808 CA PRO U 185A -5.773 51.010 -2.895 1.00 71.74 C ATOM 1809 C PRO U 185A -6.356 50.778 -1.494 1.00 73.39 C ATOM 1810 O PRO U 185A -5.682 51.049 -0.502 1.00 74.69 O ATOM 1811 CB PRO U 185A -6.307 52.311 -3.505 1.00 69.82 C ATOM 1812 CG PRO U 185A -7.242 51.894 -4.595 1.00 69.57 C ATOM 1813 CD PRO U 185A -6.749 50.580 -5.099 1.00 67.58 C ATOM 1814 N GLN U 185B -7.580 50.252 -1.432 1.00 73.26 N ATOM 1815 CA GLN U 185B -8.185 49.834 -0.174 1.00 71.86 C ATOM 1816 C GLN U 185B -7.696 48.477 0.342 1.00 72.19 C ATOM 1817 O GLN U 185B -8.054 48.101 1.451 1.00 80.93 O ATOM 1818 CB GLN U 185B -9.709 49.796 -0.314 1.00 74.42 C ATOM 1819 CG GLN U 185B -10.350 51.161 -0.441 1.00 80.50 C ATOM 1820 CD GLN U 185B -10.384 51.914 0.880 1.00 80.35 C ATOM 1821 OE1 GLN U 185B -11.015 51.478 1.842 1.00 77.93 O ATOM 1822 NE2 GLN U 185B -9.708 53.052 0.928 1.00 83.29 N ATOM 1823 HE22 GLN U 185B -9.188 53.384 0.091 1.00 0.00 H ATOM 1824 HE21 GLN U 185B -9.697 53.614 1.803 1.00 0.00 H ATOM 1825 H GLN U 185B -8.122 50.136 -2.312 1.00 0.00 H ATOM 1826 N TRP U 186 -6.890 47.746 -0.432 1.00 69.46 N ATOM 1827 CA TRP U 186 -6.517 46.345 -0.126 1.00 68.86 C ATOM 1828 C TRP U 186 -7.735 45.429 -0.035 1.00 66.20 C ATOM 1829 O TRP U 186 -7.728 44.439 0.676 1.00 65.62 O ATOM 1830 CB TRP U 186 -5.673 46.249 1.152 1.00 69.26 C ATOM 1831 CG TRP U 186 -4.580 47.256 1.177 1.00 73.98 C ATOM 1832 CD1 TRP U 186 -4.618 48.490 1.754 1.00 73.57 C ATOM 1833 CD2 TRP U 186 -3.288 47.131 0.573 1.00 73.17 C ATOM 1834 NE1 TRP U 186 -3.427 49.135 1.559 1.00 75.58 N ATOM 1835 CE2 TRP U 186 -2.595 48.329 0.828 1.00 72.70 C ATOM 1836 CE3 TRP U 186 -2.650 46.123 -0.159 1.00 70.37 C ATOM 1837 CZ2 TRP U 186 -1.291 48.547 0.385 1.00 70.60 C ATOM 1838 CZ3 TRP U 186 -1.357 46.338 -0.595 1.00 70.61 C ATOM 1839 CH2 TRP U 186 -0.692 47.543 -0.323 1.00 72.36 C ATOM 1840 HE1 TRP U 186 -3.191 50.085 1.910 1.00 0.00 H ATOM 1841 H TRP U 186 -6.504 48.182 -1.294 1.00 0.00 H ATOM 1842 N LYS U 187 -8.754 45.765 -0.812 1.00 69.10 N ATOM 1843 CA LYS U 187 -10.086 45.173 -0.742 1.00 71.69 C ATOM 1844 C LYS U 187 -10.194 43.891 -1.593 1.00 73.23 C ATOM 1845 O LYS U 187 -10.819 42.915 -1.173 1.00 75.61 O ATOM 1846 CB LYS U 187 -11.069 46.237 -1.227 1.00 75.33 C ATOM 1847 CG LYS U 187 -12.534 45.873 -1.263 1.00 83.90 C ATOM 1848 CD LYS U 187 -13.359 47.010 -1.861 1.00 89.52 C ATOM 1849 CE LYS U 187 -12.978 47.414 -3.283 1.00 92.28 C ATOM 1850 NZ LYS U 187 -12.728 46.270 -4.206 1.00 98.77 N ATOM 1851 HZ1 LYS U 187 -11.947 45.692 -3.836 1.00 0.00 H ATOM 1852 HZ2 LYS U 187 -13.588 45.689 -4.277 1.00 0.00 H ATOM 1853 HZ3 LYS U 187 -12.476 46.634 -5.147 1.00 0.00 H ATOM 1854 H LYS U 187 -8.593 46.505 -1.524 1.00 0.00 H ATOM 1855 N THR U 188 -9.589 43.908 -2.785 1.00 71.22 N ATOM 1856 CA THR U 188 -9.572 42.755 -3.704 1.00 65.68 C ATOM 1857 C THR U 188 -8.149 42.359 -4.049 1.00 62.53 C ATOM 1858 O THR U 188 -7.254 43.205 -4.046 1.00 67.68 O ATOM 1859 CB THR U 188 -10.320 43.024 -5.026 1.00 65.13 C ATOM 1860 OG1 THR U 188 -10.204 41.878 -5.875 1.00 63.59 O ATOM 1861 CG2 THR U 188 -9.756 44.227 -5.772 1.00 66.61 C ATOM 1862 HG1 THR U 188 -10.683 42.048 -6.724 1.00 0.00 H ATOM 1863 H THR U 188 -9.105 44.780 -3.080 1.00 0.00 H ATOM 1864 N ASP U 189 -7.948 41.085 -4.377 1.00 56.95 N ATOM 1865 CA ASP U 189 -6.601 40.556 -4.595 1.00 52.75 C ATOM 1866 C ASP U 189 -6.662 39.175 -5.199 1.00 49.72 C ATOM 1867 O ASP U 189 -7.716 38.542 -5.199 1.00 44.29 O ATOM 1868 CB ASP U 189 -5.859 40.467 -3.248 1.00 52.63 C ATOM 1869 CG ASP U 189 -4.363 40.284 -3.388 1.00 51.11 C ATOM 1870 OD1 ASP U 189 -3.783 40.379 -4.488 1.00 51.51 O ATOM 1871 OD2 ASP U 189 -3.758 40.030 -2.348 1.00 52.52 O ATOM 1872 H ASP U 189 -8.766 40.451 -4.481 1.00 0.00 H ATOM 1873 N SER U 190 -5.519 38.737 -5.723 1.00 49.94 N ATOM 1874 CA SER U 190 -5.229 37.326 -5.937 1.00 49.75 C ATOM 1875 C SER U 190 -4.997 36.596 -4.617 1.00 51.38 C ATOM 1876 O SER U 190 -4.690 37.210 -3.583 1.00 49.63 O ATOM 1877 CB SER U 190 -4.017 37.132 -6.865 1.00 50.87 C ATOM 1878 OG SER U 190 -2.969 38.058 -6.626 1.00 49.34 O ATOM 1879 HG SER U 190 -3.306 38.979 -6.765 1.00 0.00 H ATOM 1880 H SER U 190 -4.798 39.437 -5.993 1.00 0.00 H ATOM 1881 N CYS U 191 -5.137 35.272 -4.694 1.00 52.97 N ATOM 1882 CA CYS U 191 -4.954 34.356 -3.576 1.00 54.93 C ATOM 1883 C CYS U 191 -4.479 32.960 -4.032 1.00 53.89 C ATOM 1884 O CYS U 191 -4.239 32.743 -5.227 1.00 51.88 O ATOM 1885 CB CYS U 191 -6.298 34.241 -2.850 1.00 57.98 C ATOM 1886 SG CYS U 191 -6.245 33.209 -1.369 1.00 64.58 S ATOM 1887 H CYS U 191 -5.395 34.865 -5.616 1.00 0.00 H ATOM 1888 N GLN U 192 -4.340 32.018 -3.094 1.00 54.22 N ATOM 1889 CA GLN U 192 -3.872 30.653 -3.425 1.00 54.37 C ATOM 1890 C GLN U 192 -4.806 30.027 -4.465 1.00 52.46 C ATOM 1891 O GLN U 192 -6.029 30.155 -4.371 1.00 47.27 O ATOM 1892 CB GLN U 192 -3.805 29.781 -2.164 1.00 54.96 C ATOM 1893 CG GLN U 192 -3.492 28.307 -2.405 1.00 56.69 C ATOM 1894 CD GLN U 192 -3.439 27.458 -1.138 1.00 57.64 C ATOM 1895 OE1 GLN U 192 -4.120 26.446 -1.062 1.00 64.28 O ATOM 1896 NE2 GLN U 192 -2.673 27.871 -0.138 1.00 58.93 N ATOM 1897 HE22 GLN U 192 -2.107 28.738 -0.240 1.00 0.00 H ATOM 1898 HE21 GLN U 192 -2.638 27.328 0.748 1.00 0.00 H ATOM 1899 H GLN U 192 -4.567 32.250 -2.106 1.00 0.00 H ATOM 1900 N GLY U 193 -4.219 29.366 -5.460 1.00 54.20 N ATOM 1901 CA GLY U 193 -4.993 28.774 -6.567 1.00 54.53 C ATOM 1902 C GLY U 193 -5.071 29.668 -7.799 1.00 53.67 C ATOM 1903 O GLY U 193 -5.303 29.176 -8.914 1.00 50.95 O ATOM 1904 H GLY U 193 -3.184 29.264 -5.457 1.00 0.00 H ATOM 1905 N ASP U 194 -4.896 30.978 -7.600 1.00 51.52 N ATOM 1906 CA ASP U 194 -4.775 31.922 -8.709 1.00 51.53 C ATOM 1907 C ASP U 194 -3.407 31.859 -9.408 1.00 52.51 C ATOM 1908 O ASP U 194 -3.285 32.283 -10.561 1.00 56.98 O ATOM 1909 CB ASP U 194 -5.025 33.349 -8.217 1.00 49.24 C ATOM 1910 CG ASP U 194 -6.441 33.567 -7.761 1.00 46.96 C ATOM 1911 OD1 ASP U 194 -7.355 33.289 -8.546 1.00 47.33 O ATOM 1912 OD2 ASP U 194 -6.661 34.030 -6.626 1.00 47.24 O ATOM 1913 H ASP U 194 -4.844 31.337 -6.625 1.00 0.00 H ATOM 1914 N SER U 195 -2.401 31.339 -8.695 1.00 50.93 N ATOM 1915 CA SER U 195 -1.006 31.261 -9.149 1.00 48.26 C ATOM 1916 C SER U 195 -0.891 30.664 -10.546 1.00 46.45 C ATOM 1917 O SER U 195 -1.641 29.757 -10.898 1.00 44.80 O ATOM 1918 CB SER U 195 -0.174 30.426 -8.148 1.00 47.43 C ATOM 1919 OG SER U 195 -0.347 30.866 -6.802 1.00 45.44 O ATOM 1920 HG SER U 195 0.202 30.305 -6.199 1.00 0.00 H ATOM 1921 H SER U 195 -2.623 30.963 -7.751 1.00 0.00 H ATOM 1922 N GLY U 196 0.021 31.203 -11.350 1.00 46.54 N ATOM 1923 CA GLY U 196 0.123 30.842 -12.768 1.00 48.83 C ATOM 1924 C GLY U 196 -0.871 31.588 -13.663 1.00 51.49 C ATOM 1925 O GLY U 196 -0.658 31.714 -14.879 1.00 54.06 O ATOM 1926 H GLY U 196 0.684 31.904 -10.960 1.00 0.00 H ATOM 1927 N GLY U 197 -1.954 32.092 -13.073 1.00 51.83 N ATOM 1928 CA GLY U 197 -2.952 32.854 -13.794 1.00 51.83 C ATOM 1929 C GLY U 197 -2.430 34.214 -14.223 1.00 51.33 C ATOM 1930 O GLY U 197 -1.394 34.658 -13.720 1.00 48.08 O ATOM 1931 H GLY U 197 -2.088 31.932 -12.054 1.00 0.00 H ATOM 1932 N PRO U 198 -3.157 34.889 -15.149 1.00 53.40 N ATOM 1933 CA PRO U 198 -2.683 36.118 -15.805 1.00 56.35 C ATOM 1934 C PRO U 198 -2.818 37.448 -15.033 1.00 56.91 C ATOM 1935 O PRO U 198 -3.594 37.553 -14.080 1.00 62.37 O ATOM 1936 CB PRO U 198 -3.536 36.164 -17.084 1.00 55.96 C ATOM 1937 CG PRO U 198 -4.802 35.489 -16.708 1.00 54.38 C ATOM 1938 CD PRO U 198 -4.398 34.390 -15.779 1.00 52.64 C ATOM 1939 N LEU U 199 -2.023 38.432 -15.450 1.00 52.35 N ATOM 1940 CA LEU U 199 -2.236 39.833 -15.119 1.00 51.72 C ATOM 1941 C LEU U 199 -2.205 40.530 -16.465 1.00 52.50 C ATOM 1942 O LEU U 199 -1.146 40.613 -17.086 1.00 55.98 O ATOM 1943 CB LEU U 199 -1.139 40.358 -14.186 1.00 50.91 C ATOM 1944 CG LEU U 199 -1.038 41.856 -13.875 1.00 48.99 C ATOM 1945 CD1 LEU U 199 -2.251 42.336 -13.109 1.00 49.65 C ATOM 1946 CD2 LEU U 199 0.210 42.133 -13.058 1.00 48.81 C ATOM 1947 H LEU U 199 -1.206 38.186 -16.044 1.00 0.00 H ATOM 1948 N VAL U 200 -3.368 40.984 -16.925 1.00 52.30 N ATOM 1949 CA VAL U 200 -3.521 41.525 -18.260 1.00 53.39 C ATOM 1950 C VAL U 200 -3.825 42.989 -18.160 1.00 57.74 C ATOM 1951 O VAL U 200 -4.915 43.363 -17.716 1.00 61.66 O ATOM 1952 CB VAL U 200 -4.690 40.870 -19.010 1.00 54.63 C ATOM 1953 CG1 VAL U 200 -4.861 41.493 -20.396 1.00 54.72 C ATOM 1954 CG2 VAL U 200 -4.467 39.374 -19.107 1.00 57.27 C ATOM 1955 H VAL U 200 -4.200 40.949 -16.302 1.00 0.00 H ATOM 1956 N CYS U 201 -2.865 43.819 -18.552 1.00 60.90 N ATOM 1957 CA CYS U 201 -3.117 45.238 -18.732 1.00 65.39 C ATOM 1958 C CYS U 201 -3.352 45.522 -20.212 1.00 70.11 C ATOM 1959 O CYS U 201 -2.822 44.826 -21.088 1.00 65.76 O ATOM 1960 CB CYS U 201 -1.945 46.068 -18.233 1.00 66.78 C ATOM 1961 SG CYS U 201 -1.438 45.859 -16.504 1.00 66.24 S ATOM 1962 H CYS U 201 -1.912 43.445 -18.734 1.00 0.00 H ATOM 1963 N SER U 202 -4.169 46.538 -20.487 1.00 76.67 N ATOM 1964 CA SER U 202 -4.310 47.042 -21.843 1.00 76.43 C ATOM 1965 C SER U 202 -3.163 47.999 -22.043 1.00 75.26 C ATOM 1966 O SER U 202 -2.968 48.907 -21.247 1.00 76.01 O ATOM 1967 CB SER U 202 -5.639 47.751 -22.077 1.00 75.48 C ATOM 1968 OG SER U 202 -5.808 47.987 -23.464 1.00 75.37 O ATOM 1969 HG SER U 202 -6.671 48.447 -23.616 1.00 0.00 H ATOM 1970 H SER U 202 -4.715 46.978 -19.719 1.00 0.00 H ATOM 1971 N LEU U 203 -2.377 47.767 -23.076 1.00 77.86 N ATOM 1972 CA LEU U 203 -1.234 48.600 -23.341 1.00 82.43 C ATOM 1973 C LEU U 203 -1.188 48.883 -24.824 1.00 86.68 C ATOM 1974 O LEU U 203 -1.235 47.957 -25.635 1.00 79.67 O ATOM 1975 CB LEU U 203 0.031 47.892 -22.870 1.00 84.61 C ATOM 1976 CG LEU U 203 1.331 48.700 -22.827 1.00 88.69 C ATOM 1977 CD1 LEU U 203 1.198 50.032 -22.090 1.00 88.55 C ATOM 1978 CD2 LEU U 203 2.412 47.837 -22.191 1.00 89.65 C ATOM 1979 H LEU U 203 -2.587 46.969 -23.709 1.00 0.00 H ATOM 1980 N GLN U 204 -1.101 50.172 -25.157 1.00 96.63 N ATOM 1981 CA GLN U 204 -1.144 50.668 -26.541 1.00105.96 C ATOM 1982 C GLN U 204 -2.439 50.240 -27.264 1.00107.72 C ATOM 1983 O GLN U 204 -2.423 49.868 -28.442 1.00108.33 O ATOM 1984 CB GLN U 204 0.142 50.276 -27.321 1.00109.53 C ATOM 1985 CG GLN U 204 1.288 51.295 -27.252 1.00111.33 C ATOM 1986 CD GLN U 204 2.138 51.202 -25.982 1.00110.71 C ATOM 1987 OE1 GLN U 204 1.656 51.451 -24.872 1.00106.73 O ATOM 1988 NE2 GLN U 204 3.419 50.866 -26.148 1.00105.58 N ATOM 1989 HE22 GLN U 204 3.784 50.664 -27.101 1.00 0.00 H ATOM 1990 HE21 GLN U 204 4.052 50.806 -25.325 1.00 0.00 H ATOM 1991 H GLN U 204 -0.996 50.868 -24.392 1.00 0.00 H ATOM 1992 N GLY U 205 -3.538 50.235 -26.540 1.00110.58 N ATOM 1993 CA GLY U 205 -4.810 49.992 -27.171 1.00111.11 C ATOM 1994 C GLY U 205 -5.113 48.558 -27.490 1.00110.77 C ATOM 1995 O GLY U 205 -6.053 48.271 -28.221 1.00110.50 O ATOM 1996 H GLY U 205 -3.488 50.406 -25.515 1.00 0.00 H ATOM 1997 N ARG U 206 -4.344 47.679 -26.861 1.00106.21 N ATOM 1998 CA ARG U 206 -4.516 46.252 -26.997 1.00 99.29 C ATOM 1999 C ARG U 206 -4.219 45.564 -25.686 1.00 86.22 C ATOM 2000 O ARG U 206 -3.393 46.029 -24.935 1.00 79.57 O ATOM 2001 CB ARG U 206 -3.592 45.746 -28.096 1.00104.12 C ATOM 2002 CG ARG U 206 -3.734 46.533 -29.397 1.00107.44 C ATOM 2003 CD ARG U 206 -4.294 45.678 -30.523 1.00107.63 C ATOM 2004 NE ARG U 206 -3.380 45.621 -31.661 1.00109.68 N ATOM 2005 CZ ARG U 206 -3.428 44.705 -32.618 1.00109.69 C ATOM 2006 NH1 ARG U 206 -2.547 44.734 -33.605 1.00102.56 N ATOM 2007 NH2 ARG U 206 -4.348 43.762 -32.585 1.00115.32 N ATOM 2008 HE ARG U 206 -2.640 46.349 -31.725 1.00 0.00 H ATOM 2009 HH12 ARG U 206 -2.584 44.016 -34.356 1.00 0.00 H ATOM 2010 HH11 ARG U 206 -1.818 45.475 -33.629 1.00 0.00 H ATOM 2011 HH22 ARG U 206 -4.384 43.044 -33.337 1.00 0.00 H ATOM 2012 HH21 ARG U 206 -5.038 43.736 -31.807 1.00 0.00 H ATOM 2013 H ARG U 206 -3.585 48.033 -26.244 1.00 0.00 H ATOM 2014 N MET U 207 -4.908 44.467 -25.407 1.00 79.38 N ATOM 2015 CA MET U 207 -4.659 43.739 -24.174 1.00 76.99 C ATOM 2016 C MET U 207 -3.369 42.941 -24.165 1.00 72.37 C ATOM 2017 O MET U 207 -3.045 42.285 -25.121 1.00 64.39 O ATOM 2018 CB MET U 207 -5.833 42.821 -23.869 1.00 74.85 C ATOM 2019 CG MET U 207 -7.102 43.527 -23.459 1.00 73.44 C ATOM 2020 SD MET U 207 -7.052 44.100 -21.778 1.00 73.14 S ATOM 2021 CE MET U 207 -8.257 43.067 -21.006 1.00 72.49 C ATOM 2022 H MET U 207 -5.630 44.126 -26.073 1.00 0.00 H ATOM 2023 N THR U 208 -2.676 42.949 -23.040 1.00 69.20 N ATOM 2024 CA THR U 208 -1.297 42.511 -22.994 1.00 67.56 C ATOM 2025 C THR U 208 -1.003 41.802 -21.676 1.00 64.20 C ATOM 2026 O THR U 208 -1.353 42.298 -20.612 1.00 60.87 O ATOM 2027 CB THR U 208 -0.363 43.721 -23.132 1.00 67.39 C ATOM 2028 OG1 THR U 208 -0.793 44.533 -24.225 1.00 72.57 O ATOM 2029 CG2 THR U 208 1.048 43.282 -23.400 1.00 71.53 C ATOM 2030 HG1 THR U 208 -1.717 44.846 -24.058 1.00 0.00 H ATOM 2031 H THR U 208 -3.133 43.278 -22.166 1.00 0.00 H ATOM 2032 N LEU U 209 -0.346 40.646 -21.761 1.00 62.39 N ATOM 2033 CA LEU U 209 -0.035 39.847 -20.586 1.00 59.67 C ATOM 2034 C LEU U 209 1.159 40.431 -19.858 1.00 58.24 C ATOM 2035 O LEU U 209 2.308 40.117 -20.171 1.00 62.01 O ATOM 2036 CB LEU U 209 0.237 38.396 -20.967 1.00 58.49 C ATOM 2037 CG LEU U 209 0.616 37.461 -19.815 1.00 58.28 C ATOM 2038 CD1 LEU U 209 -0.372 37.577 -18.668 1.00 58.66 C ATOM 2039 CD2 LEU U 209 0.708 36.022 -20.315 1.00 59.27 C ATOM 2040 H LEU U 209 -0.046 40.304 -22.696 1.00 0.00 H ATOM 2041 N THR U 210 0.865 41.274 -18.879 1.00 53.79 N ATOM 2042 CA THR U 210 1.870 42.019 -18.144 1.00 53.05 C ATOM 2043 C THR U 210 2.528 41.210 -17.024 1.00 55.21 C ATOM 2044 O THR U 210 3.704 41.430 -16.696 1.00 57.47 O ATOM 2045 CB THR U 210 1.219 43.252 -17.535 1.00 53.16 C ATOM 2046 OG1 THR U 210 0.346 43.824 -18.506 1.00 54.81 O ATOM 2047 CG2 THR U 210 2.243 44.265 -17.145 1.00 55.72 C ATOM 2048 HG1 THR U 210 -0.347 43.162 -18.756 1.00 0.00 H ATOM 2049 H THR U 210 -0.135 41.408 -18.625 1.00 0.00 H ATOM 2050 N GLY U 211 1.777 40.281 -16.435 1.00 54.20 N ATOM 2051 CA GLY U 211 2.300 39.483 -15.334 1.00 54.32 C ATOM 2052 C GLY U 211 1.660 38.122 -15.145 1.00 57.35 C ATOM 2053 O GLY U 211 0.568 37.848 -15.661 1.00 58.24 O ATOM 2054 H GLY U 211 0.804 40.123 -16.766 1.00 0.00 H ATOM 2055 N ILE U 212 2.362 37.271 -14.393 1.00 57.26 N ATOM 2056 CA ILE U 212 1.868 35.956 -13.976 1.00 54.80 C ATOM 2057 C ILE U 212 1.781 35.957 -12.453 1.00 55.19 C ATOM 2058 O ILE U 212 2.777 36.232 -11.787 1.00 55.26 O ATOM 2059 CB ILE U 212 2.818 34.835 -14.431 1.00 53.09 C ATOM 2060 CG1 ILE U 212 2.876 34.779 -15.962 1.00 53.87 C ATOM 2061 CG2 ILE U 212 2.382 33.481 -13.867 1.00 53.47 C ATOM 2062 CD1 ILE U 212 4.083 34.037 -16.507 1.00 54.56 C ATOM 2063 H ILE U 212 3.313 37.558 -14.086 1.00 0.00 H ATOM 2064 N VAL U 213 0.602 35.637 -11.917 1.00 54.96 N ATOM 2065 CA VAL U 213 0.375 35.598 -10.466 1.00 58.84 C ATOM 2066 C VAL U 213 1.437 34.686 -9.827 1.00 58.70 C ATOM 2067 O VAL U 213 1.555 33.522 -10.217 1.00 62.59 O ATOM 2068 CB VAL U 213 -1.052 35.075 -10.108 1.00 62.43 C ATOM 2069 CG1 VAL U 213 -1.265 35.036 -8.591 1.00 63.88 C ATOM 2070 CG2 VAL U 213 -2.147 35.910 -10.776 1.00 61.84 C ATOM 2071 H VAL U 213 -0.188 35.406 -12.552 1.00 0.00 H ATOM 2072 N SER U 214 2.199 35.214 -8.862 1.00 57.39 N ATOM 2073 CA SER U 214 3.365 34.509 -8.295 1.00 58.05 C ATOM 2074 C SER U 214 3.314 34.288 -6.780 1.00 57.05 C ATOM 2075 O SER U 214 3.373 33.136 -6.327 1.00 57.71 O ATOM 2076 CB SER U 214 4.665 35.233 -8.657 1.00 58.34 C ATOM 2077 OG SER U 214 5.795 34.467 -8.273 1.00 57.76 O ATOM 2078 HG SER U 214 5.775 33.595 -8.741 1.00 0.00 H ATOM 2079 H SER U 214 1.960 36.158 -8.497 1.00 0.00 H ATOM 2080 N TRP U 215 3.248 35.364 -5.995 1.00 54.84 N ATOM 2081 CA TRP U 215 3.270 35.217 -4.536 1.00 56.92 C ATOM 2082 C TRP U 215 2.717 36.412 -3.751 1.00 55.77 C ATOM 2083 O TRP U 215 2.444 37.454 -4.320 1.00 54.58 O ATOM 2084 CB TRP U 215 4.691 34.839 -4.069 1.00 58.61 C ATOM 2085 CG TRP U 215 5.721 35.901 -4.240 1.00 60.22 C ATOM 2086 CD1 TRP U 215 6.482 36.162 -5.353 1.00 58.48 C ATOM 2087 CD2 TRP U 215 6.121 36.845 -3.249 1.00 61.96 C ATOM 2088 NE1 TRP U 215 7.322 37.222 -5.114 1.00 56.95 N ATOM 2089 CE2 TRP U 215 7.111 37.670 -3.834 1.00 59.77 C ATOM 2090 CE3 TRP U 215 5.731 37.084 -1.923 1.00 59.27 C ATOM 2091 CZ2 TRP U 215 7.723 38.706 -3.130 1.00 60.11 C ATOM 2092 CZ3 TRP U 215 6.339 38.110 -1.228 1.00 59.76 C ATOM 2093 CH2 TRP U 215 7.325 38.911 -1.833 1.00 60.92 C ATOM 2094 HE1 TRP U 215 8.005 37.619 -5.791 1.00 0.00 H ATOM 2095 H TRP U 215 3.181 36.311 -6.419 1.00 0.00 H ATOM 2096 N GLY U 216 2.571 36.250 -2.453 1.00 57.45 N ATOM 2097 CA GLY U 216 2.082 37.300 -1.604 1.00 57.83 C ATOM 2098 C GLY U 216 1.975 36.749 -0.216 1.00 58.12 C ATOM 2099 O GLY U 216 1.973 35.565 -0.036 1.00 55.59 O ATOM 2100 H GLY U 216 2.817 35.333 -2.029 1.00 0.00 H ATOM 2101 N ARG U 217 1.921 37.632 0.762 1.00 65.14 N ATOM 2102 CA ARG U 217 1.761 37.253 2.149 1.00 67.37 C ATOM 2103 C ARG U 217 0.320 37.517 2.478 1.00 66.96 C ATOM 2104 O ARG U 217 -0.065 38.651 2.645 1.00 67.02 O ATOM 2105 CB ARG U 217 2.680 38.082 3.045 1.00 71.99 C ATOM 2106 CG ARG U 217 2.618 37.798 4.544 1.00 77.28 C ATOM 2107 CD ARG U 217 3.093 36.392 4.928 1.00 84.66 C ATOM 2108 NE ARG U 217 2.312 35.796 6.012 1.00 86.88 N ATOM 2109 CZ ARG U 217 1.519 34.738 5.883 1.00 86.31 C ATOM 2110 NH1 ARG U 217 1.393 34.125 4.721 1.00 84.53 N ATOM 2111 NH2 ARG U 217 0.852 34.291 6.927 1.00 87.03 N ATOM 2112 HE ARG U 217 2.383 36.233 6.953 1.00 0.00 H ATOM 2113 HH12 ARG U 217 0.769 33.298 4.634 1.00 0.00 H ATOM 2114 HH11 ARG U 217 1.918 34.469 3.892 1.00 0.00 H ATOM 2115 HH22 ARG U 217 0.230 33.463 6.831 1.00 0.00 H ATOM 2116 HH21 ARG U 217 0.947 34.766 7.847 1.00 0.00 H ATOM 2117 H ARG U 217 1.997 38.642 0.527 1.00 0.00 H ATOM 2118 N GLY U 219 -0.472 36.453 2.542 1.00 81.72 N ATOM 2119 CA GLY U 219 -1.890 36.553 2.773 1.00 80.03 C ATOM 2120 C GLY U 219 -2.535 37.220 1.601 1.00 74.81 C ATOM 2121 O GLY U 219 -2.020 38.186 1.080 1.00 75.40 O ATOM 2122 H GLY U 219 -0.051 35.510 2.420 1.00 0.00 H ATOM 2123 N CYS U 220 -3.660 36.692 1.168 1.00 66.99 N ATOM 2124 CA CYS U 220 -4.392 37.320 0.126 1.00 62.49 C ATOM 2125 C CYS U 220 -5.031 38.570 0.695 1.00 64.11 C ATOM 2126 O CYS U 220 -5.675 38.524 1.709 1.00 65.56 O ATOM 2127 CB CYS U 220 -5.423 36.357 -0.387 1.00 59.72 C ATOM 2128 SG CYS U 220 -4.825 34.691 -0.617 1.00 58.80 S ATOM 2129 H CYS U 220 -4.015 35.811 1.591 1.00 0.00 H ATOM 2130 N ALA U 221 -4.819 39.694 0.030 1.00 63.32 N ATOM 2131 CA ALA U 221 -5.449 40.963 0.366 1.00 62.36 C ATOM 2132 C ALA U 221 -5.275 41.432 1.788 1.00 65.57 C ATOM 2133 O ALA U 221 -6.210 41.448 2.553 1.00 66.93 O ATOM 2134 CB ALA U 221 -6.910 40.934 -0.003 1.00 60.89 C ATOM 2135 H ALA U 221 -4.165 39.670 -0.779 1.00 0.00 H ATOM 2136 N LEU U 222 -4.069 41.858 2.127 1.00 69.87 N ATOM 2137 CA LEU U 222 -3.773 42.367 3.450 1.00 72.74 C ATOM 2138 C LEU U 222 -3.230 43.760 3.301 1.00 74.99 C ATOM 2139 O LEU U 222 -2.628 44.069 2.309 1.00 76.30 O ATOM 2140 CB LEU U 222 -2.710 41.516 4.107 1.00 71.91 C ATOM 2141 CG LEU U 222 -3.035 40.198 4.774 1.00 73.78 C ATOM 2142 CD1 LEU U 222 -1.829 39.739 5.557 1.00 72.53 C ATOM 2143 CD2 LEU U 222 -4.218 40.329 5.697 1.00 75.23 C ATOM 2144 H LEU U 222 -3.308 41.826 1.419 1.00 0.00 H ATOM 2145 N LYS U 223 -3.415 44.611 4.291 1.00 79.75 N ATOM 2146 CA LYS U 223 -2.878 45.968 4.182 1.00 81.72 C ATOM 2147 C LYS U 223 -1.344 45.933 4.059 1.00 78.77 C ATOM 2148 O LYS U 223 -0.665 45.159 4.738 1.00 75.74 O ATOM 2149 CB LYS U 223 -3.317 46.856 5.359 1.00 85.48 C ATOM 2150 CG LYS U 223 -3.323 48.351 5.029 1.00 88.14 C ATOM 2151 CD LYS U 223 -3.188 49.229 6.269 1.00 90.19 C ATOM 2152 CE LYS U 223 -2.750 50.650 5.929 1.00 93.29 C ATOM 2153 NZ LYS U 223 -2.004 51.284 7.060 1.00 95.08 N ATOM 2154 HZ1 LYS U 223 -2.616 51.321 7.900 1.00 0.00 H ATOM 2155 HZ2 LYS U 223 -1.156 50.721 7.273 1.00 0.00 H ATOM 2156 HZ3 LYS U 223 -1.723 52.249 6.791 1.00 0.00 H ATOM 2157 H LYS U 223 -3.938 44.320 5.142 1.00 0.00 H ATOM 2158 N ASP U 223A -0.834 46.788 3.178 1.00 76.97 N ATOM 2159 CA ASP U 223A 0.590 46.911 2.851 1.00 76.99 C ATOM 2160 C ASP U 223A 1.299 45.661 2.311 1.00 70.05 C ATOM 2161 O ASP U 223A 2.511 45.601 2.333 1.00 72.02 O ATOM 2162 CB ASP U 223A 1.351 47.499 4.052 1.00 80.96 C ATOM 2163 CG ASP U 223A 0.774 48.830 4.512 1.00 87.92 C ATOM 2164 OD1 ASP U 223A 0.024 49.481 3.741 1.00 89.45 O ATOM 2165 OD2 ASP U 223A 1.072 49.228 5.653 1.00 95.60 O ATOM 2166 H ASP U 223A -1.496 47.418 2.682 1.00 0.00 H ATOM 2167 N LYS U 224 0.567 44.689 1.786 1.00 64.77 N ATOM 2168 CA LYS U 224 1.196 43.504 1.202 1.00 61.88 C ATOM 2169 C LYS U 224 0.536 43.300 -0.142 1.00 59.56 C ATOM 2170 O LYS U 224 -0.511 42.672 -0.230 1.00 64.41 O ATOM 2171 CB LYS U 224 1.028 42.262 2.100 1.00 62.93 C ATOM 2172 CG LYS U 224 1.423 42.447 3.560 1.00 63.65 C ATOM 2173 CD LYS U 224 2.909 42.726 3.747 1.00 64.32 C ATOM 2174 CE LYS U 224 3.150 43.553 4.998 1.00 68.33 C ATOM 2175 NZ LYS U 224 4.534 44.107 5.042 1.00 72.33 N ATOM 2176 HZ1 LYS U 224 5.220 43.325 5.031 1.00 0.00 H ATOM 2177 HZ2 LYS U 224 4.689 44.717 4.214 1.00 0.00 H ATOM 2178 HZ3 LYS U 224 4.656 44.664 5.912 1.00 0.00 H ATOM 2179 H LYS U 224 -0.470 44.770 1.789 1.00 0.00 H ATOM 2180 N PRO U 225 1.109 43.875 -1.200 1.00 56.83 N ATOM 2181 CA PRO U 225 0.498 43.641 -2.514 1.00 55.77 C ATOM 2182 C PRO U 225 0.577 42.196 -2.996 1.00 53.11 C ATOM 2183 O PRO U 225 1.137 41.337 -2.336 1.00 54.84 O ATOM 2184 CB PRO U 225 1.295 44.564 -3.452 1.00 57.28 C ATOM 2185 CG PRO U 225 2.446 45.070 -2.653 1.00 58.67 C ATOM 2186 CD PRO U 225 2.041 45.010 -1.220 1.00 57.44 C ATOM 2187 N GLY U 226 -0.027 41.928 -4.140 1.00 52.09 N ATOM 2188 CA GLY U 226 0.245 40.699 -4.872 1.00 48.93 C ATOM 2189 C GLY U 226 1.525 40.945 -5.632 1.00 45.42 C ATOM 2190 O GLY U 226 1.816 42.095 -5.968 1.00 44.04 O ATOM 2191 H GLY U 226 -0.711 42.609 -4.526 1.00 0.00 H ATOM 2192 N VAL U 227 2.285 39.873 -5.877 1.00 45.19 N ATOM 2193 CA VAL U 227 3.550 39.921 -6.631 1.00 42.92 C ATOM 2194 C VAL U 227 3.446 38.991 -7.820 1.00 42.21 C ATOM 2195 O VAL U 227 2.990 37.875 -7.684 1.00 42.85 O ATOM 2196 CB VAL U 227 4.769 39.507 -5.791 1.00 43.03 C ATOM 2197 CG1 VAL U 227 6.051 39.871 -6.537 1.00 43.32 C ATOM 2198 CG2 VAL U 227 4.732 40.167 -4.409 1.00 43.07 C ATOM 2199 H VAL U 227 1.965 38.952 -5.515 1.00 0.00 H ATOM 2200 N TYR U 228 3.869 39.475 -8.981 1.00 45.16 N ATOM 2201 CA TYR U 228 3.633 38.817 -10.270 1.00 46.30 C ATOM 2202 C TYR U 228 4.935 38.831 -11.047 1.00 46.37 C ATOM 2203 O TYR U 228 5.740 39.758 -10.918 1.00 45.15 O ATOM 2204 CB TYR U 228 2.562 39.570 -11.089 1.00 47.59 C ATOM 2205 CG TYR U 228 1.213 39.714 -10.402 1.00 49.00 C ATOM 2206 CD1 TYR U 228 1.048 40.571 -9.308 1.00 48.92 C ATOM 2207 CD2 TYR U 228 0.096 39.011 -10.853 1.00 51.00 C ATOM 2208 CE1 TYR U 228 -0.171 40.698 -8.660 1.00 48.86 C ATOM 2209 CE2 TYR U 228 -1.133 39.134 -10.210 1.00 53.04 C ATOM 2210 CZ TYR U 228 -1.264 39.981 -9.111 1.00 51.63 C ATOM 2211 OH TYR U 228 -2.479 40.105 -8.455 1.00 50.04 O ATOM 2212 HH TYR U 228 -2.755 39.221 -8.104 1.00 0.00 H ATOM 2213 H TYR U 228 4.397 40.371 -8.976 1.00 0.00 H ATOM 2214 N THR U 229 5.143 37.814 -11.869 1.00 47.58 N ATOM 2215 CA THR U 229 6.351 37.768 -12.693 1.00 49.60 C ATOM 2216 C THR U 229 6.242 38.846 -13.813 1.00 51.55 C ATOM 2217 O THR U 229 5.247 38.924 -14.536 1.00 50.15 O ATOM 2218 CB THR U 229 6.662 36.337 -13.246 1.00 47.94 C ATOM 2219 OG1 THR U 229 6.532 35.343 -12.218 1.00 42.90 O ATOM 2220 CG2 THR U 229 8.079 36.264 -13.759 1.00 49.23 C ATOM 2221 HG1 THR U 229 6.734 34.451 -12.596 1.00 0.00 H ATOM 2222 H THR U 229 4.445 37.045 -11.929 1.00 0.00 H ATOM 2223 N ARG U 230 7.259 39.699 -13.906 1.00 54.30 N ATOM 2224 CA ARG U 230 7.279 40.788 -14.867 1.00 56.59 C ATOM 2225 C ARG U 230 7.623 40.230 -16.233 1.00 56.05 C ATOM 2226 O ARG U 230 8.787 40.034 -16.536 1.00 54.87 O ATOM 2227 CB ARG U 230 8.309 41.821 -14.442 1.00 59.30 C ATOM 2228 CG ARG U 230 8.242 43.147 -15.173 1.00 63.43 C ATOM 2229 CD ARG U 230 9.070 44.119 -14.371 1.00 66.61 C ATOM 2230 NE ARG U 230 9.166 45.451 -14.929 1.00 70.01 N ATOM 2231 CZ ARG U 230 9.886 46.426 -14.378 1.00 74.64 C ATOM 2232 NH1 ARG U 230 10.579 46.221 -13.256 1.00 71.88 N ATOM 2233 NH2 ARG U 230 9.928 47.618 -14.963 1.00 83.04 N ATOM 2234 HE ARG U 230 8.646 45.657 -15.806 1.00 0.00 H ATOM 2235 HH12 ARG U 230 11.136 46.995 -12.840 1.00 0.00 H ATOM 2236 HH11 ARG U 230 10.562 45.288 -12.798 1.00 0.00 H ATOM 2237 HH22 ARG U 230 10.488 48.386 -14.540 1.00 0.00 H ATOM 2238 HH21 ARG U 230 9.401 47.784 -15.844 1.00 0.00 H ATOM 2239 H ARG U 230 8.070 39.582 -13.266 1.00 0.00 H ATOM 2240 N VAL U 231 6.604 40.007 -17.057 1.00 55.66 N ATOM 2241 CA VAL U 231 6.755 39.251 -18.304 1.00 55.59 C ATOM 2242 C VAL U 231 7.695 39.929 -19.314 1.00 55.34 C ATOM 2243 O VAL U 231 8.527 39.266 -19.925 1.00 55.17 O ATOM 2244 CB VAL U 231 5.383 38.993 -18.957 1.00 60.08 C ATOM 2245 CG1 VAL U 231 5.525 38.300 -20.317 1.00 60.60 C ATOM 2246 CG2 VAL U 231 4.519 38.158 -18.025 1.00 61.28 C ATOM 2247 H VAL U 231 5.666 40.382 -16.808 1.00 0.00 H ATOM 2248 N SER U 232 7.574 41.244 -19.475 1.00 54.10 N ATOM 2249 CA SER U 232 8.506 42.036 -20.299 1.00 52.68 C ATOM 2250 C SER U 232 10.008 41.698 -20.050 1.00 53.99 C ATOM 2251 O SER U 232 10.848 41.748 -20.969 1.00 49.80 O ATOM 2252 CB SER U 232 8.233 43.522 -20.047 1.00 50.95 C ATOM 2253 OG SER U 232 8.521 43.875 -18.702 1.00 50.52 O ATOM 2254 HG SER U 232 8.336 44.838 -18.568 1.00 0.00 H ATOM 2255 H SER U 232 6.789 41.734 -19.000 1.00 0.00 H ATOM 2256 N HIS U 233 10.317 41.337 -18.804 1.00 55.28 N ATOM 2257 CA HIS U 233 11.663 40.919 -18.403 1.00 57.42 C ATOM 2258 C HIS U 233 12.081 39.479 -18.790 1.00 55.72 C ATOM 2259 O HIS U 233 13.242 39.129 -18.616 1.00 60.72 O ATOM 2260 CB HIS U 233 11.862 41.137 -16.886 1.00 54.72 C ATOM 2261 CG HIS U 233 12.091 42.566 -16.508 1.00 56.96 C ATOM 2262 ND1 HIS U 233 11.326 43.602 -17.000 1.00 60.31 N ATOM 2263 CD2 HIS U 233 13.005 43.133 -15.685 1.00 57.40 C ATOM 2264 CE1 HIS U 233 11.761 44.746 -16.500 1.00 59.66 C ATOM 2265 NE2 HIS U 233 12.770 44.486 -15.688 1.00 58.91 N ATOM 2266 H HIS U 233 9.568 41.353 -18.083 1.00 0.00 H ATOM 2267 N PHE U 234 11.184 38.652 -19.310 1.00 50.87 N ATOM 2268 CA PHE U 234 11.521 37.244 -19.568 1.00 52.99 C ATOM 2269 C PHE U 234 11.313 36.869 -21.028 1.00 54.93 C ATOM 2270 O PHE U 234 11.249 35.677 -21.352 1.00 53.19 O ATOM 2271 CB PHE U 234 10.675 36.309 -18.678 1.00 52.90 C ATOM 2272 CG PHE U 234 11.079 36.299 -17.223 1.00 52.41 C ATOM 2273 CD1 PHE U 234 10.682 37.321 -16.374 1.00 52.13 C ATOM 2274 CD2 PHE U 234 11.831 35.244 -16.689 1.00 52.92 C ATOM 2275 CE1 PHE U 234 11.042 37.320 -15.028 1.00 52.27 C ATOM 2276 CE2 PHE U 234 12.194 35.232 -15.344 1.00 52.19 C ATOM 2277 CZ PHE U 234 11.802 36.277 -14.512 1.00 52.31 C ATOM 2278 H PHE U 234 10.232 39.003 -19.538 1.00 0.00 H ATOM 2279 N LEU U 235 11.227 37.869 -21.909 1.00 56.69 N ATOM 2280 CA LEU U 235 10.838 37.631 -23.310 1.00 58.08 C ATOM 2281 C LEU U 235 11.817 36.759 -24.099 1.00 59.67 C ATOM 2282 O LEU U 235 11.390 35.900 -24.885 1.00 59.59 O ATOM 2283 CB LEU U 235 10.663 38.946 -24.062 1.00 58.67 C ATOM 2284 CG LEU U 235 9.577 39.898 -23.602 1.00 59.04 C ATOM 2285 CD1 LEU U 235 9.588 41.087 -24.534 1.00 59.93 C ATOM 2286 CD2 LEU U 235 8.215 39.231 -23.613 1.00 61.25 C ATOM 2287 H LEU U 235 11.440 38.839 -21.599 1.00 0.00 H ATOM 2288 N PRO U 236 13.128 36.976 -23.905 1.00 58.87 N ATOM 2289 CA PRO U 236 14.052 36.114 -24.628 1.00 60.70 C ATOM 2290 C PRO U 236 13.929 34.648 -24.174 1.00 61.71 C ATOM 2291 O PRO U 236 13.816 33.760 -25.022 1.00 65.80 O ATOM 2292 CB PRO U 236 15.431 36.711 -24.302 1.00 60.63 C ATOM 2293 CG PRO U 236 15.162 38.049 -23.700 1.00 61.43 C ATOM 2294 CD PRO U 236 13.841 37.913 -23.023 1.00 59.58 C ATOM 2295 N TRP U 237 13.918 34.413 -22.858 1.00 60.27 N ATOM 2296 CA TRP U 237 13.657 33.077 -22.287 1.00 58.47 C ATOM 2297 C TRP U 237 12.398 32.456 -22.866 1.00 57.90 C ATOM 2298 O TRP U 237 12.372 31.263 -23.172 1.00 56.96 O ATOM 2299 CB TRP U 237 13.495 33.153 -20.764 1.00 59.04 C ATOM 2300 CG TRP U 237 13.323 31.827 -20.135 1.00 55.14 C ATOM 2301 CD1 TRP U 237 14.304 31.023 -19.674 1.00 56.73 C ATOM 2302 CD2 TRP U 237 12.094 31.142 -19.902 1.00 55.22 C ATOM 2303 NE1 TRP U 237 13.773 29.867 -19.158 1.00 57.36 N ATOM 2304 CE2 TRP U 237 12.414 29.907 -19.298 1.00 55.55 C ATOM 2305 CE3 TRP U 237 10.750 31.449 -20.145 1.00 55.82 C ATOM 2306 CZ2 TRP U 237 11.436 28.973 -18.920 1.00 56.04 C ATOM 2307 CZ3 TRP U 237 9.771 30.517 -19.776 1.00 55.45 C ATOM 2308 CH2 TRP U 237 10.123 29.292 -19.169 1.00 55.26 C ATOM 2309 HE1 TRP U 237 14.315 29.089 -18.731 1.00 0.00 H ATOM 2310 H TRP U 237 14.101 35.205 -22.209 1.00 0.00 H ATOM 2311 N ILE U 238 11.347 33.234 -22.936 1.00 55.34 N ATOM 2312 CA ILE U 238 10.132 32.729 -23.493 1.00 60.35 C ATOM 2313 C ILE U 238 10.325 32.417 -24.927 1.00 62.39 C ATOM 2314 O ILE U 238 9.900 31.406 -25.415 1.00 63.50 O ATOM 2315 CB ILE U 238 9.060 33.800 -23.451 1.00 62.24 C ATOM 2316 CG1 ILE U 238 8.918 34.313 -22.027 1.00 66.30 C ATOM 2317 CG2 ILE U 238 7.763 33.268 -24.016 1.00 59.47 C ATOM 2318 CD1 ILE U 238 7.596 34.962 -21.728 1.00 65.63 C ATOM 2319 H ILE U 238 11.396 34.213 -22.588 1.00 0.00 H ATOM 2320 N ARG U 239 10.959 33.336 -25.608 1.00 66.94 N ATOM 2321 CA ARG U 239 11.041 33.243 -27.030 1.00 74.13 C ATOM 2322 C ARG U 239 11.810 32.017 -27.365 1.00 71.21 C ATOM 2323 O ARG U 239 11.440 31.261 -28.240 1.00 68.54 O ATOM 2324 CB ARG U 239 11.798 34.438 -27.548 1.00 82.95 C ATOM 2325 CG ARG U 239 11.012 35.343 -28.456 1.00 91.00 C ATOM 2326 CD ARG U 239 11.968 36.214 -29.235 1.00 97.48 C ATOM 2327 NE ARG U 239 12.687 37.123 -28.362 1.00101.58 N ATOM 2328 CZ ARG U 239 12.175 38.255 -27.918 1.00106.77 C ATOM 2329 NH1 ARG U 239 10.953 38.597 -28.267 1.00104.04 N ATOM 2330 NH2 ARG U 239 12.874 39.042 -27.128 1.00113.76 N ATOM 2331 HE ARG U 239 13.653 36.870 -28.072 1.00 0.00 H ATOM 2332 HH12 ARG U 239 10.543 39.488 -27.921 1.00 0.00 H ATOM 2333 HH11 ARG U 239 10.397 37.976 -28.889 1.00 0.00 H ATOM 2334 HH22 ARG U 239 12.461 39.932 -26.783 1.00 0.00 H ATOM 2335 HH21 ARG U 239 13.839 38.774 -26.848 1.00 0.00 H ATOM 2336 H ARG U 239 11.404 34.135 -25.113 1.00 0.00 H ATOM 2337 N SER U 240 12.911 31.831 -26.666 1.00 71.05 N ATOM 2338 CA SER U 240 13.799 30.764 -27.015 1.00 73.49 C ATOM 2339 C SER U 240 13.171 29.448 -26.769 1.00 70.91 C ATOM 2340 O SER U 240 13.163 28.585 -27.604 1.00 73.76 O ATOM 2341 CB SER U 240 15.039 30.846 -26.164 1.00 73.96 C ATOM 2342 OG SER U 240 14.709 30.556 -24.841 1.00 79.41 O ATOM 2343 HG SER U 240 14.330 29.643 -24.789 1.00 0.00 H ATOM 2344 H SER U 240 13.134 32.456 -25.865 1.00 0.00 H ATOM 2345 N HIS U 241 12.590 29.315 -25.609 1.00 67.66 N ATOM 2346 CA HIS U 241 12.072 28.025 -25.201 1.00 66.56 C ATOM 2347 C HIS U 241 10.838 27.567 -25.981 1.00 67.23 C ATOM 2348 O HIS U 241 10.311 26.504 -25.690 1.00 77.11 O ATOM 2349 CB HIS U 241 11.857 28.010 -23.687 1.00 64.94 C ATOM 2350 CG HIS U 241 13.141 28.042 -22.920 1.00 67.10 C ATOM 2351 ND1 HIS U 241 13.883 29.190 -22.752 1.00 72.02 N ATOM 2352 CD2 HIS U 241 13.843 27.055 -22.318 1.00 68.32 C ATOM 2353 CE1 HIS U 241 14.981 28.913 -22.071 1.00 71.58 C ATOM 2354 NE2 HIS U 241 14.977 27.624 -21.789 1.00 70.44 N ATOM 2355 H HIS U 241 12.498 30.135 -24.976 1.00 0.00 H ATOM 2356 N THR U 242 10.411 28.327 -26.991 1.00 65.66 N ATOM 2357 CA THR U 242 9.272 27.957 -27.833 1.00 67.43 C ATOM 2358 C THR U 242 9.711 27.399 -29.193 1.00 72.33 C ATOM 2359 O THR U 242 9.831 28.128 -30.183 1.00 76.75 O ATOM 2360 CB THR U 242 8.380 29.179 -28.036 1.00 65.50 C ATOM 2361 OG1 THR U 242 9.206 30.297 -28.382 1.00 64.91 O ATOM 2362 CG2 THR U 242 7.621 29.494 -26.755 1.00 62.16 C ATOM 2363 HG1 THR U 242 9.851 30.468 -27.651 1.00 0.00 H ATOM 2364 H THR U 242 10.908 29.219 -27.188 1.00 0.00 H TER 2365 THR U 242 HETATM 2366 O HOH 1 -14.088 37.054 -1.933 1.00 43.89 O HETATM 2367 O HOH 2 -0.597 28.673 -5.467 1.00 31.78 O HETATM 2368 O HOH 3 -3.456 14.981 -38.634 1.00 55.18 O HETATM 2369 C10 UNN A 4 0.315 27.673 -0.979 1.00 -0.03 C HETATM 2370 C11 UNN A 4 0.140 28.912 -1.875 1.00 0.03 C HETATM 2371 N6 UNN A 4 0.293 30.163 -1.122 1.00 -0.29 N HETATM 2372 C5 UNN A 4 -0.138 31.364 -1.690 1.00 0.14 C HETATM 2373 C12 UNN A 4 -0.742 32.416 -0.997 1.00 0.10 C HETATM 2374 N7 UNN A 4 -1.033 33.542 -1.688 1.00 -0.27 N HETATM 2375 C3 UNN A 4 -0.737 33.699 -2.998 1.00 0.15 C HETATM 2376 C2 UNN A 4 -1.070 35.004 -3.660 1.00 0.22 C HETATM 2377 O1 UNN A 4 -1.121 35.065 -4.881 1.00 -0.39 O HETATM 2378 N3 UNN A 4 -1.222 36.046 -2.825 1.00 -0.22 N HETATM 2379 C1 UNN A 4 -1.459 37.334 -3.112 1.00 0.33 C HETATM 2380 N2 UNN A 4 -1.573 37.788 -4.358 1.00 -0.25 N HETATM 2381 H4 UNN A 4 -1.756 38.788 -4.527 1.00 0.32 H HETATM 2382 H5 UNN A 4 -1.479 37.140 -5.153 1.00 0.32 H HETATM 2383 N1 UNN A 4 -1.566 38.133 -2.145 1.00 -0.25 N HETATM 2384 H6 UNN A 4 -1.479 37.787 -1.179 1.00 0.32 H HETATM 2385 H7 UNN A 4 -1.741 39.133 -2.320 1.00 0.32 H HETATM 2386 H3 UNN A 4 -1.148 35.830 -1.851 1.00 0.18 H HETATM 2387 C4 UNN A 4 -0.112 32.656 -3.664 1.00 0.14 C HETATM 2388 N5 UNN A 4 0.171 31.522 -2.990 1.00 -0.24 N HETATM 2389 N4 UNN A 4 0.230 32.730 -4.975 1.00 -0.31 N HETATM 2390 H13 UNN A 4 0.693 31.932 -5.432 1.00 0.18 H HETATM 2391 H14 UNN A 4 0.026 33.584 -5.513 1.00 0.18 H HETATM 2392 C13 UNN A 4 -1.207 32.419 0.430 1.00 0.04 C HETATM 2393 C14 UNN A 4 -0.683 33.265 1.392 1.00 0.03 C HETATM 2394 N8 UNN A 4 -1.188 33.247 2.648 1.00 -0.24 N HETATM 2395 C15 UNN A 4 -2.215 32.429 3.004 1.00 0.25 C HETATM 2396 O2 UNN A 4 -2.708 32.429 4.290 1.00 -0.28 O HETATM 2397 C17 UNN A 4 -1.909 32.074 5.424 1.00 0.07 C HETATM 2398 H10 UNN A 4 -2.516 32.148 6.338 1.00 0.06 H HETATM 2399 H11 UNN A 4 -1.051 32.759 5.497 1.00 0.06 H HETATM 2400 H12 UNN A 4 -1.545 31.042 5.308 1.00 0.06 H HETATM 2401 N9 UNN A 4 -2.756 31.607 2.077 1.00 -0.24 N HETATM 2402 C16 UNN A 4 -2.282 31.602 0.821 1.00 0.03 C HETATM 2403 H9 UNN A 4 -2.741 30.949 0.087 1.00 0.09 H HETATM 2404 H8 UNN A 4 0.128 33.939 1.141 1.00 0.09 H HETATM 2405 C6 UNN A 4 1.044 30.251 0.154 1.00 0.03 C HETATM 2406 C7 UNN A 4 2.423 29.605 -0.007 1.00 -0.03 C HETATM 2407 C8 UNN A 4 2.408 28.130 0.378 1.00 -0.05 C HETATM 2408 C9 UNN A 4 1.778 27.298 -0.734 1.00 -0.05 C HETATM 2409 H17 UNN A 4 2.345 27.460 -1.662 1.00 0.03 H HETATM 2410 H18 UNN A 4 1.829 26.236 -0.454 1.00 0.03 H HETATM 2411 H19 UNN A 4 3.440 27.789 0.546 1.00 0.03 H HETATM 2412 H20 UNN A 4 1.824 28.002 1.302 1.00 0.03 H HETATM 2413 H21 UNN A 4 2.738 29.695 -1.057 1.00 0.03 H HETATM 2414 H22 UNN A 4 3.141 30.134 0.638 1.00 0.03 H HETATM 2415 H23 UNN A 4 0.485 29.726 0.943 1.00 0.05 H HETATM 2416 H24 UNN A 4 1.167 31.308 0.433 1.00 0.05 H HETATM 2417 H15 UNN A 4 -0.865 28.888 -2.322 1.00 0.05 H HETATM 2418 H16 UNN A 4 0.897 28.883 -2.672 1.00 0.05 H HETATM 2419 H1 UNN A 4 -0.187 26.821 -1.461 1.00 0.03 H HETATM 2420 H2 UNN A 4 -0.160 27.876 -0.008 1.00 0.03 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 307 306 439 CONECT 365 364 1079 CONECT 439 307 438 CONECT 1079 365 1078 CONECT 1310 1309 1961 CONECT 1627 1626 1784 CONECT 1784 1627 1783 CONECT 1886 1885 2128 CONECT 1961 1310 1960 CONECT 2128 1886 2127 CONECT 2369 2370 2408 2419 2420 CONECT 2370 2369 2371 2417 2418 CONECT 2371 2370 2372 2405 CONECT 2372 2371 2373 2388 CONECT 2373 2372 2374 2392 CONECT 2374 2373 2375 CONECT 2375 2374 2376 2387 CONECT 2376 2375 2377 2378 CONECT 2377 2376 CONECT 2378 2376 2379 2386 CONECT 2379 2378 2380 2383 CONECT 2380 2379 2381 2382 CONECT 2381 2380 CONECT 2382 2380 CONECT 2383 2379 2384 2385 CONECT 2384 2383 CONECT 2385 2383 CONECT 2386 2378 CONECT 2387 2375 2388 2389 CONECT 2388 2372 2387 CONECT 2389 2387 2390 2391 CONECT 2390 2389 CONECT 2391 2389 CONECT 2392 2373 2393 2402 CONECT 2393 2392 2394 2404 CONECT 2394 2393 2395 CONECT 2395 2394 2396 2401 CONECT 2396 2395 2397 CONECT 2397 2396 2398 2399 2400 CONECT 2398 2397 CONECT 2399 2397 CONECT 2400 2397 CONECT 2401 2395 2402 CONECT 2402 2392 2401 2403 CONECT 2403 2402 CONECT 2404 2393 CONECT 2405 2371 2406 2415 2416 CONECT 2406 2405 2407 2413 2414 CONECT 2407 2406 2408 2411 2412 CONECT 2408 2369 2407 2409 2410 CONECT 2409 2408 CONECT 2410 2408 CONECT 2411 2407 CONECT 2412 2407 CONECT 2413 2406 CONECT 2414 2406 CONECT 2415 2405 CONECT 2416 2405 CONECT 2417 2370 CONECT 2418 2370 CONECT 2419 2369 CONECT 2420 2369 MASTER 0 0 0 0 0 0 0 0 2419 1 66 19 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5zah
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
urokinase plasminogen activator
Ligand Name
30I
EC.Number
E.C.-.-.-.-
Resolution
2.98(Å)
Affinity (Kd/Ki/IC50)
Ki=53nM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) J. Med. Chem. Vol. 61: pp. 8299-8320
Ligand Properties
Formula
C
1
7
H
2
4
N
9
O
2
Molecular Weight
386.432
Exact Mass
386.205
No. of atoms
52
No. of bonds
54
Polar Surface Area
173.13
LOGP Value
2.69 (
Computed with XLOGP3
)
0.45 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 3
Canonical SMILES
COc1ncc(cn1)c1nc(C(=O)[NH+]=C(N)N)c(nc1N1CCCCCC1)N
InChI String
InChI=1S/C17H23N9O2/c1-28-17-21-8-10(9-22-17)11-14(26-6-4-2-3-5-7-26)24-13(18)12(23-11)15(27)25-16(19)20/h8-9H,2-7H2,1H3,(H2,18,24)(H4,19,20,25,27)/p+1
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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