Browse entries in the PDBbind-CN Database
HEADER 6D2O_COMPLEX COMPND 6D2O_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 209 ALA LEU GLN GLN LEU PHE GLU ASN ASN VAL ARG TRP ALA SEQRES 2 A 209 GLU ALA ILE LYS GLN GLU ASP PRO ASP PHE PHE ALA LYS SEQRES 3 A 209 LEU ALA ARG GLN GLN THR PRO GLU TYR LEU TRP ILE GLY SEQRES 4 A 209 CYS SER ASP ALA ARG VAL PRO ALA ASN GLU ILE VAL GLY SEQRES 5 A 209 MET LEU PRO GLY ASP LEU PHE VAL HIS ARG ASN VAL ALA SEQRES 6 A 209 ASN VAL VAL LEU HIS THR ASP LEU ASN CYS LEU SER VAL SEQRES 7 A 209 ILE GLN PHE ALA VAL ASP VAL LEU LYS VAL LYS HIS ILE SEQRES 8 A 209 LEU VAL THR GLY HIS TYR GLY CYS GLY GLY VAL ARG ALA SEQRES 9 A 209 SER LEU HIS ASN ASP GLN LEU GLY LEU ILE ASP GLY TRP SEQRES 10 A 209 LEU ARG SER ILE ARG ASP LEU ALA TYR GLU TYR ARG GLU SEQRES 11 A 209 HIS LEU GLU GLN LEU PRO THR GLU GLU GLU ARG VAL ASP SEQRES 12 A 209 ARG LEU CYS GLU LEU ASN VAL ILE GLN GLN VAL ALA ASN SEQRES 13 A 209 VAL SER HIS THR SER ILE VAL GLN ASN ALA TRP HIS ARG SEQRES 14 A 209 GLY GLN SER LEU SER VAL HIS GLY CYS ILE TYR GLY ILE SEQRES 15 A 209 LYS ASP GLY LEU TRP LYS ASN LEU ASN VAL THR VAL SER SEQRES 16 A 209 GLY LEU ASP GLN LEU PRO PRO GLN TYR ARG LEU SER PRO SEQRES 17 A 209 LEU HET ZN A 1 1 HET UNN A 255 12 ATOM 1 N ALA A 3 -48.296 17.106 -27.025 1.00125.21 N ATOM 2 CA ALA A 3 -49.297 16.071 -27.268 1.00118.50 C ATOM 3 C ALA A 3 -48.672 14.680 -27.362 1.00106.59 C ATOM 4 O ALA A 3 -47.495 14.527 -27.689 1.00109.45 O ATOM 5 CB ALA A 3 -50.087 16.379 -28.540 1.00118.25 C ATOM 6 HN3 ALA A 3 -47.608 17.111 -27.805 1.00 0.00 H ATOM 7 HN2 ALA A 3 -47.806 16.909 -26.129 1.00 0.00 H ATOM 8 HN1 ALA A 3 -48.764 18.033 -26.968 1.00 0.00 H ATOM 9 N LEU A 4 -49.477 13.668 -27.072 1.00 93.93 N ATOM 10 CA LEU A 4 -49.046 12.286 -27.190 1.00 84.99 C ATOM 11 C LEU A 4 -49.480 11.708 -28.530 1.00 89.09 C ATOM 12 O LEU A 4 -49.366 10.502 -28.757 1.00 84.43 O ATOM 13 CB LEU A 4 -49.618 11.446 -26.047 1.00 82.40 C ATOM 14 H LEU A 4 -50.445 13.869 -26.751 1.00 0.00 H ATOM 15 N GLN A 5 -49.986 12.571 -29.412 1.00 90.17 N ATOM 16 CA GLN A 5 -50.545 12.122 -30.684 1.00 86.03 C ATOM 17 C GLN A 5 -49.520 11.361 -31.508 1.00 86.41 C ATOM 18 O GLN A 5 -49.809 10.278 -32.014 1.00 91.99 O ATOM 19 CB GLN A 5 -51.081 13.309 -31.500 1.00 84.84 C ATOM 20 H GLN A 5 -49.982 13.587 -29.189 1.00 0.00 H ATOM 21 N GLN A 6 -48.324 11.928 -31.646 1.00 88.68 N ATOM 22 CA GLN A 6 -47.311 11.335 -32.518 1.00 87.39 C ATOM 23 C GLN A 6 -46.919 9.947 -32.016 1.00 80.05 C ATOM 24 O GLN A 6 -46.658 9.043 -32.812 1.00 82.08 O ATOM 25 CB GLN A 6 -46.077 12.241 -32.624 1.00 80.90 C ATOM 26 H GLN A 6 -48.107 12.803 -31.128 1.00 0.00 H ATOM 27 N LEU A 7 -46.912 9.768 -30.697 1.00 76.84 N ATOM 28 CA LEU A 7 -46.522 8.481 -30.124 1.00 73.53 C ATOM 29 C LEU A 7 -47.568 7.420 -30.416 1.00 71.78 C ATOM 30 O LEU A 7 -47.236 6.296 -30.800 1.00 77.18 O ATOM 31 CB LEU A 7 -46.302 8.600 -28.617 1.00 68.14 C ATOM 32 CG LEU A 7 -45.003 9.278 -28.165 1.00 72.15 C ATOM 33 CD1 LEU A 7 -45.004 10.764 -28.451 1.00 77.62 C ATOM 34 CD2 LEU A 7 -44.801 9.031 -26.667 1.00 62.43 C ATOM 35 H LEU A 7 -47.186 10.550 -30.069 1.00 0.00 H ATOM 36 N PHE A 8 -48.837 7.777 -30.229 1.00 76.96 N ATOM 37 CA PHE A 8 -49.917 6.870 -30.572 1.00 80.15 C ATOM 38 C PHE A 8 -49.872 6.559 -32.073 1.00 83.80 C ATOM 39 O PHE A 8 -50.025 5.405 -32.487 1.00 83.77 O ATOM 40 CB PHE A 8 -51.273 7.458 -30.163 1.00 79.94 C ATOM 41 CG PHE A 8 -51.546 7.361 -28.692 1.00 86.39 C ATOM 42 CD1 PHE A 8 -51.896 6.149 -28.117 1.00 88.54 C ATOM 43 CD2 PHE A 8 -51.439 8.474 -27.877 1.00 89.97 C ATOM 44 CE1 PHE A 8 -52.136 6.049 -26.748 1.00 83.78 C ATOM 45 CE2 PHE A 8 -51.679 8.384 -26.505 1.00 87.36 C ATOM 46 CZ PHE A 8 -52.025 7.166 -25.945 1.00 86.72 C ATOM 47 H PHE A 8 -49.056 8.714 -29.834 1.00 0.00 H ATOM 48 N GLU A 9 -49.626 7.577 -32.887 1.00 84.25 N ATOM 49 CA GLU A 9 -49.570 7.353 -34.321 1.00 94.89 C ATOM 50 C GLU A 9 -48.358 6.508 -34.699 1.00 88.83 C ATOM 51 O GLU A 9 -48.469 5.624 -35.546 1.00 84.33 O ATOM 52 CB GLU A 9 -49.572 8.683 -35.074 1.00108.73 C ATOM 53 CG GLU A 9 -50.924 9.372 -35.006 1.00124.96 C ATOM 54 CD GLU A 9 -50.962 10.704 -35.733 1.00140.07 C ATOM 55 OE1 GLU A 9 -50.119 10.926 -36.629 1.00146.89 O ATOM 56 OE2 GLU A 9 -51.841 11.531 -35.405 1.00143.94 O ATOM 57 H GLU A 9 -49.474 8.530 -32.501 1.00 0.00 H ATOM 58 N ASN A 10 -47.211 6.762 -34.070 1.00 87.53 N ATOM 59 CA ASN A 10 -46.025 5.950 -34.344 1.00 84.04 C ATOM 60 C ASN A 10 -46.323 4.490 -34.029 1.00 79.69 C ATOM 61 O ASN A 10 -45.980 3.595 -34.805 1.00 85.04 O ATOM 62 CB ASN A 10 -44.801 6.406 -33.535 1.00 78.27 C ATOM 63 CG ASN A 10 -44.272 7.771 -33.955 1.00 82.71 C ATOM 64 OD1 ASN A 10 -44.373 8.163 -35.110 1.00 82.30 O ATOM 65 ND2 ASN A 10 -43.642 8.472 -33.016 1.00 80.82 N ATOM 66 HD22 ASN A 10 -43.579 8.103 -32.046 1.00 0.00 H ATOM 67 HD21 ASN A 10 -43.213 9.389 -33.252 1.00 0.00 H ATOM 68 H ASN A 10 -47.159 7.540 -33.382 1.00 0.00 H ATOM 69 N ASN A 11 -46.991 4.265 -32.896 1.00 78.54 N ATOM 70 CA ASN A 11 -47.355 2.917 -32.458 1.00 67.82 C ATOM 71 C ASN A 11 -48.247 2.177 -33.453 1.00 72.61 C ATOM 72 O ASN A 11 -48.000 1.013 -33.769 1.00 75.96 O ATOM 73 CB ASN A 11 -48.054 2.964 -31.091 1.00 69.30 C ATOM 74 CG ASN A 11 -48.605 1.613 -30.678 1.00 72.36 C ATOM 75 OD1 ASN A 11 -47.848 0.676 -30.426 1.00 79.17 O ATOM 76 ND2 ASN A 11 -49.925 1.501 -30.621 1.00 72.88 N ATOM 77 HD22 ASN A 11 -50.526 2.320 -30.842 1.00 0.00 H ATOM 78 HD21 ASN A 11 -50.359 0.594 -30.355 1.00 0.00 H ATOM 79 H ASN A 11 -47.262 5.076 -32.304 1.00 0.00 H ATOM 80 N VAL A 12 -49.292 2.837 -33.934 1.00 78.57 N ATOM 81 CA VAL A 12 -50.204 2.170 -34.854 1.00 78.05 C ATOM 82 C VAL A 12 -49.475 1.832 -36.161 1.00 83.06 C ATOM 83 O VAL A 12 -49.724 0.783 -36.751 1.00 89.81 O ATOM 84 CB VAL A 12 -51.470 3.021 -35.150 1.00 91.14 C ATOM 85 CG1 VAL A 12 -52.224 3.331 -33.860 1.00 89.24 C ATOM 86 CG2 VAL A 12 -51.152 4.312 -35.900 1.00 97.90 C ATOM 87 H VAL A 12 -49.460 3.825 -33.656 1.00 0.00 H ATOM 88 N ARG A 13 -48.540 2.681 -36.586 1.00 82.06 N ATOM 89 CA ARG A 13 -47.784 2.431 -37.818 1.00 88.70 C ATOM 90 C ARG A 13 -46.774 1.293 -37.646 1.00 88.60 C ATOM 91 O ARG A 13 -46.585 0.456 -38.542 1.00 82.33 O ATOM 92 CB ARG A 13 -47.063 3.708 -38.282 1.00 90.80 C ATOM 93 H ARG A 13 -48.342 3.539 -36.033 1.00 0.00 H ATOM 94 N TRP A 14 -46.122 1.279 -36.489 1.00 80.79 N ATOM 95 CA TRP A 14 -45.131 0.265 -36.154 1.00 78.17 C ATOM 96 C TRP A 14 -45.777 -1.122 -36.049 1.00 82.47 C ATOM 97 O TRP A 14 -45.285 -2.092 -36.634 1.00 78.40 O ATOM 98 CB TRP A 14 -44.443 0.661 -34.842 1.00 76.96 C ATOM 99 CG TRP A 14 -43.562 -0.354 -34.203 1.00 73.69 C ATOM 100 CD1 TRP A 14 -42.264 -0.624 -34.513 1.00 75.04 C ATOM 101 CD2 TRP A 14 -43.897 -1.201 -33.094 1.00 75.15 C ATOM 102 NE1 TRP A 14 -41.772 -1.603 -33.676 1.00 70.33 N ATOM 103 CE2 TRP A 14 -42.752 -1.968 -32.793 1.00 73.12 C ATOM 104 CE3 TRP A 14 -45.058 -1.387 -32.327 1.00 74.17 C ATOM 105 CZ2 TRP A 14 -42.733 -2.923 -31.758 1.00 71.67 C ATOM 106 CZ3 TRP A 14 -45.037 -2.334 -31.290 1.00 67.74 C ATOM 107 CH2 TRP A 14 -43.883 -3.089 -31.022 1.00 67.27 C ATOM 108 HE1 TRP A 14 -40.811 -2.000 -33.710 1.00 0.00 H ATOM 109 H TRP A 14 -46.328 2.024 -35.793 1.00 0.00 H ATOM 110 N ALA A 15 -46.876 -1.203 -35.300 1.00 80.97 N ATOM 111 CA ALA A 15 -47.609 -2.456 -35.133 1.00 82.40 C ATOM 112 C ALA A 15 -48.064 -3.012 -36.486 1.00 86.49 C ATOM 113 O ALA A 15 -47.936 -4.211 -36.750 1.00 81.14 O ATOM 114 CB ALA A 15 -48.808 -2.254 -34.212 1.00 85.88 C ATOM 115 H ALA A 15 -47.223 -0.348 -34.820 1.00 0.00 H ATOM 116 N GLU A 16 -48.583 -2.131 -37.338 1.00 90.15 N ATOM 117 CA GLU A 16 -49.066 -2.538 -38.658 1.00 94.63 C ATOM 118 C GLU A 16 -47.943 -2.987 -39.575 1.00 84.35 C ATOM 119 O GLU A 16 -48.102 -3.961 -40.308 1.00 96.67 O ATOM 120 CB GLU A 16 -49.856 -1.408 -39.319 1.00101.34 C ATOM 121 CG GLU A 16 -51.229 -1.205 -38.705 1.00119.90 C ATOM 122 CD GLU A 16 -51.915 -2.522 -38.378 1.00135.46 C ATOM 123 OE1 GLU A 16 -52.391 -3.195 -39.322 1.00138.58 O ATOM 124 OE2 GLU A 16 -51.973 -2.884 -37.178 1.00139.06 O ATOM 125 H GLU A 16 -48.647 -1.131 -37.059 1.00 0.00 H ATOM 126 N ALA A 17 -46.813 -2.291 -39.531 1.00 90.59 N ATOM 127 CA ALA A 17 -45.670 -2.636 -40.375 1.00 92.22 C ATOM 128 C ALA A 17 -45.183 -4.051 -40.067 1.00 91.54 C ATOM 129 O ALA A 17 -44.983 -4.867 -40.972 1.00 88.22 O ATOM 130 CB ALA A 17 -44.536 -1.626 -40.190 1.00 84.88 C ATOM 131 H ALA A 17 -46.739 -1.482 -38.881 1.00 0.00 H ATOM 132 N ILE A 18 -45.020 -4.340 -38.779 1.00 83.53 N ATOM 133 CA ILE A 18 -44.615 -5.669 -38.327 1.00 84.53 C ATOM 134 C ILE A 18 -45.614 -6.763 -38.738 1.00 91.28 C ATOM 135 O ILE A 18 -45.213 -7.841 -39.180 1.00 95.17 O ATOM 136 CB ILE A 18 -44.425 -5.676 -36.794 1.00 80.24 C ATOM 137 CG1 ILE A 18 -43.337 -4.668 -36.419 1.00 80.24 C ATOM 138 CG2 ILE A 18 -44.091 -7.071 -36.284 1.00 77.19 C ATOM 139 CD1 ILE A 18 -43.012 -4.603 -34.945 1.00 73.76 C ATOM 140 H ILE A 18 -45.186 -3.596 -38.071 1.00 0.00 H ATOM 141 N LYS A 19 -46.909 -6.485 -38.613 1.00 85.28 N ATOM 142 CA LYS A 19 -47.927 -7.474 -38.965 1.00 85.94 C ATOM 143 C LYS A 19 -47.933 -7.755 -40.479 1.00 90.05 C ATOM 144 O LYS A 19 -48.236 -8.864 -40.909 1.00 89.63 O ATOM 145 CB LYS A 19 -49.310 -7.008 -38.490 1.00 88.40 C ATOM 146 CG LYS A 19 -49.493 -7.061 -36.959 1.00 88.97 C ATOM 147 CD LYS A 19 -50.637 -6.163 -36.497 1.00 94.30 C ATOM 148 CE LYS A 19 -50.942 -6.380 -35.025 1.00 84.84 C ATOM 149 NZ LYS A 19 -51.996 -5.445 -34.552 1.00 80.35 N ATOM 150 HZ1 LYS A 19 -51.673 -4.465 -34.684 1.00 0.00 H ATOM 151 HZ2 LYS A 19 -52.867 -5.601 -35.099 1.00 0.00 H ATOM 152 HZ3 LYS A 19 -52.183 -5.617 -33.543 1.00 0.00 H ATOM 153 H LYS A 19 -47.201 -5.551 -38.260 1.00 0.00 H ATOM 154 N GLN A 20 -47.585 -6.748 -41.272 1.00 93.93 N ATOM 155 CA GLN A 20 -47.444 -6.919 -42.716 1.00 97.85 C ATOM 156 C GLN A 20 -46.312 -7.902 -43.042 1.00101.67 C ATOM 157 O GLN A 20 -46.497 -8.815 -43.843 1.00108.40 O ATOM 158 CB GLN A 20 -47.202 -5.571 -43.402 1.00 93.97 C ATOM 159 H GLN A 20 -47.408 -5.812 -40.854 1.00 0.00 H ATOM 160 N GLU A 21 -45.151 -7.735 -42.413 1.00 98.40 N ATOM 161 CA GLU A 21 -44.031 -8.648 -42.655 1.00100.89 C ATOM 162 C GLU A 21 -44.245 -10.033 -42.027 1.00101.95 C ATOM 163 O GLU A 21 -43.830 -11.042 -42.593 1.00 99.20 O ATOM 164 CB GLU A 21 -42.723 -8.042 -42.137 1.00 99.19 C ATOM 165 H GLU A 21 -45.038 -6.948 -41.743 1.00 0.00 H ATOM 166 N ASP A 22 -44.884 -10.077 -40.859 1.00 96.64 N ATOM 167 CA ASP A 22 -45.178 -11.340 -40.177 1.00 90.32 C ATOM 168 C ASP A 22 -46.409 -11.145 -39.308 1.00 91.00 C ATOM 169 O ASP A 22 -46.301 -10.648 -38.185 1.00 83.94 O ATOM 170 CB ASP A 22 -43.974 -11.802 -39.340 1.00 93.67 C ATOM 171 CG ASP A 22 -44.296 -12.966 -38.394 1.00 96.51 C ATOM 172 OD1 ASP A 22 -45.384 -13.580 -38.479 1.00 91.84 O ATOM 173 OD2 ASP A 22 -43.425 -13.283 -37.556 1.00102.43 O ATOM 174 H ASP A 22 -45.184 -9.185 -40.416 1.00 0.00 H ATOM 175 N PRO A 23 -47.585 -11.540 -39.822 1.00 91.25 N ATOM 176 CA PRO A 23 -48.849 -11.322 -39.105 1.00 94.03 C ATOM 177 C PRO A 23 -48.948 -12.074 -37.775 1.00 92.09 C ATOM 178 O PRO A 23 -49.809 -11.730 -36.971 1.00 92.73 O ATOM 179 CB PRO A 23 -49.912 -11.823 -40.101 1.00102.77 C ATOM 180 CG PRO A 23 -49.179 -12.689 -41.067 1.00101.28 C ATOM 181 CD PRO A 23 -47.799 -12.109 -41.164 1.00 98.69 C ATOM 182 N ASP A 24 -48.099 -13.068 -37.538 1.00 82.65 N ATOM 183 CA ASP A 24 -48.177 -13.811 -36.285 1.00 81.23 C ATOM 184 C ASP A 24 -47.167 -13.301 -35.267 1.00 75.62 C ATOM 185 O ASP A 24 -46.981 -13.923 -34.217 1.00 80.06 O ATOM 186 CB ASP A 24 -47.926 -15.295 -36.512 1.00 86.37 C ATOM 187 CG ASP A 24 -48.991 -15.948 -37.368 1.00 95.18 C ATOM 188 OD1 ASP A 24 -50.128 -15.426 -37.428 1.00 98.20 O ATOM 189 OD2 ASP A 24 -48.679 -16.995 -37.977 1.00 96.92 O ATOM 190 H ASP A 24 -47.379 -13.316 -38.246 1.00 0.00 H ATOM 191 N PHE A 25 -46.491 -12.199 -35.592 1.00 82.03 N ATOM 192 CA PHE A 25 -45.340 -11.777 -34.797 1.00 81.66 C ATOM 193 C PHE A 25 -45.711 -11.583 -33.341 1.00 74.18 C ATOM 194 O PHE A 25 -45.093 -12.173 -32.446 1.00 75.76 O ATOM 195 CB PHE A 25 -44.715 -10.484 -35.325 1.00 83.84 C ATOM 196 CG PHE A 25 -43.596 -9.974 -34.453 1.00 85.95 C ATOM 197 CD1 PHE A 25 -42.308 -10.459 -34.606 1.00 81.90 C ATOM 198 CD2 PHE A 25 -43.847 -9.061 -33.433 1.00 82.19 C ATOM 199 CE1 PHE A 25 -41.289 -10.011 -33.790 1.00 87.86 C ATOM 200 CE2 PHE A 25 -42.835 -8.617 -32.619 1.00 77.59 C ATOM 201 CZ PHE A 25 -41.556 -9.089 -32.795 1.00 80.98 C ATOM 202 H PHE A 25 -46.785 -11.636 -36.416 1.00 0.00 H ATOM 203 N PHE A 26 -46.706 -10.744 -33.088 1.00 72.63 N ATOM 204 CA PHE A 26 -47.061 -10.462 -31.705 1.00 69.75 C ATOM 205 C PHE A 26 -47.772 -11.654 -31.062 1.00 72.34 C ATOM 206 O PHE A 26 -47.532 -11.965 -29.896 1.00 70.01 O ATOM 207 CB PHE A 26 -47.930 -9.212 -31.604 1.00 72.30 C ATOM 208 CG PHE A 26 -47.244 -7.962 -32.057 1.00 74.05 C ATOM 209 CD1 PHE A 26 -46.393 -7.275 -31.204 1.00 75.06 C ATOM 210 CD2 PHE A 26 -47.470 -7.450 -33.320 1.00 74.74 C ATOM 211 CE1 PHE A 26 -45.766 -6.119 -31.606 1.00 76.47 C ATOM 212 CE2 PHE A 26 -46.843 -6.285 -33.734 1.00 71.02 C ATOM 213 CZ PHE A 26 -45.993 -5.620 -32.879 1.00 73.19 C ATOM 214 H PHE A 26 -47.226 -10.293 -33.868 1.00 0.00 H ATOM 215 N ALA A 27 -48.631 -12.327 -31.824 1.00 73.87 N ATOM 216 CA ALA A 27 -49.390 -13.458 -31.297 1.00 75.64 C ATOM 217 C ALA A 27 -48.466 -14.535 -30.744 1.00 75.46 C ATOM 218 O ALA A 27 -48.675 -15.035 -29.634 1.00 76.39 O ATOM 219 CB ALA A 27 -50.309 -14.048 -32.386 1.00 79.96 C ATOM 220 H ALA A 27 -48.764 -12.042 -32.815 1.00 0.00 H ATOM 221 N LYS A 28 -47.436 -14.874 -31.515 1.00 78.82 N ATOM 222 CA LYS A 28 -46.483 -15.897 -31.105 1.00 77.29 C ATOM 223 C LYS A 28 -45.749 -15.450 -29.840 1.00 80.74 C ATOM 224 O LYS A 28 -45.650 -16.207 -28.875 1.00 78.03 O ATOM 225 CB LYS A 28 -45.481 -16.197 -32.225 1.00 81.67 C ATOM 226 H LYS A 28 -47.308 -14.398 -32.431 1.00 0.00 H ATOM 227 N LEU A 29 -45.245 -14.220 -29.854 1.00 79.72 N ATOM 228 CA LEU A 29 -44.507 -13.668 -28.722 1.00 78.94 C ATOM 229 C LEU A 29 -45.308 -13.716 -27.431 1.00 76.44 C ATOM 230 O LEU A 29 -44.781 -14.036 -26.365 1.00 78.04 O ATOM 231 CB LEU A 29 -44.107 -12.221 -29.009 1.00 86.12 C ATOM 232 CG LEU A 29 -42.711 -11.938 -29.558 1.00 92.86 C ATOM 233 CD1 LEU A 29 -42.462 -10.430 -29.561 1.00 86.46 C ATOM 234 CD2 LEU A 29 -41.654 -12.661 -28.738 1.00 95.03 C ATOM 235 H LEU A 29 -45.381 -13.631 -30.700 1.00 0.00 H ATOM 236 N ALA A 30 -46.590 -13.394 -27.540 1.00 73.65 N ATOM 237 CA ALA A 30 -47.441 -13.222 -26.377 1.00 71.96 C ATOM 238 C ALA A 30 -47.620 -14.526 -25.615 1.00 76.37 C ATOM 239 O ALA A 30 -47.987 -14.514 -24.434 1.00 75.59 O ATOM 240 CB ALA A 30 -48.798 -12.659 -26.803 1.00 73.77 C ATOM 241 H ALA A 30 -46.998 -13.261 -28.487 1.00 0.00 H ATOM 242 N ARG A 31 -47.344 -15.647 -26.283 1.00 75.15 N ATOM 243 CA ARG A 31 -47.510 -16.970 -25.670 1.00 83.73 C ATOM 244 C ARG A 31 -46.464 -17.301 -24.609 1.00 94.87 C ATOM 245 O ARG A 31 -46.803 -17.804 -23.542 1.00 96.32 O ATOM 246 CB ARG A 31 -47.488 -18.050 -26.741 1.00 85.36 C ATOM 247 CG ARG A 31 -48.582 -17.865 -27.764 1.00 87.68 C ATOM 248 CD ARG A 31 -48.738 -19.059 -28.678 1.00 89.32 C ATOM 249 NE ARG A 31 -49.874 -18.815 -29.551 1.00 83.86 N ATOM 250 CZ ARG A 31 -51.133 -18.999 -29.184 1.00 83.68 C ATOM 251 NH1 ARG A 31 -51.407 -19.456 -27.970 1.00 92.86 N ATOM 252 NH2 ARG A 31 -52.118 -18.738 -30.029 1.00 94.05 N ATOM 253 HE ARG A 31 -49.688 -18.477 -30.517 1.00 0.00 H ATOM 254 HH12 ARG A 31 -52.395 -19.601 -27.680 1.00 0.00 H ATOM 255 HH11 ARG A 31 -50.634 -19.669 -27.308 1.00 0.00 H ATOM 256 HH22 ARG A 31 -53.106 -18.884 -29.737 1.00 0.00 H ATOM 257 HH21 ARG A 31 -51.904 -18.387 -30.984 1.00 0.00 H ATOM 258 H ARG A 31 -47.002 -15.582 -27.263 1.00 0.00 H ATOM 259 N GLN A 32 -45.196 -17.034 -24.904 1.00100.36 N ATOM 260 CA GLN A 32 -44.121 -17.347 -23.965 1.00 98.94 C ATOM 261 C GLN A 32 -42.998 -16.310 -23.994 1.00 92.39 C ATOM 262 O GLN A 32 -42.491 -15.944 -25.052 1.00 86.49 O ATOM 263 CB GLN A 32 -43.552 -18.742 -24.252 1.00111.26 C ATOM 264 CG GLN A 32 -44.104 -19.839 -23.354 1.00118.80 C ATOM 265 CD GLN A 32 -43.517 -19.798 -21.959 1.00128.06 C ATOM 266 OE1 GLN A 32 -42.377 -19.374 -21.769 1.00126.39 O ATOM 267 NE2 GLN A 32 -44.299 -20.226 -20.970 1.00135.95 N ATOM 268 HE22 GLN A 32 -45.256 -20.576 -21.178 1.00 0.00 H ATOM 269 HE21 GLN A 32 -43.953 -20.210 -19.989 1.00 0.00 H ATOM 270 H GLN A 32 -44.965 -16.595 -25.818 1.00 0.00 H ATOM 271 N GLN A 33 -42.617 -15.845 -22.811 1.00 85.40 N ATOM 272 CA GLN A 33 -41.488 -14.939 -22.669 1.00 80.77 C ATOM 273 C GLN A 33 -40.184 -15.734 -22.525 1.00 70.08 C ATOM 274 O GLN A 33 -39.985 -16.440 -21.539 1.00 72.98 O ATOM 275 CB GLN A 33 -41.699 -14.009 -21.457 1.00 80.15 C ATOM 276 CG GLN A 33 -40.544 -13.080 -21.271 1.00 74.19 C ATOM 277 CD GLN A 33 -40.745 -11.991 -20.234 1.00 69.87 C ATOM 278 OE1 GLN A 33 -41.573 -12.082 -19.316 1.00 73.72 O ATOM 279 NE2 GLN A 33 -39.970 -10.937 -20.388 1.00 59.38 N ATOM 280 HE22 GLN A 33 -39.289 -10.903 -21.173 1.00 0.00 H ATOM 281 HE21 GLN A 33 -40.039 -10.139 -19.725 1.00 0.00 H ATOM 282 H GLN A 33 -43.141 -16.137 -21.961 1.00 0.00 H ATOM 283 N THR A 34 -39.291 -15.637 -23.501 1.00 74.63 N ATOM 284 CA THR A 34 -38.063 -16.436 -23.445 1.00 73.62 C ATOM 285 C THR A 34 -36.765 -15.698 -23.779 1.00 73.33 C ATOM 286 O THR A 34 -35.988 -16.172 -24.604 1.00 73.67 O ATOM 287 CB THR A 34 -38.164 -17.640 -24.400 1.00 76.55 C ATOM 288 OG1 THR A 34 -38.345 -17.169 -25.744 1.00 75.97 O ATOM 289 CG2 THR A 34 -39.327 -18.531 -24.012 1.00 76.71 C ATOM 290 HG1 THR A 34 -37.573 -16.606 -26.002 1.00 0.00 H ATOM 291 H THR A 34 -39.461 -14.997 -24.303 1.00 0.00 H ATOM 292 N PRO A 35 -36.511 -14.544 -23.137 1.00 63.58 N ATOM 293 CA PRO A 35 -35.263 -13.840 -23.446 1.00 69.83 C ATOM 294 C PRO A 35 -34.030 -14.587 -22.940 1.00 68.78 C ATOM 295 O PRO A 35 -34.069 -15.199 -21.881 1.00 70.65 O ATOM 296 CB PRO A 35 -35.422 -12.506 -22.700 1.00 66.70 C ATOM 297 CG PRO A 35 -36.260 -12.858 -21.524 1.00 67.83 C ATOM 298 CD PRO A 35 -37.233 -13.910 -22.020 1.00 70.00 C ATOM 299 N GLU A 36 -32.934 -14.516 -23.680 1.00 66.93 N ATOM 300 CA GLU A 36 -31.699 -15.132 -23.217 1.00 68.37 C ATOM 301 C GLU A 36 -30.888 -14.146 -22.389 1.00 65.40 C ATOM 302 O GLU A 36 -29.928 -14.528 -21.732 1.00 62.60 O ATOM 303 CB GLU A 36 -30.870 -15.638 -24.408 1.00 71.04 C ATOM 304 H GLU A 36 -32.956 -14.019 -24.593 1.00 0.00 H ATOM 305 N TYR A 37 -31.286 -12.878 -22.407 1.00 63.62 N ATOM 306 CA TYR A 37 -30.489 -11.821 -21.781 1.00 61.06 C ATOM 307 C TYR A 37 -31.289 -10.918 -20.857 1.00 66.53 C ATOM 308 O TYR A 37 -32.424 -10.542 -21.174 1.00 59.59 O ATOM 309 CB TYR A 37 -29.836 -10.923 -22.845 1.00 62.97 C ATOM 310 CG TYR A 37 -29.084 -11.650 -23.934 1.00 71.15 C ATOM 311 CD1 TYR A 37 -27.726 -11.896 -23.812 1.00 69.19 C ATOM 312 CD2 TYR A 37 -29.724 -12.066 -25.089 1.00 80.31 C ATOM 313 CE1 TYR A 37 -27.029 -12.561 -24.799 1.00 78.93 C ATOM 314 CE2 TYR A 37 -29.031 -12.727 -26.089 1.00 86.49 C ATOM 315 CZ TYR A 37 -27.680 -12.973 -25.933 1.00 88.45 C ATOM 316 OH TYR A 37 -26.966 -13.629 -26.915 1.00 99.08 O ATOM 317 HH TYR A 37 -26.021 -13.715 -26.632 1.00 0.00 H ATOM 318 H TYR A 37 -32.181 -12.632 -22.875 1.00 0.00 H ATOM 319 N LEU A 38 -30.681 -10.551 -19.729 1.00 60.66 N ATOM 320 CA LEU A 38 -31.151 -9.418 -18.945 1.00 51.95 C ATOM 321 C LEU A 38 -30.177 -8.247 -19.096 1.00 59.26 C ATOM 322 O LEU A 38 -28.968 -8.396 -18.885 1.00 59.96 O ATOM 323 CB LEU A 38 -31.296 -9.791 -17.470 1.00 53.84 C ATOM 324 CG LEU A 38 -31.294 -8.613 -16.495 1.00 56.95 C ATOM 325 CD1 LEU A 38 -32.485 -7.697 -16.744 1.00 54.91 C ATOM 326 CD2 LEU A 38 -31.316 -9.160 -15.063 1.00 53.55 C ATOM 327 H LEU A 38 -29.852 -11.086 -19.401 1.00 0.00 H ATOM 328 N TRP A 39 -30.718 -7.087 -19.461 1.00 57.01 N ATOM 329 CA TRP A 39 -29.964 -5.839 -19.542 1.00 53.79 C ATOM 330 C TRP A 39 -30.157 -4.993 -18.293 1.00 56.68 C ATOM 331 O TRP A 39 -31.289 -4.675 -17.918 1.00 53.55 O ATOM 332 CB TRP A 39 -30.425 -5.048 -20.760 1.00 55.78 C ATOM 333 CG TRP A 39 -29.800 -3.689 -21.006 1.00 56.70 C ATOM 334 CD1 TRP A 39 -30.097 -2.512 -20.379 1.00 57.36 C ATOM 335 CD2 TRP A 39 -28.853 -3.364 -22.036 1.00 59.09 C ATOM 336 NE1 TRP A 39 -29.373 -1.481 -20.935 1.00 59.65 N ATOM 337 CE2 TRP A 39 -28.602 -1.978 -21.954 1.00 59.73 C ATOM 338 CE3 TRP A 39 -28.180 -4.119 -23.009 1.00 64.86 C ATOM 339 CZ2 TRP A 39 -27.698 -1.330 -22.793 1.00 57.53 C ATOM 340 CZ3 TRP A 39 -27.293 -3.470 -23.857 1.00 66.32 C ATOM 341 CH2 TRP A 39 -27.058 -2.091 -23.741 1.00 63.58 C ATOM 342 HE1 TRP A 39 -29.406 -0.487 -20.631 1.00 0.00 H ATOM 343 H TRP A 39 -31.730 -7.068 -19.701 1.00 0.00 H ATOM 344 N ILE A 40 -29.054 -4.630 -17.651 1.00 53.14 N ATOM 345 CA ILE A 40 -29.113 -3.695 -16.544 1.00 53.42 C ATOM 346 C ILE A 40 -28.344 -2.455 -16.975 1.00 57.26 C ATOM 347 O ILE A 40 -27.119 -2.485 -17.132 1.00 58.43 O ATOM 348 CB ILE A 40 -28.533 -4.273 -15.234 1.00 49.57 C ATOM 349 CG1 ILE A 40 -29.282 -5.552 -14.826 1.00 50.96 C ATOM 350 CG2 ILE A 40 -28.568 -3.179 -14.112 1.00 49.36 C ATOM 351 CD1 ILE A 40 -28.767 -6.226 -13.499 1.00 52.14 C ATOM 352 H ILE A 40 -28.136 -5.021 -17.945 1.00 0.00 H ATOM 353 N GLY A 41 -29.072 -1.368 -17.188 1.00 50.68 N ATOM 354 CA GLY A 41 -28.454 -0.170 -17.716 1.00 53.18 C ATOM 355 C GLY A 41 -28.991 1.086 -17.089 1.00 55.92 C ATOM 356 O GLY A 41 -29.833 1.031 -16.188 1.00 51.35 O ATOM 357 H GLY A 41 -30.090 -1.376 -16.975 1.00 0.00 H ATOM 358 N CYS A 42 -28.481 2.218 -17.558 1.00 56.23 N ATOM 359 CA CYS A 42 -28.941 3.523 -17.108 1.00 55.25 C ATOM 360 C CYS A 42 -30.241 3.925 -17.820 1.00 56.80 C ATOM 361 O CYS A 42 -30.482 3.549 -18.969 1.00 55.43 O ATOM 362 CB CYS A 42 -27.859 4.587 -17.344 1.00 57.05 C ATOM 363 SG CYS A 42 -28.247 6.266 -16.660 1.00 56.55 S ATOM 364 H CYS A 42 -27.726 2.171 -18.272 1.00 0.00 H ATOM 365 N SER A 43 -31.059 4.695 -17.113 1.00 53.83 N ATOM 366 CA SER A 43 -32.295 5.277 -17.623 1.00 54.22 C ATOM 367 C SER A 43 -32.085 6.305 -18.756 1.00 54.94 C ATOM 368 O SER A 43 -33.024 6.628 -19.485 1.00 54.04 O ATOM 369 CB SER A 43 -33.047 5.942 -16.454 1.00 50.84 C ATOM 370 OG SER A 43 -33.495 4.950 -15.521 1.00 48.16 O ATOM 371 HG SER A 43 -32.714 4.457 -15.165 1.00 0.00 H ATOM 372 H SER A 43 -30.800 4.897 -16.126 1.00 0.00 H ATOM 373 N ASP A 44 -30.865 6.825 -18.843 1.00 56.33 N ATOM 374 CA ASP A 44 -30.458 7.838 -19.820 1.00 61.56 C ATOM 375 C ASP A 44 -31.084 7.564 -21.198 1.00 58.48 C ATOM 376 O ASP A 44 -30.971 6.450 -21.724 1.00 56.72 O ATOM 377 CB ASP A 44 -28.922 7.869 -19.907 1.00 58.43 C ATOM 378 CG ASP A 44 -28.394 8.999 -20.791 1.00 65.49 C ATOM 379 OD1 ASP A 44 -27.425 9.679 -20.380 1.00 67.99 O ATOM 380 OD2 ASP A 44 -28.924 9.199 -21.901 1.00 62.63 O ATOM 381 H ASP A 44 -30.148 6.489 -18.169 1.00 0.00 H ATOM 382 N ALA A 45 -31.747 8.572 -21.766 1.00 59.62 N ATOM 383 CA ALA A 45 -32.529 8.405 -23.003 1.00 61.36 C ATOM 384 C ALA A 45 -31.661 8.025 -24.193 1.00 62.46 C ATOM 385 O ALA A 45 -32.162 7.554 -25.218 1.00 67.56 O ATOM 386 CB ALA A 45 -33.300 9.681 -23.325 1.00 62.32 C ATOM 387 H ALA A 45 -31.711 9.510 -21.319 1.00 0.00 H ATOM 388 N ARG A 46 -30.360 8.253 -24.051 1.00 65.40 N ATOM 389 CA ARG A 46 -29.423 8.011 -25.129 1.00 66.68 C ATOM 390 C ARG A 46 -28.910 6.576 -25.148 1.00 66.33 C ATOM 391 O ARG A 46 -28.129 6.200 -26.032 1.00 66.62 O ATOM 392 CB ARG A 46 -28.262 8.997 -25.022 1.00 62.46 C ATOM 393 CG ARG A 46 -28.726 10.439 -25.214 1.00 69.58 C ATOM 394 CD ARG A 46 -27.681 11.450 -24.820 1.00 72.60 C ATOM 395 NE ARG A 46 -27.388 11.366 -23.398 1.00 69.39 N ATOM 396 CZ ARG A 46 -26.573 12.193 -22.754 1.00 69.27 C ATOM 397 NH1 ARG A 46 -25.979 13.193 -23.404 1.00 67.25 N ATOM 398 NH2 ARG A 46 -26.363 12.027 -21.452 1.00 67.95 N ATOM 399 HE ARG A 46 -27.846 10.610 -22.850 1.00 0.00 H ATOM 400 HH12 ARG A 46 -25.341 13.838 -22.895 1.00 0.00 H ATOM 401 HH11 ARG A 46 -26.153 13.329 -24.420 1.00 0.00 H ATOM 402 HH22 ARG A 46 -25.726 12.671 -20.942 1.00 0.00 H ATOM 403 HH21 ARG A 46 -26.836 11.253 -20.944 1.00 0.00 H ATOM 404 H ARG A 46 -30.005 8.614 -23.143 1.00 0.00 H ATOM 405 N VAL A 47 -29.366 5.766 -24.192 1.00 61.05 N ATOM 406 CA VAL A 47 -28.900 4.383 -24.105 1.00 61.49 C ATOM 407 C VAL A 47 -30.049 3.354 -24.157 1.00 60.51 C ATOM 408 O VAL A 47 -30.234 2.566 -23.230 1.00 57.29 O ATOM 409 CB VAL A 47 -28.051 4.174 -22.825 1.00 60.50 C ATOM 410 CG1 VAL A 47 -27.213 2.919 -22.933 1.00 61.87 C ATOM 411 CG2 VAL A 47 -27.129 5.369 -22.601 1.00 60.38 C ATOM 412 H VAL A 47 -30.059 6.121 -23.502 1.00 0.00 H ATOM 413 N PRO A 48 -30.794 3.318 -25.284 1.00 66.23 N ATOM 414 CA PRO A 48 -31.877 2.336 -25.399 1.00 63.26 C ATOM 415 C PRO A 48 -31.306 0.947 -25.679 1.00 64.70 C ATOM 416 O PRO A 48 -30.584 0.754 -26.665 1.00 65.96 O ATOM 417 CB PRO A 48 -32.704 2.858 -26.577 1.00 68.85 C ATOM 418 CG PRO A 48 -31.679 3.540 -27.471 1.00 63.95 C ATOM 419 CD PRO A 48 -30.604 4.085 -26.531 1.00 59.43 C ATOM 420 N ALA A 49 -31.643 -0.003 -24.815 1.00 62.81 N ATOM 421 CA ALA A 49 -31.022 -1.322 -24.808 1.00 61.81 C ATOM 422 C ALA A 49 -31.166 -2.049 -26.130 1.00 62.40 C ATOM 423 O ALA A 49 -30.171 -2.412 -26.758 1.00 68.87 O ATOM 424 CB ALA A 49 -31.605 -2.167 -23.687 1.00 61.78 C ATOM 425 H ALA A 49 -32.382 0.203 -24.113 1.00 0.00 H ATOM 426 N ASN A 50 -32.405 -2.270 -26.548 1.00 61.35 N ATOM 427 CA ASN A 50 -32.659 -3.085 -27.717 1.00 67.94 C ATOM 428 C ASN A 50 -31.955 -2.581 -28.969 1.00 70.96 C ATOM 429 O ASN A 50 -31.260 -3.353 -29.639 1.00 70.03 O ATOM 430 CB ASN A 50 -34.162 -3.190 -27.947 1.00 72.32 C ATOM 431 CG ASN A 50 -34.815 -4.142 -26.967 1.00 79.60 C ATOM 432 OD1 ASN A 50 -34.822 -5.347 -27.186 1.00 76.36 O ATOM 433 ND2 ASN A 50 -35.305 -3.611 -25.846 1.00 79.82 N ATOM 434 HD22 ASN A 50 -35.278 -2.581 -25.703 1.00 0.00 H ATOM 435 HD21 ASN A 50 -35.714 -4.227 -25.115 1.00 0.00 H ATOM 436 H ASN A 50 -33.204 -1.853 -26.029 1.00 0.00 H ATOM 437 N GLU A 51 -32.104 -1.294 -29.270 1.00 64.64 N ATOM 438 CA GLU A 51 -31.472 -0.732 -30.467 1.00 71.86 C ATOM 439 C GLU A 51 -29.955 -0.927 -30.474 1.00 73.55 C ATOM 440 O GLU A 51 -29.374 -1.288 -31.502 1.00 75.21 O ATOM 441 CB GLU A 51 -31.781 0.768 -30.604 1.00 82.10 C ATOM 442 CG GLU A 51 -33.197 1.095 -31.023 1.00 88.50 C ATOM 443 CD GLU A 51 -34.151 1.218 -29.844 1.00 99.81 C ATOM 444 OE1 GLU A 51 -33.851 0.696 -28.739 1.00 88.99 O ATOM 445 OE2 GLU A 51 -35.211 1.850 -30.033 1.00109.57 O ATOM 446 H GLU A 51 -32.673 -0.682 -28.651 1.00 0.00 H ATOM 447 N ILE A 52 -29.320 -0.693 -29.327 1.00 67.61 N ATOM 448 CA ILE A 52 -27.861 -0.689 -29.245 1.00 66.82 C ATOM 449 C ILE A 52 -27.270 -2.042 -29.615 1.00 65.86 C ATOM 450 O ILE A 52 -26.196 -2.116 -30.202 1.00 70.10 O ATOM 451 CB ILE A 52 -27.393 -0.266 -27.837 1.00 65.89 C ATOM 452 CG1 ILE A 52 -27.623 1.234 -27.638 1.00 64.67 C ATOM 453 CG2 ILE A 52 -25.905 -0.570 -27.618 1.00 65.43 C ATOM 454 CD1 ILE A 52 -27.376 1.697 -26.203 1.00 60.51 C ATOM 455 H ILE A 52 -29.876 -0.508 -28.468 1.00 0.00 H ATOM 456 N VAL A 53 -27.977 -3.119 -29.307 1.00 67.66 N ATOM 457 CA VAL A 53 -27.435 -4.428 -29.644 1.00 66.52 C ATOM 458 C VAL A 53 -28.292 -5.151 -30.676 1.00 72.55 C ATOM 459 O VAL A 53 -28.172 -6.357 -30.856 1.00 72.00 O ATOM 460 CB VAL A 53 -27.265 -5.290 -28.399 1.00 65.08 C ATOM 461 CG1 VAL A 53 -26.153 -4.705 -27.515 1.00 65.81 C ATOM 462 CG2 VAL A 53 -28.570 -5.371 -27.628 1.00 72.08 C ATOM 463 H VAL A 53 -28.899 -3.032 -28.835 1.00 0.00 H ATOM 464 N GLY A 54 -29.145 -4.396 -31.357 1.00 73.86 N ATOM 465 CA GLY A 54 -29.971 -4.939 -32.419 1.00 82.29 C ATOM 466 C GLY A 54 -30.843 -6.117 -32.028 1.00 80.02 C ATOM 467 O GLY A 54 -30.980 -7.075 -32.794 1.00 77.83 O ATOM 468 H GLY A 54 -29.224 -3.386 -31.123 1.00 0.00 H ATOM 469 N MET A 55 -31.442 -6.045 -30.845 1.00 74.67 N ATOM 470 CA MET A 55 -32.388 -7.069 -30.404 1.00 79.80 C ATOM 471 C MET A 55 -33.815 -6.676 -30.749 1.00 80.17 C ATOM 472 O MET A 55 -34.114 -5.505 -30.985 1.00 84.89 O ATOM 473 CB MET A 55 -32.278 -7.323 -28.898 1.00 88.48 C ATOM 474 CG MET A 55 -30.883 -7.652 -28.417 1.00 94.66 C ATOM 475 SD MET A 55 -29.933 -8.669 -29.565 1.00155.73 S ATOM 476 CE MET A 55 -30.819 -10.201 -29.408 1.00 78.41 C ATOM 477 H MET A 55 -31.233 -5.242 -30.218 1.00 0.00 H ATOM 478 N LEU A 56 -34.687 -7.676 -30.788 1.00 71.69 N ATOM 479 CA LEU A 56 -36.091 -7.492 -31.133 1.00 70.93 C ATOM 480 C LEU A 56 -36.936 -7.645 -29.874 1.00 68.73 C ATOM 481 O LEU A 56 -36.447 -8.187 -28.884 1.00 66.70 O ATOM 482 CB LEU A 56 -36.518 -8.517 -32.190 1.00 77.83 C ATOM 483 CG LEU A 56 -36.262 -8.223 -33.668 1.00 83.29 C ATOM 484 CD1 LEU A 56 -34.815 -7.864 -33.955 1.00 78.65 C ATOM 485 CD2 LEU A 56 -36.696 -9.435 -34.491 1.00 85.13 C ATOM 486 H LEU A 56 -34.353 -8.635 -30.562 1.00 0.00 H ATOM 487 N PRO A 57 -38.203 -7.177 -29.910 1.00 71.05 N ATOM 488 CA PRO A 57 -39.120 -7.512 -28.818 1.00 72.78 C ATOM 489 C PRO A 57 -39.056 -9.004 -28.529 1.00 71.83 C ATOM 490 O PRO A 57 -39.114 -9.807 -29.454 1.00 72.02 O ATOM 491 CB PRO A 57 -40.494 -7.120 -29.369 1.00 69.26 C ATOM 492 CG PRO A 57 -40.204 -6.049 -30.364 1.00 71.57 C ATOM 493 CD PRO A 57 -38.870 -6.391 -30.967 1.00 75.81 C ATOM 494 N GLY A 58 -38.886 -9.366 -27.268 1.00 65.95 N ATOM 495 CA GLY A 58 -38.816 -10.764 -26.899 1.00 67.84 C ATOM 496 C GLY A 58 -37.416 -11.214 -26.536 1.00 63.83 C ATOM 497 O GLY A 58 -37.251 -12.202 -25.826 1.00 66.46 O ATOM 498 H GLY A 58 -38.802 -8.636 -26.532 1.00 0.00 H ATOM 499 N ASP A 59 -36.409 -10.483 -27.005 1.00 62.49 N ATOM 500 CA ASP A 59 -35.018 -10.894 -26.819 1.00 62.95 C ATOM 501 C ASP A 59 -34.393 -10.482 -25.480 1.00 64.59 C ATOM 502 O ASP A 59 -33.532 -11.190 -24.964 1.00 61.96 O ATOM 503 CB ASP A 59 -34.139 -10.331 -27.938 1.00 62.09 C ATOM 504 CG ASP A 59 -34.458 -10.936 -29.301 1.00 74.76 C ATOM 505 OD1 ASP A 59 -34.982 -12.066 -29.350 1.00 73.37 O ATOM 506 OD2 ASP A 59 -34.149 -10.296 -30.325 1.00 71.64 O ATOM 507 H ASP A 59 -36.615 -9.600 -27.515 1.00 0.00 H ATOM 508 N LEU A 60 -34.817 -9.335 -24.948 1.00 62.19 N ATOM 509 CA LEU A 60 -34.092 -8.636 -23.894 1.00 65.45 C ATOM 510 C LEU A 60 -34.974 -8.219 -22.715 1.00 58.37 C ATOM 511 O LEU A 60 -35.814 -7.327 -22.844 1.00 58.89 O ATOM 512 CB LEU A 60 -33.428 -7.387 -24.472 1.00 71.50 C ATOM 513 CG LEU A 60 -31.960 -7.161 -24.162 1.00 83.44 C ATOM 514 CD1 LEU A 60 -31.139 -8.247 -24.852 1.00 89.85 C ATOM 515 CD2 LEU A 60 -31.541 -5.756 -24.616 1.00 81.74 C ATOM 516 H LEU A 60 -35.704 -8.921 -25.300 1.00 0.00 H ATOM 517 N PHE A 61 -34.784 -8.882 -21.582 1.00 57.78 N ATOM 518 CA PHE A 61 -35.397 -8.490 -20.305 1.00 56.83 C ATOM 519 C PHE A 61 -34.615 -7.272 -19.842 1.00 55.39 C ATOM 520 O PHE A 61 -33.386 -7.283 -19.906 1.00 56.07 O ATOM 521 CB PHE A 61 -35.323 -9.645 -19.301 1.00 54.58 C ATOM 522 CG PHE A 61 -36.338 -9.576 -18.174 1.00 57.92 C ATOM 523 CD1 PHE A 61 -37.704 -9.566 -18.437 1.00 59.50 C ATOM 524 CD2 PHE A 61 -35.921 -9.589 -16.849 1.00 58.19 C ATOM 525 CE1 PHE A 61 -38.631 -9.539 -17.404 1.00 56.61 C ATOM 526 CE2 PHE A 61 -36.849 -9.567 -15.802 1.00 59.70 C ATOM 527 CZ PHE A 61 -38.201 -9.534 -16.082 1.00 56.14 C ATOM 528 H PHE A 61 -34.170 -9.722 -21.598 1.00 0.00 H ATOM 529 N VAL A 62 -35.302 -6.214 -19.420 1.00 57.35 N ATOM 530 CA VAL A 62 -34.628 -4.939 -19.168 1.00 51.94 C ATOM 531 C VAL A 62 -34.902 -4.322 -17.794 1.00 53.65 C ATOM 532 O VAL A 62 -36.052 -4.171 -17.400 1.00 51.21 O ATOM 533 CB VAL A 62 -35.027 -3.894 -20.254 1.00 56.26 C ATOM 534 CG1 VAL A 62 -34.524 -2.501 -19.908 1.00 55.24 C ATOM 535 CG2 VAL A 62 -34.483 -4.313 -21.631 1.00 56.48 C ATOM 536 H VAL A 62 -36.328 -6.293 -19.268 1.00 0.00 H ATOM 537 N HIS A 63 -33.835 -3.935 -17.091 1.00 51.65 N ATOM 538 CA HIS A 63 -33.930 -2.991 -15.970 1.00 53.62 C ATOM 539 C HIS A 63 -33.084 -1.769 -16.289 1.00 53.93 C ATOM 540 O HIS A 63 -31.913 -1.895 -16.690 1.00 53.55 O ATOM 541 CB HIS A 63 -33.440 -3.606 -14.659 1.00 55.23 C ATOM 542 CG HIS A 63 -33.541 -2.690 -13.466 1.00 49.63 C ATOM 543 ND1 HIS A 63 -34.734 -2.153 -13.028 1.00 48.79 N ATOM 544 CD2 HIS A 63 -32.599 -2.278 -12.578 1.00 51.32 C ATOM 545 CE1 HIS A 63 -34.519 -1.425 -11.943 1.00 52.92 C ATOM 546 NE2 HIS A 63 -33.235 -1.483 -11.650 1.00 50.14 N ATOM 547 H HIS A 63 -32.902 -4.316 -17.347 1.00 0.00 H ATOM 548 N ARG A 64 -33.669 -0.590 -16.129 1.00 49.26 N ATOM 549 CA ARG A 64 -32.899 0.640 -16.250 1.00 50.66 C ATOM 550 C ARG A 64 -33.175 1.538 -15.053 1.00 52.17 C ATOM 551 O ARG A 64 -34.342 1.717 -14.656 1.00 51.85 O ATOM 552 CB ARG A 64 -33.216 1.358 -17.567 1.00 53.46 C ATOM 553 CG ARG A 64 -32.628 0.637 -18.782 1.00 52.57 C ATOM 554 CD ARG A 64 -33.160 1.166 -20.101 1.00 53.53 C ATOM 555 NE ARG A 64 -32.715 2.538 -20.421 1.00 53.83 N ATOM 556 CZ ARG A 64 -33.116 3.170 -21.517 1.00 55.79 C ATOM 557 NH1 ARG A 64 -33.949 2.545 -22.343 1.00 54.68 N ATOM 558 NH2 ARG A 64 -32.699 4.402 -21.796 1.00 55.24 N ATOM 559 HE ARG A 64 -32.068 3.023 -19.767 1.00 0.00 H ATOM 560 HH12 ARG A 64 -34.277 3.020 -23.208 1.00 0.00 H ATOM 561 HH11 ARG A 64 -34.273 1.581 -22.124 1.00 0.00 H ATOM 562 HH22 ARG A 64 -33.026 4.878 -22.661 1.00 0.00 H ATOM 563 HH21 ARG A 64 -32.046 4.889 -21.149 1.00 0.00 H ATOM 564 H ARG A 64 -34.686 -0.543 -15.915 1.00 0.00 H ATOM 565 N ASN A 65 -32.101 2.049 -14.449 1.00 53.25 N ATOM 566 CA ASN A 65 -32.225 2.990 -13.347 1.00 50.83 C ATOM 567 C ASN A 65 -31.153 4.065 -13.467 1.00 49.60 C ATOM 568 O ASN A 65 -30.336 4.048 -14.397 1.00 53.64 O ATOM 569 CB ASN A 65 -32.172 2.259 -11.967 1.00 48.79 C ATOM 570 CG ASN A 65 -30.797 1.640 -11.640 1.00 48.56 C ATOM 571 OD1 ASN A 65 -29.763 2.290 -11.726 1.00 54.26 O ATOM 572 ND2 ASN A 65 -30.807 0.388 -11.215 1.00 48.42 N ATOM 573 HD22 ASN A 65 -31.705 -0.134 -11.155 1.00 0.00 H ATOM 574 HD21 ASN A 65 -29.917 -0.075 -10.941 1.00 0.00 H ATOM 575 H ASN A 65 -31.154 1.768 -14.773 1.00 0.00 H ATOM 576 N VAL A 66 -31.155 5.023 -12.546 1.00 51.46 N ATOM 577 CA VAL A 66 -30.136 6.054 -12.587 1.00 52.40 C ATOM 578 C VAL A 66 -28.746 5.474 -12.328 1.00 54.27 C ATOM 579 O VAL A 66 -28.445 4.993 -11.235 1.00 55.51 O ATOM 580 CB VAL A 66 -30.417 7.172 -11.585 1.00 60.45 C ATOM 581 CG1 VAL A 66 -29.251 8.155 -11.569 1.00 58.91 C ATOM 582 CG2 VAL A 66 -31.693 7.885 -11.970 1.00 55.98 C ATOM 583 H VAL A 66 -31.881 5.033 -11.802 1.00 0.00 H ATOM 584 N ALA A 67 -27.915 5.517 -13.363 1.00 50.81 N ATOM 585 CA ALA A 67 -26.504 5.114 -13.296 1.00 52.10 C ATOM 586 C ALA A 67 -26.319 3.621 -13.050 1.00 55.79 C ATOM 587 O ALA A 67 -25.258 3.190 -12.588 1.00 58.81 O ATOM 588 CB ALA A 67 -25.752 5.919 -12.231 1.00 55.24 C ATOM 589 H ALA A 67 -28.285 5.856 -14.274 1.00 0.00 H ATOM 590 N ASN A 68 -27.329 2.839 -13.422 1.00 52.09 N ATOM 591 CA ASN A 68 -27.254 1.370 -13.444 1.00 53.18 C ATOM 592 C ASN A 68 -26.627 0.801 -12.182 1.00 59.61 C ATOM 593 O ASN A 68 -25.639 0.062 -12.210 1.00 57.36 O ATOM 594 CB ASN A 68 -26.513 0.863 -14.713 1.00 54.28 C ATOM 595 CG ASN A 68 -25.190 1.598 -15.002 1.00 55.44 C ATOM 596 OD1 ASN A 68 -25.162 2.610 -15.704 1.00 56.90 O ATOM 597 ND2 ASN A 68 -24.086 1.064 -14.479 1.00 55.51 N ATOM 598 HD22 ASN A 68 -24.150 0.209 -13.891 1.00 0.00 H ATOM 599 HD21 ASN A 68 -23.160 1.503 -14.659 1.00 0.00 H ATOM 600 H ASN A 68 -28.220 3.291 -13.713 1.00 0.00 H ATOM 601 N VAL A 69 -27.252 1.151 -11.067 1.00 52.82 N ATOM 602 CA VAL A 69 -26.777 0.800 -9.738 1.00 50.08 C ATOM 603 C VAL A 69 -27.516 -0.438 -9.235 1.00 48.18 C ATOM 604 O VAL A 69 -28.733 -0.554 -9.401 1.00 52.89 O ATOM 605 CB VAL A 69 -26.975 1.995 -8.781 1.00 53.74 C ATOM 606 CG1 VAL A 69 -26.848 1.570 -7.306 1.00 58.61 C ATOM 607 CG2 VAL A 69 -25.994 3.116 -9.138 1.00 54.08 C ATOM 608 H VAL A 69 -28.128 1.706 -11.147 1.00 0.00 H ATOM 609 N VAL A 70 -26.767 -1.371 -8.653 1.00 49.76 N ATOM 610 CA VAL A 70 -27.315 -2.620 -8.117 1.00 46.98 C ATOM 611 C VAL A 70 -26.982 -2.698 -6.639 1.00 52.64 C ATOM 612 O VAL A 70 -25.809 -2.812 -6.261 1.00 51.76 O ATOM 613 CB VAL A 70 -26.751 -3.856 -8.863 1.00 49.31 C ATOM 614 CG1 VAL A 70 -27.304 -5.158 -8.304 1.00 49.92 C ATOM 615 CG2 VAL A 70 -27.080 -3.755 -10.368 1.00 46.47 C ATOM 616 H VAL A 70 -25.743 -1.206 -8.575 1.00 0.00 H ATOM 617 N LEU A 71 -28.015 -2.654 -5.809 1.00 48.91 N ATOM 618 CA LEU A 71 -27.834 -2.659 -4.357 1.00 51.49 C ATOM 619 C LEU A 71 -28.472 -3.893 -3.759 1.00 53.42 C ATOM 620 O LEU A 71 -29.573 -4.282 -4.149 1.00 51.11 O ATOM 621 CB LEU A 71 -28.437 -1.398 -3.731 1.00 54.29 C ATOM 622 CG LEU A 71 -27.849 -0.080 -4.227 1.00 57.52 C ATOM 623 CD1 LEU A 71 -28.745 1.098 -3.833 1.00 58.57 C ATOM 624 CD2 LEU A 71 -26.445 0.099 -3.698 1.00 60.05 C ATOM 625 H LEU A 71 -28.978 -2.615 -6.200 1.00 0.00 H ATOM 626 N HIS A 72 -27.807 -4.486 -2.775 1.00 53.72 N ATOM 627 CA HIS A 72 -28.283 -5.744 -2.236 1.00 59.50 C ATOM 628 C HIS A 72 -29.503 -5.599 -1.320 1.00 53.65 C ATOM 629 O HIS A 72 -30.042 -6.589 -0.853 1.00 51.31 O ATOM 630 CB HIS A 72 -27.145 -6.451 -1.514 1.00 66.88 C ATOM 631 CG HIS A 72 -26.265 -7.240 -2.434 1.00 71.14 C ATOM 632 ND1 HIS A 72 -25.708 -8.450 -2.081 1.00 63.94 N ATOM 633 CD2 HIS A 72 -25.862 -6.991 -3.705 1.00 65.01 C ATOM 634 CE1 HIS A 72 -24.987 -8.908 -3.090 1.00 71.61 C ATOM 635 NE2 HIS A 72 -25.063 -8.043 -4.086 1.00 70.10 N ATOM 636 H HIS A 72 -26.945 -4.048 -2.391 1.00 0.00 H ATOM 637 N THR A 73 -29.960 -4.375 -1.082 1.00 51.16 N ATOM 638 CA THR A 73 -31.200 -4.198 -0.336 1.00 46.02 C ATOM 639 C THR A 73 -32.309 -3.599 -1.190 1.00 53.08 C ATOM 640 O THR A 73 -33.387 -3.256 -0.691 1.00 47.11 O ATOM 641 CB THR A 73 -30.980 -3.297 0.896 1.00 54.19 C ATOM 642 OG1 THR A 73 -30.417 -2.050 0.468 1.00 53.97 O ATOM 643 CG2 THR A 73 -30.014 -3.987 1.847 1.00 53.04 C ATOM 644 HG1 THR A 73 -29.552 -2.217 0.017 1.00 0.00 H ATOM 645 H THR A 73 -29.435 -3.546 -1.427 1.00 0.00 H ATOM 646 N ASP A 74 -32.054 -3.482 -2.488 1.00 48.69 N ATOM 647 CA ASP A 74 -33.052 -2.905 -3.371 1.00 50.31 C ATOM 648 C ASP A 74 -33.904 -3.963 -4.048 1.00 49.07 C ATOM 649 O ASP A 74 -33.475 -4.531 -5.046 1.00 50.56 O ATOM 650 CB ASP A 74 -32.371 -2.043 -4.433 1.00 45.11 C ATOM 651 CG ASP A 74 -33.335 -1.618 -5.535 1.00 49.31 C ATOM 652 OD1 ASP A 74 -34.537 -1.442 -5.247 1.00 49.17 O ATOM 653 OD2 ASP A 74 -32.903 -1.513 -6.698 1.00 48.42 O ATOM 654 H ASP A 74 -31.142 -3.803 -2.871 1.00 0.00 H ATOM 655 N LEU A 75 -35.119 -4.205 -3.548 1.00 46.38 N ATOM 656 CA LEU A 75 -35.971 -5.232 -4.155 1.00 52.70 C ATOM 657 C LEU A 75 -36.478 -4.870 -5.554 1.00 51.33 C ATOM 658 O LEU A 75 -36.970 -5.743 -6.259 1.00 52.24 O ATOM 659 CB LEU A 75 -37.171 -5.555 -3.251 1.00 54.73 C ATOM 660 CG LEU A 75 -37.010 -6.868 -2.459 1.00 63.91 C ATOM 661 CD1 LEU A 75 -35.654 -6.951 -1.778 1.00 64.12 C ATOM 662 CD2 LEU A 75 -38.144 -7.041 -1.449 1.00 61.42 C ATOM 663 H LEU A 75 -35.461 -3.665 -2.728 1.00 0.00 H ATOM 664 N ASN A 76 -36.376 -3.602 -5.955 1.00 50.50 N ATOM 665 CA ASN A 76 -36.683 -3.223 -7.341 1.00 46.96 C ATOM 666 C ASN A 76 -35.745 -3.947 -8.329 1.00 48.48 C ATOM 667 O ASN A 76 -36.167 -4.842 -9.070 1.00 49.36 O ATOM 668 CB ASN A 76 -36.577 -1.696 -7.540 1.00 46.25 C ATOM 669 CG ASN A 76 -37.029 -1.239 -8.939 1.00 52.15 C ATOM 670 OD1 ASN A 76 -36.848 -1.947 -9.935 1.00 46.95 O ATOM 671 ND2 ASN A 76 -37.606 -0.040 -9.012 1.00 47.93 N ATOM 672 HD22 ASN A 76 -37.740 0.526 -8.150 1.00 0.00 H ATOM 673 HD21 ASN A 76 -37.922 0.330 -9.931 1.00 0.00 H ATOM 674 H ASN A 76 -36.075 -2.872 -5.278 1.00 0.00 H ATOM 675 N CYS A 77 -34.474 -3.569 -8.327 1.00 47.74 N ATOM 676 CA CYS A 77 -33.508 -4.228 -9.194 1.00 50.05 C ATOM 677 C CYS A 77 -33.396 -5.730 -8.884 1.00 57.84 C ATOM 678 O CYS A 77 -33.337 -6.560 -9.793 1.00 51.59 O ATOM 679 CB CYS A 77 -32.134 -3.561 -9.071 1.00 50.28 C ATOM 680 SG CYS A 77 -30.889 -4.330 -10.151 1.00 51.38 S ATOM 681 H CYS A 77 -34.165 -2.797 -7.702 1.00 0.00 H ATOM 682 N LEU A 78 -33.360 -6.088 -7.604 1.00 50.17 N ATOM 683 CA LEU A 78 -33.191 -7.497 -7.268 1.00 52.67 C ATOM 684 C LEU A 78 -34.361 -8.352 -7.767 1.00 54.14 C ATOM 685 O LEU A 78 -34.159 -9.512 -8.111 1.00 52.09 O ATOM 686 CB LEU A 78 -33.018 -7.682 -5.758 1.00 50.81 C ATOM 687 CG LEU A 78 -31.722 -7.104 -5.175 1.00 53.42 C ATOM 688 CD1 LEU A 78 -31.691 -7.298 -3.645 1.00 52.05 C ATOM 689 CD2 LEU A 78 -30.489 -7.720 -5.805 1.00 55.72 C ATOM 690 H LEU A 78 -33.451 -5.374 -6.854 1.00 0.00 H ATOM 691 N SER A 79 -35.575 -7.796 -7.834 1.00 50.51 N ATOM 692 CA SER A 79 -36.709 -8.620 -8.258 1.00 52.33 C ATOM 693 C SER A 79 -36.640 -8.859 -9.759 1.00 54.68 C ATOM 694 O SER A 79 -37.045 -9.921 -10.230 1.00 54.61 O ATOM 695 CB SER A 79 -38.052 -7.992 -7.881 1.00 52.82 C ATOM 696 OG SER A 79 -38.216 -7.993 -6.466 1.00 54.65 O ATOM 697 HG SER A 79 -37.485 -7.471 -6.050 1.00 0.00 H ATOM 698 H SER A 79 -35.712 -6.795 -7.589 1.00 0.00 H ATOM 699 N VAL A 80 -36.115 -7.875 -10.494 1.00 51.45 N ATOM 700 CA VAL A 80 -35.863 -8.039 -11.916 1.00 47.30 C ATOM 701 C VAL A 80 -34.823 -9.149 -12.113 1.00 53.20 C ATOM 702 O VAL A 80 -35.014 -10.047 -12.926 1.00 56.76 O ATOM 703 CB VAL A 80 -35.359 -6.759 -12.575 1.00 46.15 C ATOM 704 CG1 VAL A 80 -35.100 -7.048 -14.053 1.00 50.88 C ATOM 705 CG2 VAL A 80 -36.377 -5.627 -12.426 1.00 45.40 C ATOM 706 H VAL A 80 -35.881 -6.970 -10.038 1.00 0.00 H ATOM 707 N ILE A 81 -33.726 -9.091 -11.357 1.00 54.61 N ATOM 708 CA ILE A 81 -32.704 -10.128 -11.463 1.00 55.79 C ATOM 709 C ILE A 81 -33.301 -11.495 -11.120 1.00 54.85 C ATOM 710 O ILE A 81 -33.085 -12.490 -11.831 1.00 54.55 O ATOM 711 CB ILE A 81 -31.481 -9.849 -10.559 1.00 57.92 C ATOM 712 CG1 ILE A 81 -30.746 -8.591 -11.042 1.00 53.63 C ATOM 713 CG2 ILE A 81 -30.530 -11.046 -10.578 1.00 54.35 C ATOM 714 CD1 ILE A 81 -29.670 -8.048 -10.067 1.00 50.01 C ATOM 715 H ILE A 81 -33.598 -8.304 -10.689 1.00 0.00 H ATOM 716 N GLN A 82 -34.097 -11.547 -10.059 1.00 55.11 N ATOM 717 CA GLN A 82 -34.598 -12.841 -9.624 1.00 56.68 C ATOM 718 C GLN A 82 -35.614 -13.387 -10.613 1.00 59.71 C ATOM 719 O GLN A 82 -35.629 -14.592 -10.887 1.00 61.66 O ATOM 720 CB GLN A 82 -35.215 -12.766 -8.230 1.00 57.24 C ATOM 721 CG GLN A 82 -35.730 -14.129 -7.785 1.00 68.79 C ATOM 722 CD GLN A 82 -36.173 -14.136 -6.358 1.00 86.30 C ATOM 723 OE1 GLN A 82 -37.125 -13.454 -5.993 1.00 90.21 O ATOM 724 NE2 GLN A 82 -35.488 -14.914 -5.533 1.00 99.28 N ATOM 725 HE22 GLN A 82 -34.688 -15.474 -5.890 1.00 0.00 H ATOM 726 HE21 GLN A 82 -35.750 -14.965 -4.528 1.00 0.00 H ATOM 727 H GLN A 82 -34.357 -10.679 -9.549 1.00 0.00 H ATOM 728 N PHE A 83 -36.454 -12.510 -11.161 1.00 59.20 N ATOM 729 CA PHE A 83 -37.401 -12.959 -12.179 1.00 60.46 C ATOM 730 C PHE A 83 -36.613 -13.490 -13.372 1.00 58.92 C ATOM 731 O PHE A 83 -36.893 -14.589 -13.875 1.00 60.42 O ATOM 732 CB PHE A 83 -38.357 -11.834 -12.599 1.00 61.58 C ATOM 733 CG PHE A 83 -39.647 -12.328 -13.239 1.00 64.70 C ATOM 734 CD1 PHE A 83 -40.784 -12.530 -12.467 1.00 65.58 C ATOM 735 CD2 PHE A 83 -39.721 -12.573 -14.609 1.00 60.99 C ATOM 736 CE1 PHE A 83 -41.964 -12.986 -13.038 1.00 64.03 C ATOM 737 CE2 PHE A 83 -40.902 -13.022 -15.188 1.00 66.14 C ATOM 738 CZ PHE A 83 -42.023 -13.225 -14.402 1.00 66.90 C ATOM 739 H PHE A 83 -36.436 -11.513 -10.866 1.00 0.00 H ATOM 740 N ALA A 84 -35.621 -12.715 -13.807 1.00 57.47 N ATOM 741 CA ALA A 84 -34.780 -13.087 -14.949 1.00 60.34 C ATOM 742 C ALA A 84 -34.077 -14.428 -14.728 1.00 60.77 C ATOM 743 O ALA A 84 -34.119 -15.306 -15.596 1.00 61.80 O ATOM 744 CB ALA A 84 -33.740 -11.993 -15.231 1.00 52.93 C ATOM 745 H ALA A 84 -35.437 -11.815 -13.320 1.00 0.00 H ATOM 746 N VAL A 85 -33.446 -14.583 -13.563 1.00 58.43 N ATOM 747 CA VAL A 85 -32.613 -15.752 -13.295 1.00 59.67 C ATOM 748 C VAL A 85 -33.439 -16.988 -12.910 1.00 63.90 C ATOM 749 O VAL A 85 -33.198 -18.078 -13.424 1.00 65.30 O ATOM 750 CB VAL A 85 -31.580 -15.455 -12.185 1.00 60.49 C ATOM 751 CG1 VAL A 85 -30.879 -16.746 -11.719 1.00 56.68 C ATOM 752 CG2 VAL A 85 -30.570 -14.399 -12.665 1.00 57.88 C ATOM 753 H VAL A 85 -33.550 -13.854 -12.828 1.00 0.00 H ATOM 754 N ASP A 86 -34.424 -16.814 -12.037 1.00 60.68 N ATOM 755 CA ASP A 86 -35.194 -17.951 -11.517 1.00 68.21 C ATOM 756 C ASP A 86 -36.369 -18.374 -12.406 1.00 69.23 C ATOM 757 O ASP A 86 -36.629 -19.563 -12.579 1.00 70.07 O ATOM 758 CB ASP A 86 -35.738 -17.647 -10.114 1.00 67.70 C ATOM 759 CG ASP A 86 -34.662 -17.625 -9.056 1.00 66.41 C ATOM 760 OD1 ASP A 86 -33.495 -17.913 -9.374 1.00 61.96 O ATOM 761 OD2 ASP A 86 -34.997 -17.341 -7.892 1.00 61.69 O ATOM 762 H ASP A 86 -34.655 -15.853 -11.715 1.00 0.00 H ATOM 763 N VAL A 87 -37.105 -17.403 -12.932 1.00 63.15 N ATOM 764 CA VAL A 87 -38.299 -17.705 -13.714 1.00 65.38 C ATOM 765 C VAL A 87 -37.988 -17.814 -15.211 1.00 68.49 C ATOM 766 O VAL A 87 -38.326 -18.814 -15.850 1.00 71.12 O ATOM 767 CB VAL A 87 -39.406 -16.642 -13.479 1.00 70.84 C ATOM 768 CG1 VAL A 87 -40.658 -16.986 -14.269 1.00 75.21 C ATOM 769 CG2 VAL A 87 -39.741 -16.548 -12.008 1.00 68.34 C ATOM 770 H VAL A 87 -36.826 -16.412 -12.785 1.00 0.00 H ATOM 771 N LEU A 88 -37.329 -16.808 -15.778 1.00 64.76 N ATOM 772 CA LEU A 88 -37.051 -16.820 -17.219 1.00 58.77 C ATOM 773 C LEU A 88 -35.817 -17.646 -17.568 1.00 57.61 C ATOM 774 O LEU A 88 -35.690 -18.144 -18.690 1.00 63.80 O ATOM 775 CB LEU A 88 -36.889 -15.394 -17.740 1.00 56.96 C ATOM 776 CG LEU A 88 -38.109 -14.512 -17.491 1.00 65.54 C ATOM 777 CD1 LEU A 88 -37.815 -13.106 -18.005 1.00 62.62 C ATOM 778 CD2 LEU A 88 -39.376 -15.111 -18.124 1.00 61.43 C ATOM 779 H LEU A 88 -37.008 -16.007 -15.197 1.00 0.00 H ATOM 780 N LYS A 89 -34.931 -17.813 -16.588 1.00 62.48 N ATOM 781 CA LYS A 89 -33.657 -18.508 -16.766 1.00 65.24 C ATOM 782 C LYS A 89 -32.839 -17.938 -17.921 1.00 66.48 C ATOM 783 O LYS A 89 -32.386 -18.669 -18.796 1.00 63.45 O ATOM 784 CB LYS A 89 -33.881 -20.009 -16.967 1.00 70.48 C ATOM 785 CG LYS A 89 -34.557 -20.644 -15.760 1.00 77.68 C ATOM 786 CD LYS A 89 -34.390 -22.149 -15.741 1.00 88.80 C ATOM 787 CE LYS A 89 -34.917 -22.718 -14.440 1.00 96.40 C ATOM 788 NZ LYS A 89 -36.283 -22.208 -14.138 1.00100.81 N ATOM 789 HZ1 LYS A 89 -36.255 -21.171 -14.058 1.00 0.00 H ATOM 790 HZ2 LYS A 89 -36.931 -22.481 -14.905 1.00 0.00 H ATOM 791 HZ3 LYS A 89 -36.614 -22.617 -13.241 1.00 0.00 H ATOM 792 H LYS A 89 -35.157 -17.429 -15.648 1.00 0.00 H ATOM 793 N VAL A 90 -32.636 -16.624 -17.892 1.00 64.06 N ATOM 794 CA VAL A 90 -31.722 -15.970 -18.810 1.00 67.25 C ATOM 795 C VAL A 90 -30.326 -16.555 -18.612 1.00 68.29 C ATOM 796 O VAL A 90 -29.987 -17.023 -17.517 1.00 68.15 O ATOM 797 CB VAL A 90 -31.711 -14.426 -18.608 1.00 62.09 C ATOM 798 CG1 VAL A 90 -33.110 -13.855 -18.813 1.00 59.79 C ATOM 799 CG2 VAL A 90 -31.175 -14.057 -17.209 1.00 57.49 C ATOM 800 H VAL A 90 -33.147 -16.049 -17.192 1.00 0.00 H ATOM 801 N LYS A 91 -29.542 -16.565 -19.687 1.00 71.67 N ATOM 802 CA LYS A 91 -28.191 -17.111 -19.668 1.00 71.37 C ATOM 803 C LYS A 91 -27.175 -16.024 -19.395 1.00 66.47 C ATOM 804 O LYS A 91 -26.034 -16.303 -19.033 1.00 67.28 O ATOM 805 CB LYS A 91 -27.840 -17.783 -21.006 1.00 77.19 C ATOM 806 CG LYS A 91 -28.938 -18.610 -21.626 1.00 83.94 C ATOM 807 CD LYS A 91 -29.037 -19.957 -20.955 1.00 93.27 C ATOM 808 CE LYS A 91 -29.929 -20.884 -21.751 1.00 94.89 C ATOM 809 NZ LYS A 91 -29.879 -22.241 -21.172 1.00100.30 N ATOM 810 HZ1 LYS A 91 -28.901 -22.593 -21.201 1.00 0.00 H ATOM 811 HZ2 LYS A 91 -30.207 -22.208 -20.186 1.00 0.00 H ATOM 812 HZ3 LYS A 91 -30.494 -22.874 -21.722 1.00 0.00 H ATOM 813 H LYS A 91 -29.908 -16.168 -20.576 1.00 0.00 H ATOM 814 N HIS A 92 -27.580 -14.776 -19.609 1.00 65.73 N ATOM 815 CA HIS A 92 -26.648 -13.652 -19.501 1.00 67.57 C ATOM 816 C HIS A 92 -27.267 -12.429 -18.875 1.00 64.38 C ATOM 817 O HIS A 92 -28.395 -12.047 -19.187 1.00 61.46 O ATOM 818 CB HIS A 92 -26.101 -13.281 -20.879 1.00 67.49 C ATOM 819 CG HIS A 92 -25.567 -14.447 -21.627 1.00 70.55 C ATOM 820 ND1 HIS A 92 -24.311 -14.972 -21.386 1.00 73.75 N ATOM 821 CD2 HIS A 92 -26.120 -15.236 -22.580 1.00 70.82 C ATOM 822 CE1 HIS A 92 -24.113 -16.010 -22.168 1.00 80.12 C ATOM 823 NE2 HIS A 92 -25.200 -16.190 -22.908 1.00 79.67 N ATOM 824 H HIS A 92 -28.574 -14.595 -19.857 1.00 0.00 H ATOM 825 N ILE A 93 -26.502 -11.814 -17.991 1.00 63.37 N ATOM 826 CA ILE A 93 -26.862 -10.521 -17.448 1.00 57.30 C ATOM 827 C ILE A 93 -25.865 -9.527 -18.026 1.00 65.36 C ATOM 828 O ILE A 93 -24.645 -9.633 -17.806 1.00 63.58 O ATOM 829 CB ILE A 93 -26.845 -10.532 -15.919 1.00 54.59 C ATOM 830 CG1 ILE A 93 -27.912 -11.509 -15.394 1.00 57.28 C ATOM 831 CG2 ILE A 93 -27.107 -9.123 -15.369 1.00 53.45 C ATOM 832 CD1 ILE A 93 -27.926 -11.670 -13.888 1.00 54.75 C ATOM 833 H ILE A 93 -25.621 -12.269 -17.678 1.00 0.00 H ATOM 834 N LEU A 94 -26.385 -8.591 -18.811 1.00 62.63 N ATOM 835 CA LEU A 94 -25.561 -7.556 -19.412 1.00 57.36 C ATOM 836 C LEU A 94 -25.579 -6.259 -18.586 1.00 60.44 C ATOM 837 O LEU A 94 -26.475 -5.419 -18.750 1.00 59.97 O ATOM 838 CB LEU A 94 -26.037 -7.270 -20.834 1.00 55.64 C ATOM 839 CG LEU A 94 -26.267 -8.474 -21.753 1.00 62.45 C ATOM 840 CD1 LEU A 94 -26.946 -8.016 -23.046 1.00 65.21 C ATOM 841 CD2 LEU A 94 -24.946 -9.152 -22.081 1.00 66.80 C ATOM 842 H LEU A 94 -27.408 -8.599 -19.000 1.00 0.00 H ATOM 843 N VAL A 95 -24.597 -6.091 -17.704 1.00 60.08 N ATOM 844 CA VAL A 95 -24.452 -4.829 -16.984 1.00 61.57 C ATOM 845 C VAL A 95 -23.779 -3.810 -17.901 1.00 63.52 C ATOM 846 O VAL A 95 -22.579 -3.910 -18.205 1.00 63.11 O ATOM 847 CB VAL A 95 -23.636 -4.980 -15.690 1.00 64.56 C ATOM 848 CG1 VAL A 95 -23.581 -3.648 -14.941 1.00 58.95 C ATOM 849 CG2 VAL A 95 -24.255 -6.064 -14.805 1.00 62.55 C ATOM 850 H VAL A 95 -23.926 -6.866 -17.526 1.00 0.00 H ATOM 851 N THR A 96 -24.561 -2.836 -18.346 1.00 53.89 N ATOM 852 CA THR A 96 -24.063 -1.828 -19.261 1.00 59.06 C ATOM 853 C THR A 96 -24.170 -0.424 -18.673 1.00 58.59 C ATOM 854 O THR A 96 -25.268 0.097 -18.460 1.00 59.52 O ATOM 855 CB THR A 96 -24.828 -1.869 -20.603 1.00 61.61 C ATOM 856 OG1 THR A 96 -24.792 -3.201 -21.144 1.00 62.76 O ATOM 857 CG2 THR A 96 -24.212 -0.890 -21.603 1.00 59.90 C ATOM 858 HG1 THR A 96 -25.284 -3.220 -22.003 1.00 0.00 H ATOM 859 H THR A 96 -25.552 -2.794 -18.032 1.00 0.00 H ATOM 860 N GLY A 97 -23.026 0.183 -18.398 1.00 56.60 N ATOM 861 CA GLY A 97 -23.000 1.577 -17.981 1.00 56.40 C ATOM 862 C GLY A 97 -22.710 2.346 -19.251 1.00 67.30 C ATOM 863 O GLY A 97 -22.658 1.756 -20.339 1.00 63.45 O ATOM 864 H GLY A 97 -22.133 -0.344 -18.481 1.00 0.00 H ATOM 865 N HIS A 98 -22.527 3.654 -19.152 1.00 59.83 N ATOM 866 CA HIS A 98 -22.136 4.388 -20.353 1.00 62.23 C ATOM 867 C HIS A 98 -21.245 5.568 -20.009 1.00 63.95 C ATOM 868 O HIS A 98 -21.250 6.066 -18.880 1.00 63.41 O ATOM 869 CB HIS A 98 -23.374 4.865 -21.120 1.00 59.67 C ATOM 870 CG HIS A 98 -24.225 5.834 -20.351 1.00 69.26 C ATOM 871 ND1 HIS A 98 -24.142 7.201 -20.520 1.00 64.40 N ATOM 872 CD2 HIS A 98 -25.180 5.628 -19.408 1.00 64.25 C ATOM 873 CE1 HIS A 98 -25.002 7.797 -19.713 1.00 58.42 C ATOM 874 NE2 HIS A 98 -25.648 6.867 -19.031 1.00 58.68 N ATOM 875 H HIS A 98 -22.658 4.145 -18.245 1.00 0.00 H ATOM 876 N TYR A 99 -20.475 6.025 -20.988 1.00 66.49 N ATOM 877 CA TYR A 99 -19.653 7.207 -20.788 1.00 63.95 C ATOM 878 C TYR A 99 -20.553 8.429 -20.694 1.00 67.65 C ATOM 879 O TYR A 99 -21.676 8.429 -21.218 1.00 63.33 O ATOM 880 CB TYR A 99 -18.624 7.365 -21.922 1.00 66.64 C ATOM 881 CG TYR A 99 -17.561 6.288 -21.903 1.00 70.18 C ATOM 882 CD1 TYR A 99 -17.401 5.419 -22.972 1.00 77.42 C ATOM 883 CD2 TYR A 99 -16.744 6.119 -20.793 1.00 65.78 C ATOM 884 CE1 TYR A 99 -16.426 4.419 -22.950 1.00 82.07 C ATOM 885 CE2 TYR A 99 -15.764 5.124 -20.755 1.00 74.26 C ATOM 886 CZ TYR A 99 -15.610 4.279 -21.840 1.00 78.00 C ATOM 887 OH TYR A 99 -14.645 3.290 -21.805 1.00 76.18 O ATOM 888 HH TYR A 99 -13.753 3.705 -21.691 1.00 0.00 H ATOM 889 H TYR A 99 -20.459 5.534 -21.905 1.00 0.00 H ATOM 890 N GLY A 100 -20.064 9.455 -20.001 1.00 71.83 N ATOM 891 CA GLY A 100 -20.799 10.695 -19.845 1.00 70.14 C ATOM 892 C GLY A 100 -22.049 10.555 -18.989 1.00 72.44 C ATOM 893 O GLY A 100 -22.964 11.367 -19.106 1.00 68.13 O ATOM 894 H GLY A 100 -19.127 9.364 -19.558 1.00 0.00 H ATOM 895 N CYS A 101 -22.097 9.534 -18.134 1.00 65.14 N ATOM 896 CA CYS A 101 -23.274 9.315 -17.292 1.00 58.77 C ATOM 897 C CYS A 101 -23.428 10.451 -16.288 1.00 63.35 C ATOM 898 O CYS A 101 -22.494 10.771 -15.562 1.00 60.17 O ATOM 899 CB CYS A 101 -23.181 7.967 -16.572 1.00 62.28 C ATOM 900 SG CYS A 101 -24.647 7.481 -15.595 1.00 60.78 S ATOM 901 H CYS A 101 -21.288 8.884 -18.064 1.00 0.00 H ATOM 902 N GLY A 102 -24.609 11.057 -16.250 1.00 65.56 N ATOM 903 CA GLY A 102 -24.875 12.168 -15.355 1.00 66.64 C ATOM 904 C GLY A 102 -24.980 11.757 -13.898 1.00 67.11 C ATOM 905 O GLY A 102 -24.674 12.542 -12.996 1.00 62.28 O ATOM 906 H GLY A 102 -25.366 10.725 -16.881 1.00 0.00 H ATOM 907 N GLY A 103 -25.422 10.526 -13.659 1.00 63.82 N ATOM 908 CA GLY A 103 -25.477 10.001 -12.306 1.00 61.29 C ATOM 909 C GLY A 103 -24.070 9.853 -11.763 1.00 63.86 C ATOM 910 O GLY A 103 -23.774 10.248 -10.630 1.00 64.32 O ATOM 911 H GLY A 103 -25.733 9.930 -14.453 1.00 0.00 H ATOM 912 N VAL A 104 -23.193 9.284 -12.586 1.00 58.06 N ATOM 913 CA VAL A 104 -21.798 9.138 -12.208 1.00 62.80 C ATOM 914 C VAL A 104 -21.205 10.525 -12.025 1.00 68.54 C ATOM 915 O VAL A 104 -20.495 10.775 -11.045 1.00 68.82 O ATOM 916 CB VAL A 104 -21.005 8.337 -13.252 1.00 63.84 C ATOM 917 CG1 VAL A 104 -19.547 8.338 -12.911 1.00 66.75 C ATOM 918 CG2 VAL A 104 -21.529 6.909 -13.326 1.00 63.18 C ATOM 919 H VAL A 104 -23.511 8.939 -13.514 1.00 0.00 H ATOM 920 N ARG A 105 -21.518 11.432 -12.954 1.00 69.49 N ATOM 921 CA ARG A 105 -21.016 12.809 -12.876 1.00 68.64 C ATOM 922 C ARG A 105 -21.437 13.487 -11.573 1.00 69.65 C ATOM 923 O ARG A 105 -20.615 14.108 -10.887 1.00 73.21 O ATOM 924 CB ARG A 105 -21.507 13.637 -14.065 1.00 64.87 C ATOM 925 CG ARG A 105 -21.111 15.110 -13.976 1.00 71.19 C ATOM 926 CD ARG A 105 -21.424 15.873 -15.253 1.00 77.12 C ATOM 927 NE ARG A 105 -20.564 15.458 -16.352 1.00 87.74 N ATOM 928 CZ ARG A 105 -20.981 14.750 -17.397 1.00 89.98 C ATOM 929 NH1 ARG A 105 -22.257 14.383 -17.495 1.00 89.68 N ATOM 930 NH2 ARG A 105 -20.123 14.418 -18.348 1.00 88.98 N ATOM 931 HE ARG A 105 -19.561 15.732 -16.317 1.00 0.00 H ATOM 932 HH12 ARG A 105 -22.577 13.829 -18.315 1.00 0.00 H ATOM 933 HH11 ARG A 105 -22.933 14.650 -16.752 1.00 0.00 H ATOM 934 HH22 ARG A 105 -20.444 13.864 -19.168 1.00 0.00 H ATOM 935 HH21 ARG A 105 -19.128 14.711 -18.276 1.00 0.00 H ATOM 936 H ARG A 105 -22.130 11.157 -13.749 1.00 0.00 H ATOM 937 N ALA A 106 -22.722 13.368 -11.241 1.00 64.51 N ATOM 938 CA ALA A 106 -23.266 13.980 -10.034 1.00 69.26 C ATOM 939 C ALA A 106 -22.532 13.481 -8.788 1.00 71.50 C ATOM 940 O ALA A 106 -22.310 14.233 -7.835 1.00 70.88 O ATOM 941 CB ALA A 106 -24.760 13.699 -9.926 1.00 70.71 C ATOM 942 H ALA A 106 -23.355 12.823 -11.860 1.00 0.00 H ATOM 943 N SER A 107 -22.137 12.214 -8.814 1.00 70.37 N ATOM 944 CA SER A 107 -21.432 11.599 -7.691 1.00 70.81 C ATOM 945 C SER A 107 -20.014 12.128 -7.537 1.00 72.93 C ATOM 946 O SER A 107 -19.379 11.935 -6.503 1.00 77.08 O ATOM 947 CB SER A 107 -21.389 10.087 -7.863 1.00 60.44 C ATOM 948 OG SER A 107 -22.702 9.585 -7.957 1.00 70.37 O ATOM 949 HG SER A 107 -23.155 9.993 -8.737 1.00 0.00 H ATOM 950 H SER A 107 -22.335 11.641 -9.659 1.00 0.00 H ATOM 951 N LEU A 108 -19.512 12.781 -8.575 1.00 69.97 N ATOM 952 CA LEU A 108 -18.172 13.338 -8.528 1.00 74.48 C ATOM 953 C LEU A 108 -18.187 14.784 -8.034 1.00 82.19 C ATOM 954 O LEU A 108 -17.155 15.326 -7.642 1.00 88.14 O ATOM 955 CB LEU A 108 -17.529 13.256 -9.907 1.00 81.09 C ATOM 956 CG LEU A 108 -16.029 13.005 -9.956 1.00 88.06 C ATOM 957 CD1 LEU A 108 -15.682 11.743 -9.190 1.00 83.93 C ATOM 958 CD2 LEU A 108 -15.592 12.894 -11.413 1.00 97.23 C ATOM 959 H LEU A 108 -20.086 12.896 -9.435 1.00 0.00 H ATOM 960 N HIS A 109 -19.358 15.411 -8.071 1.00 81.18 N ATOM 961 CA HIS A 109 -19.497 16.799 -7.647 1.00 80.32 C ATOM 962 C HIS A 109 -20.240 16.866 -6.330 1.00 78.92 C ATOM 963 O HIS A 109 -20.608 15.833 -5.779 1.00 72.92 O ATOM 964 CB HIS A 109 -20.215 17.628 -8.712 1.00 87.28 C ATOM 965 CG HIS A 109 -19.413 17.822 -9.958 1.00102.52 C ATOM 966 ND1 HIS A 109 -18.955 16.765 -10.721 1.00107.82 N ATOM 967 CD2 HIS A 109 -18.959 18.943 -10.565 1.00112.20 C ATOM 968 CE1 HIS A 109 -18.271 17.229 -11.747 1.00107.74 C ATOM 969 NE2 HIS A 109 -18.258 18.550 -11.679 1.00113.98 N ATOM 970 H HIS A 109 -20.197 14.899 -8.411 1.00 0.00 H ATOM 971 N ASN A 110 -20.469 18.075 -5.824 1.00 75.32 N ATOM 972 CA ASN A 110 -20.968 18.207 -4.465 1.00 78.58 C ATOM 973 C ASN A 110 -22.322 18.904 -4.353 1.00 75.21 C ATOM 974 O ASN A 110 -22.717 19.332 -3.265 1.00 79.54 O ATOM 975 CB ASN A 110 -19.932 18.940 -3.612 1.00 84.31 C ATOM 976 CG ASN A 110 -19.929 20.436 -3.851 1.00108.35 C ATOM 977 OD1 ASN A 110 -20.143 20.909 -4.971 1.00114.26 O ATOM 978 ND2 ASN A 110 -19.696 21.197 -2.785 1.00120.51 N ATOM 979 HD22 ASN A 110 -19.520 20.756 -1.860 1.00 0.00 H ATOM 980 HD21 ASN A 110 -19.689 22.233 -2.877 1.00 0.00 H ATOM 981 H ASN A 110 -20.292 18.923 -6.399 1.00 0.00 H ATOM 982 N ASP A 111 -23.043 18.996 -5.468 1.00 73.34 N ATOM 983 CA ASP A 111 -24.402 19.528 -5.457 1.00 69.80 C ATOM 984 C ASP A 111 -25.396 18.487 -4.957 1.00 70.72 C ATOM 985 O ASP A 111 -25.248 17.298 -5.223 1.00 66.54 O ATOM 986 CB ASP A 111 -24.810 20.004 -6.856 1.00 70.49 C ATOM 987 CG ASP A 111 -23.763 20.890 -7.491 1.00 84.29 C ATOM 988 OD1 ASP A 111 -23.728 22.096 -7.169 1.00 86.82 O ATOM 989 OD2 ASP A 111 -22.979 20.377 -8.316 1.00 89.93 O ATOM 990 H ASP A 111 -22.628 18.681 -6.368 1.00 0.00 H ATOM 991 N GLN A 112 -26.406 18.942 -4.222 1.00 64.16 N ATOM 992 CA GLN A 112 -27.476 18.074 -3.776 1.00 70.77 C ATOM 993 C GLN A 112 -28.566 18.038 -4.828 1.00 75.06 C ATOM 994 O GLN A 112 -29.030 19.084 -5.290 1.00 77.62 O ATOM 995 CB GLN A 112 -28.061 18.547 -2.447 1.00 67.32 C ATOM 996 CG GLN A 112 -27.112 18.520 -1.292 1.00 67.94 C ATOM 997 CD GLN A 112 -27.787 18.991 -0.008 1.00 66.60 C ATOM 998 OE1 GLN A 112 -28.854 18.498 0.368 1.00 66.86 O ATOM 999 NE2 GLN A 112 -27.189 19.980 0.638 1.00 67.78 N ATOM 1000 HE22 GLN A 112 -26.290 20.364 0.283 1.00 0.00 H ATOM 1001 HE21 GLN A 112 -27.618 20.373 1.500 1.00 0.00 H ATOM 1002 H GLN A 112 -26.428 19.948 -3.960 1.00 0.00 H ATOM 1003 N LEU A 113 -28.980 16.829 -5.191 1.00 68.76 N ATOM 1004 CA LEU A 113 -30.028 16.638 -6.183 1.00 69.64 C ATOM 1005 C LEU A 113 -31.277 16.013 -5.542 1.00 76.01 C ATOM 1006 O LEU A 113 -32.219 15.634 -6.240 1.00 80.17 O ATOM 1007 CB LEU A 113 -29.513 15.758 -7.333 1.00 72.36 C ATOM 1008 CG LEU A 113 -28.723 16.362 -8.510 1.00 77.83 C ATOM 1009 CD1 LEU A 113 -27.625 17.318 -8.068 1.00 80.61 C ATOM 1010 CD2 LEU A 113 -28.143 15.252 -9.405 1.00 66.11 C ATOM 1011 H LEU A 113 -28.542 15.994 -4.753 1.00 0.00 H ATOM 1012 N GLY A 114 -31.277 15.901 -4.214 1.00 69.21 N ATOM 1013 CA GLY A 114 -32.418 15.362 -3.483 1.00 66.60 C ATOM 1014 C GLY A 114 -32.347 13.870 -3.200 1.00 62.98 C ATOM 1015 O GLY A 114 -31.308 13.362 -2.781 1.00 59.45 O ATOM 1016 H GLY A 114 -30.437 16.207 -3.682 1.00 0.00 H ATOM 1017 N LEU A 115 -33.458 13.165 -3.425 1.00 60.69 N ATOM 1018 CA LEU A 115 -33.501 11.706 -3.302 1.00 63.47 C ATOM 1019 C LEU A 115 -32.342 11.018 -3.985 1.00 61.44 C ATOM 1020 O LEU A 115 -31.804 10.038 -3.480 1.00 56.42 O ATOM 1021 CB LEU A 115 -34.789 11.144 -3.897 1.00 64.68 C ATOM 1022 CG LEU A 115 -36.083 11.330 -3.125 1.00 66.52 C ATOM 1023 CD1 LEU A 115 -37.134 10.369 -3.655 1.00 64.67 C ATOM 1024 CD2 LEU A 115 -35.800 11.087 -1.661 1.00 60.22 C ATOM 1025 H LEU A 115 -34.325 13.670 -3.698 1.00 0.00 H ATOM 1026 N ILE A 116 -31.985 11.520 -5.161 1.00 56.23 N ATOM 1027 CA ILE A 116 -30.941 10.903 -5.966 1.00 56.51 C ATOM 1028 C ILE A 116 -29.612 10.850 -5.232 1.00 52.58 C ATOM 1029 O ILE A 116 -28.780 9.981 -5.505 1.00 53.18 O ATOM 1030 CB ILE A 116 -30.746 11.649 -7.290 1.00 67.90 C ATOM 1031 CG1 ILE A 116 -32.104 11.995 -7.908 1.00 71.56 C ATOM 1032 CG2 ILE A 116 -29.952 10.806 -8.254 1.00 84.69 C ATOM 1033 CD1 ILE A 116 -32.016 12.909 -9.113 1.00 67.68 C ATOM 1034 H ILE A 116 -32.462 12.374 -5.515 1.00 0.00 H ATOM 1035 N ASP A 117 -29.410 11.784 -4.303 1.00 55.35 N ATOM 1036 CA ASP A 117 -28.152 11.856 -3.568 1.00 53.89 C ATOM 1037 C ASP A 117 -27.845 10.535 -2.856 1.00 55.36 C ATOM 1038 O ASP A 117 -26.709 10.055 -2.864 1.00 58.09 O ATOM 1039 CB ASP A 117 -28.190 12.990 -2.549 1.00 55.67 C ATOM 1040 CG ASP A 117 -28.289 14.361 -3.197 1.00 63.86 C ATOM 1041 OD1 ASP A 117 -27.957 14.496 -4.397 1.00 65.49 O ATOM 1042 OD2 ASP A 117 -28.693 15.308 -2.495 1.00 62.38 O ATOM 1043 H ASP A 117 -30.162 12.473 -4.099 1.00 0.00 H ATOM 1044 N GLY A 118 -28.866 9.953 -2.245 1.00 53.73 N ATOM 1045 CA GLY A 118 -28.712 8.700 -1.526 1.00 55.56 C ATOM 1046 C GLY A 118 -28.560 7.516 -2.464 1.00 56.55 C ATOM 1047 O GLY A 118 -27.774 6.595 -2.203 1.00 50.43 O ATOM 1048 H GLY A 118 -29.802 10.405 -2.281 1.00 0.00 H ATOM 1049 N TRP A 119 -29.312 7.543 -3.558 1.00 50.25 N ATOM 1050 CA TRP A 119 -29.204 6.522 -4.594 1.00 48.02 C ATOM 1051 C TRP A 119 -27.772 6.379 -5.101 1.00 52.40 C ATOM 1052 O TRP A 119 -27.286 5.265 -5.332 1.00 53.43 O ATOM 1053 CB TRP A 119 -30.142 6.837 -5.776 1.00 50.18 C ATOM 1054 CG TRP A 119 -30.104 5.741 -6.842 1.00 50.02 C ATOM 1055 CD1 TRP A 119 -29.543 5.813 -8.100 1.00 55.17 C ATOM 1056 CD2 TRP A 119 -30.591 4.400 -6.697 1.00 50.60 C ATOM 1057 NE1 TRP A 119 -29.682 4.599 -8.750 1.00 52.51 N ATOM 1058 CE2 TRP A 119 -30.326 3.719 -7.910 1.00 52.80 C ATOM 1059 CE3 TRP A 119 -31.262 3.717 -5.671 1.00 46.67 C ATOM 1060 CZ2 TRP A 119 -30.684 2.384 -8.111 1.00 49.99 C ATOM 1061 CZ3 TRP A 119 -31.612 2.392 -5.866 1.00 51.96 C ATOM 1062 CH2 TRP A 119 -31.319 1.736 -7.084 1.00 51.03 C ATOM 1063 HE1 TRP A 119 -29.354 4.387 -9.714 1.00 0.00 H ATOM 1064 H TRP A 119 -29.998 8.315 -3.680 1.00 0.00 H ATOM 1065 N LEU A 120 -27.090 7.511 -5.253 1.00 51.10 N ATOM 1066 CA LEU A 120 -25.784 7.543 -5.902 1.00 56.44 C ATOM 1067 C LEU A 120 -24.626 7.317 -4.933 1.00 57.19 C ATOM 1068 O LEU A 120 -23.470 7.235 -5.348 1.00 61.16 O ATOM 1069 CB LEU A 120 -25.598 8.885 -6.633 1.00 58.75 C ATOM 1070 CG LEU A 120 -26.567 9.086 -7.798 1.00 57.57 C ATOM 1071 CD1 LEU A 120 -26.499 10.509 -8.284 1.00 58.34 C ATOM 1072 CD2 LEU A 120 -26.228 8.111 -8.938 1.00 58.05 C ATOM 1073 H LEU A 120 -27.500 8.399 -4.899 1.00 0.00 H ATOM 1074 N ARG A 121 -24.952 7.232 -3.646 1.00 53.37 N ATOM 1075 CA ARG A 121 -23.973 6.962 -2.582 1.00 62.25 C ATOM 1076 C ARG A 121 -22.864 5.985 -2.955 1.00 57.90 C ATOM 1077 O ARG A 121 -21.690 6.275 -2.755 1.00 62.78 O ATOM 1078 CB ARG A 121 -24.700 6.424 -1.337 1.00 65.01 C ATOM 1079 CG ARG A 121 -23.805 5.742 -0.305 1.00 73.62 C ATOM 1080 CD ARG A 121 -23.039 6.784 0.459 1.00 82.35 C ATOM 1081 NE ARG A 121 -22.281 6.255 1.588 1.00 79.49 N ATOM 1082 CZ ARG A 121 -21.589 7.036 2.406 1.00 77.38 C ATOM 1083 NH1 ARG A 121 -21.601 8.346 2.204 1.00 71.34 N ATOM 1084 NH2 ARG A 121 -20.905 6.524 3.424 1.00 76.55 N ATOM 1085 HE ARG A 121 -22.284 5.229 1.757 1.00 0.00 H ATOM 1086 HH12 ARG A 121 -21.064 8.974 2.835 1.00 0.00 H ATOM 1087 HH11 ARG A 121 -22.147 8.745 1.414 1.00 0.00 H ATOM 1088 HH22 ARG A 121 -20.367 7.150 4.057 1.00 0.00 H ATOM 1089 HH21 ARG A 121 -20.908 5.497 3.588 1.00 0.00 H ATOM 1090 H ARG A 121 -25.949 7.363 -3.379 1.00 0.00 H ATOM 1091 N SER A 122 -23.240 4.817 -3.473 1.00 53.44 N ATOM 1092 CA SER A 122 -22.268 3.767 -3.733 1.00 60.49 C ATOM 1093 C SER A 122 -21.274 4.186 -4.807 1.00 59.98 C ATOM 1094 O SER A 122 -20.152 3.689 -4.832 1.00 62.74 O ATOM 1095 CB SER A 122 -22.966 2.465 -4.153 1.00 66.60 C ATOM 1096 OG SER A 122 -23.993 2.713 -5.103 1.00 75.19 O ATOM 1097 HG SER A 122 -24.668 3.319 -4.707 1.00 0.00 H ATOM 1098 H SER A 122 -24.243 4.654 -3.695 1.00 0.00 H ATOM 1099 N ILE A 123 -21.688 5.082 -5.706 1.00 58.41 N ATOM 1100 CA ILE A 123 -20.766 5.573 -6.737 1.00 57.38 C ATOM 1101 C ILE A 123 -19.820 6.565 -6.089 1.00 62.01 C ATOM 1102 O ILE A 123 -18.635 6.603 -6.399 1.00 70.03 O ATOM 1103 CB ILE A 123 -21.485 6.246 -7.920 1.00 64.43 C ATOM 1104 CG1 ILE A 123 -22.525 5.305 -8.533 1.00 62.38 C ATOM 1105 CG2 ILE A 123 -20.475 6.672 -9.004 1.00 62.49 C ATOM 1106 CD1 ILE A 123 -23.170 5.871 -9.801 1.00 61.92 C ATOM 1107 H ILE A 123 -22.667 5.433 -5.676 1.00 0.00 H ATOM 1108 N ARG A 124 -20.366 7.352 -5.170 1.00 61.30 N ATOM 1109 CA ARG A 124 -19.585 8.319 -4.434 1.00 66.80 C ATOM 1110 C ARG A 124 -18.535 7.576 -3.609 1.00 69.73 C ATOM 1111 O ARG A 124 -17.389 8.022 -3.512 1.00 67.73 O ATOM 1112 CB ARG A 124 -20.499 9.184 -3.566 1.00 63.15 C ATOM 1113 CG ARG A 124 -19.830 10.435 -3.013 1.00 68.53 C ATOM 1114 CD ARG A 124 -20.836 11.327 -2.291 1.00 66.85 C ATOM 1115 NE ARG A 124 -21.706 12.009 -3.239 1.00 63.31 N ATOM 1116 CZ ARG A 124 -21.385 13.143 -3.854 1.00 67.86 C ATOM 1117 NH1 ARG A 124 -20.210 13.722 -3.614 1.00 64.87 N ATOM 1118 NH2 ARG A 124 -22.239 13.695 -4.709 1.00 70.43 N ATOM 1119 HE ARG A 124 -22.632 11.584 -3.447 1.00 0.00 H ATOM 1120 HH12 ARG A 124 -19.959 14.609 -4.095 1.00 0.00 H ATOM 1121 HH11 ARG A 124 -19.543 13.287 -2.945 1.00 0.00 H ATOM 1122 HH22 ARG A 124 -21.991 14.582 -5.192 1.00 0.00 H ATOM 1123 HH21 ARG A 124 -23.155 13.240 -4.895 1.00 0.00 H ATOM 1124 H ARG A 124 -21.384 7.270 -4.974 1.00 0.00 H ATOM 1125 N ASP A 125 -18.914 6.424 -3.053 1.00 66.80 N ATOM 1126 CA ASP A 125 -17.955 5.547 -2.358 1.00 68.11 C ATOM 1127 C ASP A 125 -16.832 5.083 -3.290 1.00 73.64 C ATOM 1128 O ASP A 125 -15.679 4.948 -2.878 1.00 69.72 O ATOM 1129 CB ASP A 125 -18.663 4.320 -1.764 1.00 69.31 C ATOM 1130 CG ASP A 125 -19.496 4.647 -0.534 1.00 72.26 C ATOM 1131 OD1 ASP A 125 -19.204 5.640 0.166 1.00 70.65 O ATOM 1132 OD2 ASP A 125 -20.437 3.882 -0.248 1.00 71.15 O ATOM 1133 H ASP A 125 -19.912 6.137 -3.112 1.00 0.00 H ATOM 1134 N LEU A 126 -17.181 4.838 -4.549 1.00 65.90 N ATOM 1135 CA LEU A 126 -16.224 4.366 -5.542 1.00 71.86 C ATOM 1136 C LEU A 126 -15.233 5.476 -5.893 1.00 71.76 C ATOM 1137 O LEU A 126 -14.039 5.224 -6.087 1.00 76.92 O ATOM 1138 CB LEU A 126 -16.964 3.894 -6.787 1.00 67.58 C ATOM 1139 CG LEU A 126 -16.343 2.754 -7.555 1.00 79.18 C ATOM 1140 CD1 LEU A 126 -16.396 1.552 -6.699 1.00 73.93 C ATOM 1141 CD2 LEU A 126 -17.224 2.507 -8.746 1.00 79.64 C ATOM 1142 H LEU A 126 -18.170 4.988 -4.835 1.00 0.00 H ATOM 1143 N ALA A 127 -15.745 6.701 -5.966 1.00 68.62 N ATOM 1144 CA ALA A 127 -14.938 7.867 -6.274 1.00 68.96 C ATOM 1145 C ALA A 127 -13.941 8.143 -5.151 1.00 77.12 C ATOM 1146 O ALA A 127 -12.872 8.707 -5.383 1.00 79.18 O ATOM 1147 CB ALA A 127 -15.831 9.067 -6.505 1.00 71.98 C ATOM 1148 H ALA A 127 -16.763 6.828 -5.796 1.00 0.00 H ATOM 1149 N TYR A 128 -14.300 7.751 -3.932 1.00 77.28 N ATOM 1150 CA TYR A 128 -13.434 7.981 -2.784 1.00 78.19 C ATOM 1151 C TYR A 128 -12.346 6.910 -2.644 1.00 75.96 C ATOM 1152 O TYR A 128 -11.197 7.224 -2.378 1.00 83.63 O ATOM 1153 CB TYR A 128 -14.275 8.063 -1.515 1.00 80.01 C ATOM 1154 CG TYR A 128 -13.460 8.112 -0.245 1.00 83.98 C ATOM 1155 CD1 TYR A 128 -13.274 6.969 0.528 1.00 91.47 C ATOM 1156 CD2 TYR A 128 -12.860 9.294 0.174 1.00 84.20 C ATOM 1157 CE1 TYR A 128 -12.528 7.009 1.696 1.00 90.41 C ATOM 1158 CE2 TYR A 128 -12.114 9.343 1.345 1.00 86.08 C ATOM 1159 CZ TYR A 128 -11.953 8.198 2.098 1.00 88.30 C ATOM 1160 OH TYR A 128 -11.210 8.231 3.258 1.00 92.58 O ATOM 1161 HH TYR A 128 -11.199 7.330 3.667 1.00 0.00 H ATOM 1162 H TYR A 128 -15.213 7.273 -3.796 1.00 0.00 H ATOM 1163 N GLU A 129 -12.705 5.645 -2.818 1.00 74.62 N ATOM 1164 CA GLU A 129 -11.707 4.572 -2.790 1.00 87.17 C ATOM 1165 C GLU A 129 -10.675 4.680 -3.921 1.00 87.47 C ATOM 1166 O GLU A 129 -9.557 4.172 -3.792 1.00 89.45 O ATOM 1167 CB GLU A 129 -12.396 3.195 -2.832 1.00 95.24 C ATOM 1168 CG GLU A 129 -13.349 3.017 -4.039 1.00114.00 C ATOM 1169 CD GLU A 129 -13.972 1.636 -4.108 1.00125.92 C ATOM 1170 OE1 GLU A 129 -13.199 0.685 -4.296 1.00124.09 O ATOM 1171 OE2 GLU A 129 -15.203 1.509 -3.949 1.00135.49 O ATOM 1172 H GLU A 129 -13.706 5.412 -2.976 1.00 0.00 H ATOM 1173 N TYR A 130 -11.047 5.335 -5.019 1.00 78.71 N ATOM 1174 CA TYR A 130 -10.141 5.511 -6.144 1.00 80.79 C ATOM 1175 C TYR A 130 -9.746 6.972 -6.280 1.00 81.60 C ATOM 1176 O TYR A 130 -9.429 7.431 -7.380 1.00 88.18 O ATOM 1177 CB TYR A 130 -10.780 5.003 -7.450 1.00 82.25 C ATOM 1178 CG TYR A 130 -10.799 3.496 -7.584 1.00 81.93 C ATOM 1179 CD1 TYR A 130 -9.715 2.821 -8.123 1.00 88.47 C ATOM 1180 CD2 TYR A 130 -11.907 2.746 -7.192 1.00 76.00 C ATOM 1181 CE1 TYR A 130 -9.721 1.440 -8.248 1.00 96.45 C ATOM 1182 CE2 TYR A 130 -11.918 1.359 -7.314 1.00 74.47 C ATOM 1183 CZ TYR A 130 -10.824 0.714 -7.842 1.00 87.10 C ATOM 1184 OH TYR A 130 -10.829 -0.657 -7.976 1.00 89.80 O ATOM 1185 HH TYR A 130 -9.970 -0.952 -8.370 1.00 0.00 H ATOM 1186 H TYR A 130 -12.007 5.730 -5.074 1.00 0.00 H ATOM 1187 N ARG A 131 -9.758 7.698 -5.164 1.00 84.34 N ATOM 1188 CA ARG A 131 -9.441 9.121 -5.199 1.00 91.21 C ATOM 1189 C ARG A 131 -8.034 9.343 -5.749 1.00 89.19 C ATOM 1190 O ARG A 131 -7.811 10.304 -6.477 1.00 85.50 O ATOM 1191 CB ARG A 131 -9.588 9.761 -3.810 1.00 86.51 C ATOM 1192 CG ARG A 131 -8.795 9.103 -2.694 1.00 88.75 C ATOM 1193 CD ARG A 131 -9.262 9.604 -1.327 1.00 92.48 C ATOM 1194 NE ARG A 131 -8.449 9.055 -0.246 1.00 90.14 N ATOM 1195 CZ ARG A 131 -8.660 7.872 0.319 1.00 82.12 C ATOM 1196 NH1 ARG A 131 -9.670 7.111 -0.082 1.00 73.62 N ATOM 1197 NH2 ARG A 131 -7.862 7.453 1.291 1.00 80.15 N ATOM 1198 HE ARG A 131 -7.654 9.627 0.104 1.00 0.00 H ATOM 1199 HH12 ARG A 131 -9.832 6.185 0.363 1.00 0.00 H ATOM 1200 HH11 ARG A 131 -10.300 7.440 -0.841 1.00 0.00 H ATOM 1201 HH22 ARG A 131 -8.025 6.527 1.735 1.00 0.00 H ATOM 1202 HH21 ARG A 131 -7.073 8.050 1.610 1.00 0.00 H ATOM 1203 H ARG A 131 -9.996 7.246 -4.258 1.00 0.00 H ATOM 1204 N GLU A 132 -7.108 8.444 -5.414 1.00 92.35 N ATOM 1205 CA GLU A 132 -5.725 8.534 -5.884 1.00100.41 C ATOM 1206 C GLU A 132 -5.648 8.396 -7.402 1.00105.40 C ATOM 1207 O GLU A 132 -5.047 9.227 -8.084 1.00107.78 O ATOM 1208 CB GLU A 132 -4.858 7.465 -5.218 1.00 98.74 C ATOM 1209 H GLU A 132 -7.378 7.651 -4.797 1.00 0.00 H ATOM 1210 N HIS A 133 -6.264 7.338 -7.921 1.00104.05 N ATOM 1211 CA HIS A 133 -6.314 7.101 -9.360 1.00104.68 C ATOM 1212 C HIS A 133 -7.002 8.244 -10.109 1.00 99.32 C ATOM 1213 O HIS A 133 -6.481 8.754 -11.102 1.00 98.98 O ATOM 1214 CB HIS A 133 -7.033 5.780 -9.649 1.00110.60 C ATOM 1215 CG HIS A 133 -7.252 5.511 -11.107 1.00116.52 C ATOM 1216 ND1 HIS A 133 -6.224 5.178 -11.967 1.00120.44 N ATOM 1217 CD2 HIS A 133 -8.380 5.518 -11.855 1.00112.50 C ATOM 1218 CE1 HIS A 133 -6.713 4.993 -13.179 1.00119.30 C ATOM 1219 NE2 HIS A 133 -8.018 5.195 -13.140 1.00114.29 N ATOM 1220 H HIS A 133 -6.724 6.659 -7.282 1.00 0.00 H ATOM 1221 N LEU A 134 -8.173 8.643 -9.622 1.00100.25 N ATOM 1222 CA LEU A 134 -8.978 9.666 -10.281 1.00 98.92 C ATOM 1223 C LEU A 134 -8.288 11.025 -10.265 1.00 96.51 C ATOM 1224 O LEU A 134 -8.427 11.805 -11.209 1.00 91.20 O ATOM 1225 CB LEU A 134 -10.357 9.769 -9.618 1.00 95.59 C ATOM 1226 CG LEU A 134 -11.311 8.586 -9.815 1.00 92.20 C ATOM 1227 CD1 LEU A 134 -12.614 8.803 -9.052 1.00 86.92 C ATOM 1228 CD2 LEU A 134 -11.590 8.346 -11.289 1.00 88.34 C ATOM 1229 H LEU A 134 -8.526 8.212 -8.744 1.00 0.00 H ATOM 1230 N GLU A 135 -7.546 11.300 -9.192 1.00 92.65 N ATOM 1231 CA GLU A 135 -6.848 12.574 -9.048 1.00101.94 C ATOM 1232 C GLU A 135 -5.769 12.731 -10.116 1.00110.59 C ATOM 1233 O GLU A 135 -5.469 13.844 -10.537 1.00114.10 O ATOM 1234 CB GLU A 135 -6.227 12.704 -7.647 1.00100.78 C ATOM 1235 H GLU A 135 -7.462 10.588 -8.438 1.00 0.00 H ATOM 1236 N GLN A 136 -5.204 11.613 -10.565 1.00115.28 N ATOM 1237 CA GLN A 136 -4.116 11.648 -11.540 1.00119.91 C ATOM 1238 C GLN A 136 -4.603 11.733 -12.988 1.00117.17 C ATOM 1239 O GLN A 136 -3.806 11.625 -13.921 1.00114.93 O ATOM 1240 CB GLN A 136 -3.211 10.427 -11.364 1.00127.01 C ATOM 1241 CG GLN A 136 -2.436 10.437 -10.054 1.00140.55 C ATOM 1242 CD GLN A 136 -1.501 9.251 -9.909 1.00154.47 C ATOM 1243 OE1 GLN A 136 -1.248 8.522 -10.870 1.00159.12 O ATOM 1244 NE2 GLN A 136 -0.980 9.052 -8.700 1.00159.20 N ATOM 1245 HE22 GLN A 136 -1.222 9.693 -7.918 1.00 0.00 H ATOM 1246 HE21 GLN A 136 -0.331 8.255 -8.538 1.00 0.00 H ATOM 1247 H GLN A 136 -5.544 10.695 -10.215 1.00 0.00 H ATOM 1248 N LEU A 137 -5.906 11.930 -13.171 1.00112.58 N ATOM 1249 CA LEU A 137 -6.459 12.202 -14.497 1.00113.62 C ATOM 1250 C LEU A 137 -6.764 13.695 -14.613 1.00122.48 C ATOM 1251 O LEU A 137 -7.385 14.280 -13.721 1.00115.18 O ATOM 1252 CB LEU A 137 -7.722 11.367 -14.760 1.00101.88 C ATOM 1253 CG LEU A 137 -7.578 9.840 -14.786 1.00 90.46 C ATOM 1254 CD1 LEU A 137 -8.946 9.137 -14.735 1.00 85.12 C ATOM 1255 CD2 LEU A 137 -6.777 9.380 -16.004 1.00 89.88 C ATOM 1256 H LEU A 137 -6.546 11.890 -12.352 1.00 0.00 H ATOM 1257 N PRO A 138 -6.319 14.315 -15.715 1.00137.49 N ATOM 1258 CA PRO A 138 -6.392 15.769 -15.915 1.00146.32 C ATOM 1259 C PRO A 138 -7.812 16.341 -15.971 1.00147.38 C ATOM 1260 O PRO A 138 -8.194 17.093 -15.077 1.00152.09 O ATOM 1261 CB PRO A 138 -5.678 15.977 -17.258 1.00151.47 C ATOM 1262 CG PRO A 138 -5.627 14.639 -17.900 1.00148.63 C ATOM 1263 CD PRO A 138 -5.601 13.636 -16.806 1.00142.87 C ATOM 1264 N THR A 139 -8.576 15.995 -17.001 1.00141.54 N ATOM 1265 CA THR A 139 -9.876 16.622 -17.238 1.00134.83 C ATOM 1266 C THR A 139 -11.003 15.910 -16.476 1.00122.52 C ATOM 1267 O THR A 139 -10.948 14.699 -16.269 1.00118.70 O ATOM 1268 CB THR A 139 -10.186 16.651 -18.761 1.00139.97 C ATOM 1269 OG1 THR A 139 -9.296 17.569 -19.409 1.00141.76 O ATOM 1270 CG2 THR A 139 -11.616 17.091 -19.041 1.00138.60 C ATOM 1271 HG1 THR A 139 -9.493 17.588 -20.379 1.00 0.00 H ATOM 1272 H THR A 139 -8.241 15.259 -17.656 1.00 0.00 H ATOM 1273 N GLU A 140 -12.007 16.674 -16.044 1.00111.70 N ATOM 1274 CA GLU A 140 -13.201 16.125 -15.402 1.00 98.03 C ATOM 1275 C GLU A 140 -13.855 15.031 -16.252 1.00 89.53 C ATOM 1276 O GLU A 140 -14.285 14.004 -15.725 1.00 85.66 O ATOM 1277 CB GLU A 140 -14.221 17.231 -15.121 1.00 96.82 C ATOM 1278 CG GLU A 140 -15.480 16.755 -14.376 1.00 95.85 C ATOM 1279 CD GLU A 140 -16.748 16.853 -15.217 1.00 99.90 C ATOM 1280 OE1 GLU A 140 -16.645 16.818 -16.462 1.00102.09 O ATOM 1281 OE2 GLU A 140 -17.848 16.966 -14.634 1.00 93.84 O ATOM 1282 H GLU A 140 -11.938 17.704 -16.169 1.00 0.00 H ATOM 1283 N GLU A 141 -13.923 15.259 -17.562 1.00 89.85 N ATOM 1284 CA GLU A 141 -14.443 14.266 -18.502 1.00 86.93 C ATOM 1285 C GLU A 141 -13.752 12.908 -18.330 1.00 86.64 C ATOM 1286 O GLU A 141 -14.406 11.865 -18.318 1.00 85.38 O ATOM 1287 CB GLU A 141 -14.286 14.758 -19.940 1.00 86.29 C ATOM 1288 H GLU A 141 -13.595 16.175 -17.930 1.00 0.00 H ATOM 1289 N GLU A 142 -12.433 12.927 -18.173 1.00 87.94 N ATOM 1290 CA GLU A 142 -11.677 11.697 -17.956 1.00 89.13 C ATOM 1291 C GLU A 142 -12.027 11.039 -16.626 1.00 83.53 C ATOM 1292 O GLU A 142 -12.167 9.821 -16.541 1.00 85.97 O ATOM 1293 CB GLU A 142 -10.183 11.979 -17.996 1.00 98.06 C ATOM 1294 CG GLU A 142 -9.633 12.199 -19.383 1.00107.38 C ATOM 1295 CD GLU A 142 -8.291 12.881 -19.344 1.00116.79 C ATOM 1296 OE1 GLU A 142 -7.264 12.176 -19.277 1.00117.58 O ATOM 1297 OE2 GLU A 142 -8.272 14.128 -19.362 1.00126.12 O ATOM 1298 H GLU A 142 -11.929 13.836 -18.205 1.00 0.00 H ATOM 1299 N ARG A 143 -12.140 11.850 -15.582 1.00 79.49 N ATOM 1300 CA ARG A 143 -12.466 11.323 -14.273 1.00 86.23 C ATOM 1301 C ARG A 143 -13.852 10.687 -14.331 1.00 81.44 C ATOM 1302 O ARG A 143 -14.051 9.575 -13.854 1.00 76.18 O ATOM 1303 CB ARG A 143 -12.399 12.424 -13.217 1.00 89.73 C ATOM 1304 CG ARG A 143 -11.009 13.039 -13.055 1.00 99.81 C ATOM 1305 CD ARG A 143 -11.094 14.493 -12.615 1.00109.73 C ATOM 1306 NE ARG A 143 -11.834 14.634 -11.364 1.00125.02 N ATOM 1307 CZ ARG A 143 -12.406 15.761 -10.952 1.00134.49 C ATOM 1308 NH1 ARG A 143 -12.329 16.857 -11.699 1.00138.22 N ATOM 1309 NH2 ARG A 143 -13.058 15.792 -9.794 1.00131.59 N ATOM 1310 HE ARG A 143 -11.919 13.796 -10.754 1.00 0.00 H ATOM 1311 HH12 ARG A 143 -12.777 17.739 -11.376 1.00 0.00 H ATOM 1312 HH11 ARG A 143 -11.821 16.833 -12.606 1.00 0.00 H ATOM 1313 HH22 ARG A 143 -13.505 16.674 -9.472 1.00 0.00 H ATOM 1314 HH21 ARG A 143 -13.121 14.934 -9.210 1.00 0.00 H ATOM 1315 H ARG A 143 -11.993 12.872 -15.705 1.00 0.00 H ATOM 1316 N VAL A 144 -14.797 11.395 -14.939 1.00 75.62 N ATOM 1317 CA VAL A 144 -16.156 10.893 -15.060 1.00 73.25 C ATOM 1318 C VAL A 144 -16.165 9.564 -15.795 1.00 73.54 C ATOM 1319 O VAL A 144 -16.709 8.570 -15.301 1.00 69.94 O ATOM 1320 CB VAL A 144 -17.068 11.887 -15.797 1.00 75.21 C ATOM 1321 CG1 VAL A 144 -18.370 11.208 -16.210 1.00 77.38 C ATOM 1322 CG2 VAL A 144 -17.349 13.098 -14.929 1.00 72.67 C ATOM 1323 H VAL A 144 -14.560 12.327 -15.336 1.00 0.00 H ATOM 1324 N ASP A 145 -15.541 9.542 -16.971 1.00 73.34 N ATOM 1325 CA ASP A 145 -15.592 8.358 -17.828 1.00 76.44 C ATOM 1326 C ASP A 145 -14.918 7.149 -17.176 1.00 73.40 C ATOM 1327 O ASP A 145 -15.397 6.020 -17.325 1.00 70.89 O ATOM 1328 CB ASP A 145 -14.957 8.650 -19.189 1.00 75.04 C ATOM 1329 CG ASP A 145 -15.848 9.495 -20.077 1.00 78.27 C ATOM 1330 OD1 ASP A 145 -17.023 9.693 -19.715 1.00 72.74 O ATOM 1331 OD2 ASP A 145 -15.379 9.952 -21.144 1.00 84.80 O ATOM 1332 H ASP A 145 -15.010 10.379 -17.285 1.00 0.00 H ATOM 1333 N ARG A 146 -13.816 7.376 -16.454 1.00 71.90 N ATOM 1334 CA ARG A 146 -13.173 6.280 -15.728 1.00 76.64 C ATOM 1335 C ARG A 146 -14.094 5.780 -14.611 1.00 73.45 C ATOM 1336 O ARG A 146 -14.256 4.570 -14.410 1.00 76.85 O ATOM 1337 CB ARG A 146 -11.819 6.705 -15.140 1.00 76.64 C ATOM 1338 CG ARG A 146 -11.043 5.548 -14.486 1.00 85.13 C ATOM 1339 CD ARG A 146 -10.945 4.305 -15.402 1.00 92.63 C ATOM 1340 NE ARG A 146 -10.141 3.231 -14.805 1.00107.44 N ATOM 1341 CZ ARG A 146 -10.265 1.930 -15.084 1.00112.09 C ATOM 1342 NH1 ARG A 146 -11.177 1.509 -15.952 1.00112.16 N ATOM 1343 NH2 ARG A 146 -9.479 1.041 -14.483 1.00108.84 N ATOM 1344 HE ARG A 146 -9.418 3.505 -14.110 1.00 0.00 H ATOM 1345 HH12 ARG A 146 -11.265 0.494 -16.162 1.00 0.00 H ATOM 1346 HH11 ARG A 146 -11.803 2.194 -16.422 1.00 0.00 H ATOM 1347 HH22 ARG A 146 -9.577 0.029 -14.701 1.00 0.00 H ATOM 1348 HH21 ARG A 146 -8.767 1.358 -13.795 1.00 0.00 H ATOM 1349 H ARG A 146 -13.414 8.334 -16.408 1.00 0.00 H ATOM 1350 N LEU A 147 -14.713 6.713 -13.898 1.00 68.95 N ATOM 1351 CA LEU A 147 -15.658 6.337 -12.838 1.00 65.75 C ATOM 1352 C LEU A 147 -16.841 5.547 -13.421 1.00 69.48 C ATOM 1353 O LEU A 147 -17.347 4.602 -12.794 1.00 63.84 O ATOM 1354 CB LEU A 147 -16.145 7.583 -12.079 1.00 65.01 C ATOM 1355 CG LEU A 147 -16.964 7.290 -10.806 1.00 65.39 C ATOM 1356 CD1 LEU A 147 -16.232 6.316 -9.884 1.00 64.19 C ATOM 1357 CD2 LEU A 147 -17.313 8.572 -10.063 1.00 69.01 C ATOM 1358 H LEU A 147 -14.528 7.718 -14.091 1.00 0.00 H ATOM 1359 N CYS A 148 -17.273 5.913 -14.626 1.00 66.81 N ATOM 1360 CA CYS A 148 -18.311 5.143 -15.315 1.00 67.78 C ATOM 1361 C CYS A 148 -17.884 3.686 -15.482 1.00 68.07 C ATOM 1362 O CYS A 148 -18.677 2.768 -15.282 1.00 65.10 O ATOM 1363 CB CYS A 148 -18.628 5.752 -16.679 1.00 67.32 C ATOM 1364 SG CYS A 148 -19.571 7.295 -16.596 1.00 68.30 S ATOM 1365 H CYS A 148 -16.869 6.755 -15.083 1.00 0.00 H ATOM 1366 N GLU A 149 -16.619 3.477 -15.828 1.00 68.93 N ATOM 1367 CA GLU A 149 -16.095 2.128 -16.030 1.00 69.58 C ATOM 1368 C GLU A 149 -15.956 1.380 -14.719 1.00 69.26 C ATOM 1369 O GLU A 149 -16.338 0.207 -14.616 1.00 68.36 O ATOM 1370 CB GLU A 149 -14.738 2.169 -16.730 1.00 70.26 C ATOM 1371 CG GLU A 149 -14.786 2.681 -18.135 1.00 75.96 C ATOM 1372 CD GLU A 149 -13.408 3.049 -18.638 1.00 81.62 C ATOM 1373 OE1 GLU A 149 -12.452 2.978 -17.840 1.00 83.91 O ATOM 1374 OE2 GLU A 149 -13.280 3.403 -19.823 1.00 79.41 O ATOM 1375 H GLU A 149 -15.987 4.292 -15.958 1.00 0.00 H ATOM 1376 N LEU A 150 -15.372 2.056 -13.734 1.00 64.84 N ATOM 1377 CA LEU A 150 -15.266 1.532 -12.371 1.00 65.83 C ATOM 1378 C LEU A 150 -16.629 1.148 -11.821 1.00 69.85 C ATOM 1379 O LEU A 150 -16.780 0.088 -11.203 1.00 66.37 O ATOM 1380 CB LEU A 150 -14.613 2.560 -11.447 1.00 71.74 C ATOM 1381 CG LEU A 150 -13.109 2.775 -11.638 1.00 81.12 C ATOM 1382 CD1 LEU A 150 -12.589 3.805 -10.653 1.00 81.69 C ATOM 1383 CD2 LEU A 150 -12.351 1.460 -11.500 1.00 85.68 C ATOM 1384 H LEU A 150 -14.975 2.995 -13.940 1.00 0.00 H ATOM 1385 N ASN A 151 -17.619 2.010 -12.039 1.00 64.39 N ATOM 1386 CA ASN A 151 -18.976 1.694 -11.609 1.00 61.16 C ATOM 1387 C ASN A 151 -19.461 0.375 -12.203 1.00 67.04 C ATOM 1388 O ASN A 151 -19.908 -0.494 -11.463 1.00 68.75 O ATOM 1389 CB ASN A 151 -19.953 2.803 -11.977 1.00 53.99 C ATOM 1390 CG ASN A 151 -21.321 2.605 -11.332 1.00 59.78 C ATOM 1391 OD1 ASN A 151 -21.427 2.114 -10.201 1.00 56.71 O ATOM 1392 ND2 ASN A 151 -22.369 2.964 -12.055 1.00 57.28 N ATOM 1393 HD22 ASN A 151 -22.232 3.373 -13.001 1.00 0.00 H ATOM 1394 HD21 ASN A 151 -23.330 2.837 -11.677 1.00 0.00 H ATOM 1395 H ASN A 151 -17.424 2.912 -12.518 1.00 0.00 H ATOM 1396 N VAL A 152 -19.368 0.226 -13.530 1.00 63.04 N ATOM 1397 CA VAL A 152 -19.790 -1.014 -14.186 1.00 62.19 C ATOM 1398 C VAL A 152 -19.097 -2.245 -13.581 1.00 61.65 C ATOM 1399 O VAL A 152 -19.729 -3.263 -13.305 1.00 60.34 O ATOM 1400 CB VAL A 152 -19.502 -0.973 -15.707 1.00 64.27 C ATOM 1401 CG1 VAL A 152 -19.741 -2.340 -16.346 1.00 61.36 C ATOM 1402 CG2 VAL A 152 -20.357 0.084 -16.372 1.00 64.75 C ATOM 1403 H VAL A 152 -18.989 1.005 -14.106 1.00 0.00 H ATOM 1404 N ILE A 153 -17.792 -2.146 -13.371 1.00 66.12 N ATOM 1405 CA ILE A 153 -17.044 -3.285 -12.864 1.00 69.05 C ATOM 1406 C ILE A 153 -17.560 -3.624 -11.452 1.00 68.78 C ATOM 1407 O ILE A 153 -17.715 -4.788 -11.086 1.00 65.41 O ATOM 1408 CB ILE A 153 -15.531 -2.994 -12.877 1.00 69.47 C ATOM 1409 CG1 ILE A 153 -15.060 -2.793 -14.325 1.00 71.07 C ATOM 1410 CG2 ILE A 153 -14.755 -4.124 -12.216 1.00 70.05 C ATOM 1411 CD1 ILE A 153 -13.593 -2.362 -14.468 1.00 72.82 C ATOM 1412 H ILE A 153 -17.302 -1.251 -13.570 1.00 0.00 H ATOM 1413 N GLN A 154 -17.876 -2.596 -10.682 1.00 61.57 N ATOM 1414 CA GLN A 154 -18.408 -2.803 -9.345 1.00 63.77 C ATOM 1415 C GLN A 154 -19.784 -3.452 -9.383 1.00 63.22 C ATOM 1416 O GLN A 154 -20.104 -4.319 -8.562 1.00 61.94 O ATOM 1417 CB GLN A 154 -18.514 -1.479 -8.594 1.00 68.16 C ATOM 1418 CG GLN A 154 -19.083 -1.634 -7.200 1.00 71.28 C ATOM 1419 CD GLN A 154 -18.189 -2.491 -6.335 1.00 81.10 C ATOM 1420 OE1 GLN A 154 -16.988 -2.233 -6.225 1.00 80.08 O ATOM 1421 NE2 GLN A 154 -18.760 -3.529 -5.731 1.00 84.32 N ATOM 1422 HE22 GLN A 154 -19.777 -3.707 -5.853 1.00 0.00 H ATOM 1423 HE21 GLN A 154 -18.189 -4.163 -5.136 1.00 0.00 H ATOM 1424 H GLN A 154 -17.742 -1.628 -11.037 1.00 0.00 H ATOM 1425 N GLN A 155 -20.617 -2.989 -10.307 1.00 55.05 N ATOM 1426 CA GLN A 155 -21.981 -3.499 -10.394 1.00 56.92 C ATOM 1427 C GLN A 155 -21.986 -4.944 -10.880 1.00 61.68 C ATOM 1428 O GLN A 155 -22.835 -5.732 -10.462 1.00 67.99 O ATOM 1429 CB GLN A 155 -22.833 -2.623 -11.319 1.00 57.05 C ATOM 1430 CG GLN A 155 -22.953 -1.152 -10.900 1.00 56.42 C ATOM 1431 CD GLN A 155 -23.349 -0.962 -9.430 1.00 64.95 C ATOM 1432 OE1 GLN A 155 -24.133 -1.737 -8.876 1.00 59.88 O ATOM 1433 NE2 GLN A 155 -22.802 0.078 -8.797 1.00 58.06 N ATOM 1434 HE22 GLN A 155 -22.145 0.707 -9.302 1.00 0.00 H ATOM 1435 HE21 GLN A 155 -23.032 0.259 -7.799 1.00 0.00 H ATOM 1436 H GLN A 155 -20.295 -2.258 -10.973 1.00 0.00 H ATOM 1437 N VAL A 156 -21.046 -5.301 -11.755 1.00 61.76 N ATOM 1438 CA VAL A 156 -20.897 -6.709 -12.150 1.00 62.19 C ATOM 1439 C VAL A 156 -20.624 -7.553 -10.887 1.00 61.00 C ATOM 1440 O VAL A 156 -21.271 -8.570 -10.660 1.00 60.94 O ATOM 1441 CB VAL A 156 -19.767 -6.922 -13.195 1.00 62.42 C ATOM 1442 CG1 VAL A 156 -19.496 -8.400 -13.388 1.00 63.34 C ATOM 1443 CG2 VAL A 156 -20.153 -6.319 -14.538 1.00 63.47 C ATOM 1444 H VAL A 156 -20.415 -4.580 -12.160 1.00 0.00 H ATOM 1445 N ALA A 157 -19.676 -7.112 -10.067 1.00 63.04 N ATOM 1446 CA ALA A 157 -19.419 -7.760 -8.783 1.00 66.49 C ATOM 1447 C ALA A 157 -20.698 -7.888 -7.957 1.00 67.29 C ATOM 1448 O ALA A 157 -21.008 -8.975 -7.467 1.00 64.03 O ATOM 1449 CB ALA A 157 -18.366 -6.998 -8.007 1.00 61.02 C ATOM 1450 H ALA A 157 -19.105 -6.288 -10.345 1.00 0.00 H ATOM 1451 N ASN A 158 -21.451 -6.791 -7.832 1.00 61.93 N ATOM 1452 CA ASN A 158 -22.662 -6.776 -6.991 1.00 63.29 C ATOM 1453 C ASN A 158 -23.712 -7.810 -7.443 1.00 59.51 C ATOM 1454 O ASN A 158 -24.294 -8.527 -6.626 1.00 56.73 O ATOM 1455 CB ASN A 158 -23.301 -5.364 -6.964 1.00 60.47 C ATOM 1456 CG ASN A 158 -22.405 -4.312 -6.303 1.00 64.04 C ATOM 1457 OD1 ASN A 158 -21.508 -4.640 -5.522 1.00 62.08 O ATOM 1458 ND2 ASN A 158 -22.652 -3.037 -6.614 1.00 59.11 N ATOM 1459 HD22 ASN A 158 -23.418 -2.803 -7.277 1.00 0.00 H ATOM 1460 HD21 ASN A 158 -22.078 -2.279 -6.193 1.00 0.00 H ATOM 1461 H ASN A 158 -21.176 -5.926 -8.341 1.00 0.00 H ATOM 1462 N VAL A 159 -23.950 -7.884 -8.743 1.00 54.71 N ATOM 1463 CA VAL A 159 -24.868 -8.873 -9.294 1.00 54.81 C ATOM 1464 C VAL A 159 -24.376 -10.293 -8.991 1.00 59.91 C ATOM 1465 O VAL A 159 -25.134 -11.143 -8.508 1.00 58.93 O ATOM 1466 CB VAL A 159 -25.033 -8.697 -10.827 1.00 55.33 C ATOM 1467 CG1 VAL A 159 -25.883 -9.814 -11.420 1.00 54.13 C ATOM 1468 CG2 VAL A 159 -25.651 -7.355 -11.139 1.00 57.18 C ATOM 1469 H VAL A 159 -23.471 -7.221 -9.386 1.00 0.00 H ATOM 1470 N SER A 160 -23.099 -10.541 -9.262 1.00 59.94 N ATOM 1471 CA SER A 160 -22.553 -11.888 -9.106 1.00 66.83 C ATOM 1472 C SER A 160 -22.510 -12.319 -7.638 1.00 64.18 C ATOM 1473 O SER A 160 -22.490 -13.518 -7.341 1.00 72.61 O ATOM 1474 CB SER A 160 -21.154 -11.978 -9.737 1.00 66.98 C ATOM 1475 OG SER A 160 -20.185 -11.305 -8.946 1.00 77.15 O ATOM 1476 HG SER A 160 -20.433 -10.350 -8.864 1.00 0.00 H ATOM 1477 H SER A 160 -22.482 -9.770 -9.588 1.00 0.00 H ATOM 1478 N HIS A 161 -22.522 -11.359 -6.716 1.00 61.97 N ATOM 1479 CA HIS A 161 -22.497 -11.699 -5.292 1.00 61.63 C ATOM 1480 C HIS A 161 -23.866 -12.004 -4.721 1.00 61.39 C ATOM 1481 O HIS A 161 -23.960 -12.529 -3.618 1.00 65.61 O ATOM 1482 CB HIS A 161 -21.855 -10.578 -4.469 1.00 56.97 C ATOM 1483 CG HIS A 161 -20.424 -10.329 -4.810 1.00 65.47 C ATOM 1484 ND1 HIS A 161 -19.740 -9.211 -4.390 1.00 61.50 N ATOM 1485 CD2 HIS A 161 -19.549 -11.046 -5.565 1.00 67.15 C ATOM 1486 CE1 HIS A 161 -18.499 -9.256 -4.846 1.00 66.27 C ATOM 1487 NE2 HIS A 161 -18.364 -10.356 -5.572 1.00 68.36 N ATOM 1488 H HIS A 161 -22.549 -10.361 -7.009 1.00 0.00 H ATOM 1489 N THR A 162 -24.924 -11.674 -5.451 1.00 57.78 N ATOM 1490 CA THR A 162 -26.276 -11.945 -4.961 1.00 59.10 C ATOM 1491 C THR A 162 -26.464 -13.443 -4.752 1.00 62.11 C ATOM 1492 O THR A 162 -25.909 -14.245 -5.495 1.00 60.35 O ATOM 1493 CB THR A 162 -27.366 -11.442 -5.935 1.00 55.29 C ATOM 1494 OG1 THR A 162 -27.255 -12.122 -7.201 1.00 58.05 O ATOM 1495 CG2 THR A 162 -27.249 -9.930 -6.151 1.00 53.16 C ATOM 1496 HG1 THR A 162 -26.363 -11.945 -7.592 1.00 0.00 H ATOM 1497 H THR A 162 -24.791 -11.220 -6.377 1.00 0.00 H ATOM 1498 N SER A 163 -27.245 -13.814 -3.743 1.00 55.81 N ATOM 1499 CA SER A 163 -27.662 -15.210 -3.583 1.00 61.32 C ATOM 1500 C SER A 163 -28.520 -15.675 -4.760 1.00 62.68 C ATOM 1501 O SER A 163 -28.566 -16.865 -5.070 1.00 59.35 O ATOM 1502 CB SER A 163 -28.420 -15.400 -2.261 1.00 61.10 C ATOM 1503 OG SER A 163 -29.582 -14.588 -2.202 1.00 60.13 O ATOM 1504 HG SER A 163 -30.043 -14.736 -1.339 1.00 0.00 H ATOM 1505 H SER A 163 -27.566 -13.102 -3.056 1.00 0.00 H ATOM 1506 N ILE A 164 -29.217 -14.746 -5.401 1.00 59.62 N ATOM 1507 CA ILE A 164 -29.961 -15.090 -6.613 1.00 59.95 C ATOM 1508 C ILE A 164 -29.019 -15.771 -7.600 1.00 64.04 C ATOM 1509 O ILE A 164 -29.259 -16.904 -8.019 1.00 60.83 O ATOM 1510 CB ILE A 164 -30.580 -13.857 -7.272 1.00 58.38 C ATOM 1511 CG1 ILE A 164 -31.487 -13.121 -6.281 1.00 62.11 C ATOM 1512 CG2 ILE A 164 -31.364 -14.257 -8.541 1.00 54.85 C ATOM 1513 CD1 ILE A 164 -31.827 -11.689 -6.732 1.00 62.75 C ATOM 1514 H ILE A 164 -29.235 -13.770 -5.041 1.00 0.00 H ATOM 1515 N VAL A 165 -27.923 -15.093 -7.929 1.00 60.61 N ATOM 1516 CA VAL A 165 -27.003 -15.608 -8.929 1.00 67.05 C ATOM 1517 C VAL A 165 -26.223 -16.829 -8.407 1.00 66.98 C ATOM 1518 O VAL A 165 -26.092 -17.828 -9.122 1.00 63.25 O ATOM 1519 CB VAL A 165 -26.043 -14.519 -9.407 1.00 63.97 C ATOM 1520 CG1 VAL A 165 -24.912 -15.120 -10.237 1.00 63.27 C ATOM 1521 CG2 VAL A 165 -26.812 -13.465 -10.207 1.00 58.69 C ATOM 1522 H VAL A 165 -27.722 -14.184 -7.465 1.00 0.00 H ATOM 1523 N GLN A 166 -25.749 -16.782 -7.162 1.00 61.65 N ATOM 1524 CA GLN A 166 -25.001 -17.930 -6.618 1.00 65.04 C ATOM 1525 C GLN A 166 -25.842 -19.207 -6.575 1.00 65.40 C ATOM 1526 O GLN A 166 -25.354 -20.293 -6.892 1.00 64.13 O ATOM 1527 CB GLN A 166 -24.451 -17.619 -5.224 1.00 64.64 C ATOM 1528 CG GLN A 166 -23.386 -16.529 -5.235 1.00 62.44 C ATOM 1529 CD GLN A 166 -22.578 -16.478 -3.961 1.00 68.05 C ATOM 1530 OE1 GLN A 166 -21.891 -17.439 -3.608 1.00 75.98 O ATOM 1531 NE2 GLN A 166 -22.681 -15.363 -3.240 1.00 69.36 N ATOM 1532 HE22 GLN A 166 -23.273 -14.578 -3.578 1.00 0.00 H ATOM 1533 HE21 GLN A 166 -22.169 -15.278 -2.339 1.00 0.00 H ATOM 1534 H GLN A 166 -25.906 -15.937 -6.576 1.00 0.00 H ATOM 1535 N ASN A 167 -27.111 -19.082 -6.210 1.00 65.88 N ATOM 1536 CA ASN A 167 -27.970 -20.259 -6.129 1.00 63.41 C ATOM 1537 C ASN A 167 -28.308 -20.832 -7.505 1.00 68.51 C ATOM 1538 O ASN A 167 -28.594 -22.019 -7.626 1.00 70.42 O ATOM 1539 CB ASN A 167 -29.248 -19.936 -5.365 1.00 62.29 C ATOM 1540 CG ASN A 167 -28.995 -19.771 -3.875 1.00 70.83 C ATOM 1541 OD1 ASN A 167 -28.046 -20.346 -3.344 1.00 70.56 O ATOM 1542 ND2 ASN A 167 -29.835 -18.984 -3.199 1.00 68.24 N ATOM 1543 HD22 ASN A 167 -30.623 -18.519 -3.693 1.00 0.00 H ATOM 1544 HD21 ASN A 167 -29.701 -18.836 -2.178 1.00 0.00 H ATOM 1545 H ASN A 167 -27.495 -18.143 -5.981 1.00 0.00 H ATOM 1546 N ALA A 168 -28.312 -19.975 -8.525 1.00 64.64 N ATOM 1547 CA ALA A 168 -28.438 -20.438 -9.907 1.00 66.53 C ATOM 1548 C ALA A 168 -27.261 -21.338 -10.255 1.00 69.39 C ATOM 1549 O ALA A 168 -27.427 -22.426 -10.819 1.00 78.55 O ATOM 1550 CB ALA A 168 -28.512 -19.260 -10.863 1.00 67.61 C ATOM 1551 H ALA A 168 -28.224 -18.956 -8.335 1.00 0.00 H ATOM 1552 N TRP A 169 -26.064 -20.877 -9.916 1.00 65.81 N ATOM 1553 CA TRP A 169 -24.851 -21.672 -10.099 1.00 71.45 C ATOM 1554 C TRP A 169 -24.877 -22.968 -9.279 1.00 82.92 C ATOM 1555 O TRP A 169 -24.505 -24.024 -9.788 1.00 84.75 O ATOM 1556 CB TRP A 169 -23.614 -20.843 -9.728 1.00 70.44 C ATOM 1557 CG TRP A 169 -23.336 -19.739 -10.693 1.00 74.07 C ATOM 1558 CD1 TRP A 169 -23.689 -19.701 -12.018 1.00 72.97 C ATOM 1559 CD2 TRP A 169 -22.656 -18.506 -10.425 1.00 70.64 C ATOM 1560 NE1 TRP A 169 -23.264 -18.525 -12.587 1.00 70.76 N ATOM 1561 CE2 TRP A 169 -22.623 -17.776 -11.634 1.00 73.69 C ATOM 1562 CE3 TRP A 169 -22.055 -17.957 -9.288 1.00 71.93 C ATOM 1563 CZ2 TRP A 169 -22.027 -16.519 -11.733 1.00 73.39 C ATOM 1564 CZ3 TRP A 169 -21.465 -16.706 -9.389 1.00 69.84 C ATOM 1565 CH2 TRP A 169 -21.460 -16.000 -10.601 1.00 77.73 C ATOM 1566 HE1 TRP A 169 -23.405 -18.248 -13.579 1.00 0.00 H ATOM 1567 H TRP A 169 -25.987 -19.923 -9.509 1.00 0.00 H ATOM 1568 N HIS A 170 -25.309 -22.892 -8.018 1.00 80.28 N ATOM 1569 CA HIS A 170 -25.367 -24.083 -7.163 1.00 79.88 C ATOM 1570 C HIS A 170 -26.186 -25.177 -7.829 1.00 80.94 C ATOM 1571 O HIS A 170 -25.788 -26.333 -7.821 1.00 85.55 O ATOM 1572 CB HIS A 170 -25.953 -23.761 -5.778 1.00 71.70 C ATOM 1573 CG HIS A 170 -24.990 -23.079 -4.856 1.00 74.97 C ATOM 1574 ND1 HIS A 170 -23.704 -23.536 -4.658 1.00 76.31 N ATOM 1575 CD2 HIS A 170 -25.113 -21.966 -4.096 1.00 73.36 C ATOM 1576 CE1 HIS A 170 -23.081 -22.738 -3.809 1.00 76.46 C ATOM 1577 NE2 HIS A 170 -23.909 -21.772 -3.459 1.00 74.71 N ATOM 1578 H HIS A 170 -25.610 -21.973 -7.635 1.00 0.00 H ATOM 1579 N ARG A 171 -27.320 -24.812 -8.421 1.00 74.14 N ATOM 1580 CA ARG A 171 -28.155 -25.812 -9.070 1.00 80.99 C ATOM 1581 C ARG A 171 -27.789 -26.049 -10.544 1.00 83.84 C ATOM 1582 O ARG A 171 -28.594 -26.577 -11.312 1.00 88.54 O ATOM 1583 CB ARG A 171 -29.631 -25.433 -8.945 1.00 78.08 C ATOM 1584 CG ARG A 171 -30.012 -24.126 -9.571 1.00 81.18 C ATOM 1585 CD ARG A 171 -31.385 -23.669 -9.078 1.00 81.10 C ATOM 1586 NE ARG A 171 -31.823 -22.499 -9.829 1.00 82.72 N ATOM 1587 CZ ARG A 171 -31.990 -21.285 -9.316 1.00 78.76 C ATOM 1588 NH1 ARG A 171 -31.790 -21.067 -8.022 1.00 72.13 N ATOM 1589 NH2 ARG A 171 -32.376 -20.288 -10.107 1.00 75.94 N ATOM 1590 HE ARG A 171 -32.020 -22.624 -10.843 1.00 0.00 H ATOM 1591 HH12 ARG A 171 -31.923 -20.113 -7.629 1.00 0.00 H ATOM 1592 HH11 ARG A 171 -31.500 -21.850 -7.401 1.00 0.00 H ATOM 1593 HH22 ARG A 171 -32.509 -19.334 -9.714 1.00 0.00 H ATOM 1594 HH21 ARG A 171 -32.545 -20.462 -11.118 1.00 0.00 H ATOM 1595 H ARG A 171 -27.610 -23.813 -8.420 1.00 0.00 H ATOM 1596 N GLY A 172 -26.571 -25.683 -10.926 1.00 82.51 N ATOM 1597 CA GLY A 172 -26.040 -26.054 -12.231 1.00 84.10 C ATOM 1598 C GLY A 172 -26.613 -25.291 -13.412 1.00 84.43 C ATOM 1599 O GLY A 172 -26.528 -25.727 -14.568 1.00 83.22 O ATOM 1600 H GLY A 172 -25.983 -25.119 -10.279 1.00 0.00 H ATOM 1601 N GLN A 173 -27.207 -24.143 -13.121 1.00 77.31 N ATOM 1602 CA GLN A 173 -27.761 -23.293 -14.156 1.00 75.08 C ATOM 1603 C GLN A 173 -26.619 -22.519 -14.764 1.00 74.00 C ATOM 1604 O GLN A 173 -25.753 -22.037 -14.046 1.00 75.46 O ATOM 1605 CB GLN A 173 -28.814 -22.359 -13.569 1.00 77.53 C ATOM 1606 CG GLN A 173 -29.875 -21.909 -14.532 1.00 77.59 C ATOM 1607 CD GLN A 173 -30.958 -21.095 -13.851 1.00 75.55 C ATOM 1608 OE1 GLN A 173 -31.592 -21.542 -12.889 1.00 73.17 O ATOM 1609 NE2 GLN A 173 -31.154 -19.878 -14.333 1.00 75.65 N ATOM 1610 HE22 GLN A 173 -30.596 -19.544 -15.145 1.00 0.00 H ATOM 1611 HE21 GLN A 173 -31.866 -19.255 -13.900 1.00 0.00 H ATOM 1612 H GLN A 173 -27.277 -23.845 -12.127 1.00 0.00 H ATOM 1613 N SER A 174 -26.595 -22.422 -16.088 1.00 71.11 N ATOM 1614 CA SER A 174 -25.569 -21.645 -16.780 1.00 69.77 C ATOM 1615 C SER A 174 -25.950 -20.157 -16.783 1.00 70.14 C ATOM 1616 O SER A 174 -27.035 -19.791 -17.220 1.00 78.67 O ATOM 1617 CB SER A 174 -25.383 -22.167 -18.207 1.00 77.40 C ATOM 1618 OG SER A 174 -24.643 -21.245 -18.996 1.00 88.17 O ATOM 1619 HG SER A 174 -25.127 -20.382 -19.034 1.00 0.00 H ATOM 1620 H SER A 174 -27.324 -22.911 -16.646 1.00 0.00 H ATOM 1621 N LEU A 175 -25.057 -19.306 -16.292 1.00 71.18 N ATOM 1622 CA LEU A 175 -25.372 -17.890 -16.087 1.00 63.83 C ATOM 1623 C LEU A 175 -24.081 -17.069 -16.089 1.00 73.03 C ATOM 1624 O LEU A 175 -23.214 -17.280 -15.240 1.00 74.14 O ATOM 1625 CB LEU A 175 -26.142 -17.698 -14.758 1.00 62.35 C ATOM 1626 CG LEU A 175 -26.556 -16.262 -14.376 1.00 62.80 C ATOM 1627 CD1 LEU A 175 -27.327 -15.617 -15.512 1.00 63.78 C ATOM 1628 CD2 LEU A 175 -27.374 -16.202 -13.084 1.00 59.55 C ATOM 1629 H LEU A 175 -24.108 -19.654 -16.046 1.00 0.00 H ATOM 1630 N SER A 176 -23.944 -16.141 -17.036 1.00 69.89 N ATOM 1631 CA SER A 176 -22.792 -15.236 -17.049 1.00 67.17 C ATOM 1632 C SER A 176 -23.217 -13.786 -16.819 1.00 69.30 C ATOM 1633 O SER A 176 -24.226 -13.346 -17.349 1.00 65.62 O ATOM 1634 CB SER A 176 -22.027 -15.335 -18.375 1.00 70.83 C ATOM 1635 OG SER A 176 -21.366 -16.585 -18.503 1.00 74.11 O ATOM 1636 HG SER A 176 -22.034 -17.315 -18.471 1.00 0.00 H ATOM 1637 H SER A 176 -24.667 -16.058 -17.779 1.00 0.00 H ATOM 1638 N VAL A 177 -22.430 -13.056 -16.032 1.00 62.01 N ATOM 1639 CA VAL A 177 -22.645 -11.626 -15.769 1.00 63.17 C ATOM 1640 C VAL A 177 -21.540 -10.845 -16.457 1.00 68.68 C ATOM 1641 O VAL A 177 -20.361 -11.034 -16.148 1.00 70.84 O ATOM 1642 CB VAL A 177 -22.632 -11.290 -14.253 1.00 65.83 C ATOM 1643 CG1 VAL A 177 -23.108 -9.826 -14.013 1.00 57.44 C ATOM 1644 CG2 VAL A 177 -23.474 -12.281 -13.474 1.00 61.53 C ATOM 1645 H VAL A 177 -21.619 -13.523 -15.579 1.00 0.00 H ATOM 1646 N HIS A 178 -21.912 -9.981 -17.398 1.00 62.12 N ATOM 1647 CA HIS A 178 -20.931 -9.267 -18.202 1.00 67.29 C ATOM 1648 C HIS A 178 -20.921 -7.793 -17.838 1.00 70.91 C ATOM 1649 O HIS A 178 -21.941 -7.247 -17.421 1.00 61.58 O ATOM 1650 CB HIS A 178 -21.234 -9.419 -19.694 1.00 63.03 C ATOM 1651 CG HIS A 178 -21.521 -10.826 -20.114 1.00 69.97 C ATOM 1652 ND1 HIS A 178 -20.522 -11.755 -20.359 1.00 70.41 N ATOM 1653 CD2 HIS A 178 -22.689 -11.475 -20.327 1.00 74.64 C ATOM 1654 CE1 HIS A 178 -21.066 -12.901 -20.706 1.00 71.81 C ATOM 1655 NE2 HIS A 178 -22.384 -12.764 -20.701 1.00 78.21 N ATOM 1656 H HIS A 178 -22.925 -9.812 -17.562 1.00 0.00 H ATOM 1657 N GLY A 179 -19.766 -7.154 -18.013 1.00 67.18 N ATOM 1658 CA GLY A 179 -19.652 -5.715 -17.866 1.00 61.53 C ATOM 1659 C GLY A 179 -19.322 -5.081 -19.202 1.00 68.80 C ATOM 1660 O GLY A 179 -18.330 -5.439 -19.834 1.00 70.50 O ATOM 1661 H GLY A 179 -18.919 -7.704 -18.263 1.00 0.00 H ATOM 1662 N CYS A 180 -20.175 -4.162 -19.643 1.00 63.95 N ATOM 1663 CA CYS A 180 -19.950 -3.438 -20.886 1.00 66.76 C ATOM 1664 C CYS A 180 -20.146 -1.968 -20.669 1.00 68.75 C ATOM 1665 O CYS A 180 -20.789 -1.559 -19.701 1.00 64.00 O ATOM 1666 CB CYS A 180 -20.888 -3.909 -21.992 1.00 65.68 C ATOM 1667 SG CYS A 180 -20.685 -5.641 -22.427 1.00 80.37 S ATOM 1668 H CYS A 180 -21.027 -3.954 -19.084 1.00 0.00 H ATOM 1669 N ILE A 181 -19.600 -1.167 -21.579 1.00 65.90 N ATOM 1670 CA ILE A 181 -19.803 0.265 -21.494 1.00 67.03 C ATOM 1671 C ILE A 181 -20.102 0.844 -22.877 1.00 72.20 C ATOM 1672 O ILE A 181 -19.426 0.553 -23.862 1.00 71.81 O ATOM 1673 CB ILE A 181 -18.598 0.971 -20.831 1.00 74.33 C ATOM 1674 CG1 ILE A 181 -18.937 2.440 -20.570 1.00 72.13 C ATOM 1675 CG2 ILE A 181 -17.325 0.801 -21.665 1.00 78.17 C ATOM 1676 CD1 ILE A 181 -18.403 2.949 -19.265 1.00 75.89 C ATOM 1677 H ILE A 181 -19.028 -1.567 -22.350 1.00 0.00 H ATOM 1678 N TYR A 182 -21.162 1.638 -22.931 1.00 71.35 N ATOM 1679 CA TYR A 182 -21.638 2.246 -24.161 1.00 67.21 C ATOM 1680 C TYR A 182 -21.094 3.663 -24.302 1.00 67.20 C ATOM 1681 O TYR A 182 -21.049 4.419 -23.324 1.00 66.60 O ATOM 1682 CB TYR A 182 -23.166 2.254 -24.161 1.00 62.55 C ATOM 1683 CG TYR A 182 -23.790 2.906 -25.362 1.00 61.36 C ATOM 1684 CD1 TYR A 182 -23.829 2.246 -26.585 1.00 66.66 C ATOM 1685 CD2 TYR A 182 -24.351 4.177 -25.277 1.00 62.02 C ATOM 1686 CE1 TYR A 182 -24.401 2.829 -27.695 1.00 68.49 C ATOM 1687 CE2 TYR A 182 -24.934 4.771 -26.389 1.00 68.61 C ATOM 1688 CZ TYR A 182 -24.950 4.087 -27.592 1.00 70.74 C ATOM 1689 OH TYR A 182 -25.521 4.653 -28.703 1.00 67.63 O ATOM 1690 HH TYR A 182 -26.477 4.839 -28.523 1.00 0.00 H ATOM 1691 H TYR A 182 -21.678 1.835 -22.050 1.00 0.00 H ATOM 1692 N GLY A 183 -20.648 4.024 -25.501 1.00 69.94 N ATOM 1693 CA GLY A 183 -20.212 5.388 -25.743 1.00 70.07 C ATOM 1694 C GLY A 183 -21.366 6.179 -26.329 1.00 69.03 C ATOM 1695 O GLY A 183 -21.819 5.871 -27.423 1.00 69.85 O ATOM 1696 H GLY A 183 -20.611 3.325 -26.271 1.00 0.00 H ATOM 1697 N ILE A 184 -21.878 7.175 -25.609 1.00 70.31 N ATOM 1698 CA ILE A 184 -22.938 7.990 -26.198 1.00 69.42 C ATOM 1699 C ILE A 184 -22.376 8.861 -27.336 1.00 77.09 C ATOM 1700 O ILE A 184 -23.132 9.361 -28.180 1.00 78.29 O ATOM 1701 CB ILE A 184 -23.651 8.875 -25.153 1.00 68.17 C ATOM 1702 CG1 ILE A 184 -22.650 9.714 -24.346 1.00 71.02 C ATOM 1703 CG2 ILE A 184 -24.528 8.011 -24.244 1.00 68.01 C ATOM 1704 CD1 ILE A 184 -23.315 10.680 -23.295 1.00 68.46 C ATOM 1705 H ILE A 184 -21.531 7.369 -24.648 1.00 0.00 H ATOM 1706 N LYS A 185 -21.053 9.017 -27.370 1.00 76.91 N ATOM 1707 CA LYS A 185 -20.391 9.803 -28.421 1.00 74.96 C ATOM 1708 C LYS A 185 -20.214 9.045 -29.725 1.00 81.94 C ATOM 1709 O LYS A 185 -20.014 9.662 -30.778 1.00 81.20 O ATOM 1710 CB LYS A 185 -19.011 10.290 -27.957 1.00 75.20 C ATOM 1711 CG LYS A 185 -19.039 11.377 -26.886 1.00 81.08 C ATOM 1712 CD LYS A 185 -17.707 12.108 -26.767 1.00 92.86 C ATOM 1713 CE LYS A 185 -16.683 11.313 -25.973 1.00102.03 C ATOM 1714 NZ LYS A 185 -15.505 12.157 -25.575 1.00106.38 N ATOM 1715 HZ1 LYS A 185 -15.041 12.527 -26.429 1.00 0.00 H ATOM 1716 HZ2 LYS A 185 -15.831 12.950 -24.986 1.00 0.00 H ATOM 1717 HZ3 LYS A 185 -14.831 11.577 -25.036 1.00 0.00 H ATOM 1718 H LYS A 185 -20.472 8.570 -26.632 1.00 0.00 H ATOM 1719 N ASP A 186 -20.255 7.717 -29.679 1.00 74.96 N ATOM 1720 CA ASP A 186 -19.945 6.959 -30.896 1.00 80.04 C ATOM 1721 C ASP A 186 -20.835 5.743 -31.172 1.00 79.97 C ATOM 1722 O ASP A 186 -20.658 5.065 -32.176 1.00 80.99 O ATOM 1723 CB ASP A 186 -18.481 6.505 -30.865 1.00 88.58 C ATOM 1724 CG ASP A 186 -18.169 5.597 -29.689 1.00 87.91 C ATOM 1725 OD1 ASP A 186 -16.975 5.291 -29.483 1.00 93.72 O ATOM 1726 OD2 ASP A 186 -19.107 5.175 -28.974 1.00 80.59 O ATOM 1727 H ASP A 186 -20.502 7.225 -28.797 1.00 0.00 H ATOM 1728 N GLY A 187 -21.776 5.451 -30.282 1.00 74.91 N ATOM 1729 CA GLY A 187 -22.730 4.385 -30.550 1.00 70.96 C ATOM 1730 C GLY A 187 -22.150 3.006 -30.293 1.00 75.00 C ATOM 1731 O GLY A 187 -22.787 1.990 -30.569 1.00 71.81 O ATOM 1732 H GLY A 187 -21.832 5.985 -29.391 1.00 0.00 H ATOM 1733 N LEU A 188 -20.936 2.957 -29.761 1.00 75.17 N ATOM 1734 CA LEU A 188 -20.259 1.676 -29.622 1.00 74.10 C ATOM 1735 C LEU A 188 -20.451 1.082 -28.212 1.00 73.29 C ATOM 1736 O LEU A 188 -20.224 1.722 -27.197 1.00 70.53 O ATOM 1737 CB LEU A 188 -18.775 1.817 -29.945 1.00 79.47 C ATOM 1738 CG LEU A 188 -18.437 2.233 -31.385 1.00 84.61 C ATOM 1739 CD1 LEU A 188 -16.927 2.263 -31.605 1.00 86.12 C ATOM 1740 CD2 LEU A 188 -19.102 1.314 -32.387 1.00 82.01 C ATOM 1741 H LEU A 188 -20.469 3.831 -29.444 1.00 0.00 H ATOM 1742 N TRP A 189 -20.885 -0.167 -28.204 1.00 71.90 N ATOM 1743 CA TRP A 189 -21.079 -0.965 -27.018 1.00 73.38 C ATOM 1744 C TRP A 189 -19.835 -1.832 -26.796 1.00 72.09 C ATOM 1745 O TRP A 189 -19.567 -2.762 -27.561 1.00 76.11 O ATOM 1746 CB TRP A 189 -22.335 -1.805 -27.213 1.00 68.88 C ATOM 1747 CG TRP A 189 -22.799 -2.584 -26.049 1.00 64.14 C ATOM 1748 CD1 TRP A 189 -23.241 -2.094 -24.851 1.00 65.44 C ATOM 1749 CD2 TRP A 189 -22.926 -4.001 -25.979 1.00 64.45 C ATOM 1750 NE1 TRP A 189 -23.612 -3.131 -24.027 1.00 65.56 N ATOM 1751 CE2 TRP A 189 -23.430 -4.313 -24.693 1.00 65.71 C ATOM 1752 CE3 TRP A 189 -22.654 -5.044 -26.869 1.00 70.03 C ATOM 1753 CZ2 TRP A 189 -23.674 -5.619 -24.287 1.00 69.00 C ATOM 1754 CZ3 TRP A 189 -22.890 -6.339 -26.466 1.00 71.40 C ATOM 1755 CH2 TRP A 189 -23.400 -6.618 -25.184 1.00 72.54 C ATOM 1756 HE1 TRP A 189 -23.972 -3.033 -23.056 1.00 0.00 H ATOM 1757 H TRP A 189 -21.103 -0.607 -29.121 1.00 0.00 H ATOM 1758 N LYS A 190 -19.058 -1.517 -25.769 1.00 69.50 N ATOM 1759 CA LYS A 190 -17.761 -2.169 -25.604 1.00 73.25 C ATOM 1760 C LYS A 190 -17.698 -3.089 -24.383 1.00 79.82 C ATOM 1761 O LYS A 190 -18.245 -2.775 -23.324 1.00 71.38 O ATOM 1762 CB LYS A 190 -16.660 -1.107 -25.526 1.00 81.05 C ATOM 1763 CG LYS A 190 -15.249 -1.674 -25.503 1.00104.80 C ATOM 1764 CD LYS A 190 -14.192 -0.578 -25.473 1.00115.29 C ATOM 1765 CE LYS A 190 -14.100 0.078 -24.108 1.00115.54 C ATOM 1766 NZ LYS A 190 -13.117 1.194 -24.129 1.00121.93 N ATOM 1767 HZ1 LYS A 190 -12.180 0.825 -24.390 1.00 0.00 H ATOM 1768 HZ2 LYS A 190 -13.417 1.905 -24.826 1.00 0.00 H ATOM 1769 HZ3 LYS A 190 -13.069 1.630 -23.186 1.00 0.00 H ATOM 1770 H LYS A 190 -19.372 -0.805 -25.080 1.00 0.00 H ATOM 1771 N ASN A 191 -17.018 -4.222 -24.548 1.00 78.91 N ATOM 1772 CA ASN A 191 -16.795 -5.180 -23.466 1.00 81.58 C ATOM 1773 C ASN A 191 -15.692 -4.716 -22.508 1.00 80.48 C ATOM 1774 O ASN A 191 -14.598 -4.376 -22.946 1.00 77.84 O ATOM 1775 CB ASN A 191 -16.437 -6.550 -24.058 1.00 82.96 C ATOM 1776 CG ASN A 191 -16.598 -7.685 -23.065 1.00 76.68 C ATOM 1777 OD1 ASN A 191 -16.729 -7.469 -21.867 1.00 77.97 O ATOM 1778 ND2 ASN A 191 -16.588 -8.910 -23.569 1.00 78.77 N ATOM 1779 HD22 ASN A 191 -16.474 -9.050 -24.593 1.00 0.00 H ATOM 1780 HD21 ASN A 191 -16.694 -9.732 -22.940 1.00 0.00 H ATOM 1781 H ASN A 191 -16.628 -4.435 -25.488 1.00 0.00 H ATOM 1782 N LEU A 192 -15.971 -4.702 -21.202 1.00 69.41 N ATOM 1783 CA LEU A 192 -14.928 -4.365 -20.231 1.00 73.97 C ATOM 1784 C LEU A 192 -14.210 -5.634 -19.782 1.00 79.28 C ATOM 1785 O LEU A 192 -13.329 -5.583 -18.919 1.00 85.47 O ATOM 1786 CB LEU A 192 -15.505 -3.626 -19.017 1.00 69.94 C ATOM 1787 CG LEU A 192 -15.943 -2.190 -19.307 1.00 68.75 C ATOM 1788 CD1 LEU A 192 -16.642 -1.571 -18.090 1.00 68.03 C ATOM 1789 CD2 LEU A 192 -14.747 -1.352 -19.732 1.00 81.31 C ATOM 1790 H LEU A 192 -16.931 -4.931 -20.874 1.00 0.00 H ATOM 1791 N ASN A 193 -14.612 -6.763 -20.368 1.00 75.34 N ATOM 1792 CA ASN A 193 -14.004 -8.070 -20.104 1.00 83.61 C ATOM 1793 C ASN A 193 -13.847 -8.402 -18.630 1.00 84.29 C ATOM 1794 O ASN A 193 -12.752 -8.731 -18.170 1.00 86.10 O ATOM 1795 CB ASN A 193 -12.646 -8.156 -20.799 1.00 94.34 C ATOM 1796 CG ASN A 193 -12.755 -7.927 -22.290 1.00 97.06 C ATOM 1797 OD1 ASN A 193 -13.583 -8.546 -22.963 1.00 96.70 O ATOM 1798 ND2 ASN A 193 -11.935 -7.023 -22.813 1.00104.53 N ATOM 1799 HD22 ASN A 193 -11.253 -6.526 -22.205 1.00 0.00 H ATOM 1800 HD21 ASN A 193 -11.975 -6.812 -23.831 1.00 0.00 H ATOM 1801 H ASN A 193 -15.398 -6.713 -21.048 1.00 0.00 H ATOM 1802 N VAL A 194 -14.954 -8.325 -17.896 1.00 79.21 N ATOM 1803 CA VAL A 194 -14.971 -8.666 -16.479 1.00 72.53 C ATOM 1804 C VAL A 194 -16.015 -9.740 -16.182 1.00 77.74 C ATOM 1805 O VAL A 194 -16.615 -9.762 -15.106 1.00 77.72 O ATOM 1806 CB VAL A 194 -15.271 -7.436 -15.614 1.00 76.25 C ATOM 1807 CG1 VAL A 194 -14.053 -6.526 -15.543 1.00 74.84 C ATOM 1808 CG2 VAL A 194 -16.484 -6.697 -16.168 1.00 67.32 C ATOM 1809 H VAL A 194 -15.836 -8.011 -18.348 1.00 0.00 H ATOM 1810 N THR A 195 -16.223 -10.628 -17.145 1.00 73.09 N ATOM 1811 CA THR A 195 -17.304 -11.594 -17.077 1.00 72.28 C ATOM 1812 C THR A 195 -17.108 -12.583 -15.940 1.00 75.26 C ATOM 1813 O THR A 195 -16.020 -13.105 -15.741 1.00 77.46 O ATOM 1814 CB THR A 195 -17.432 -12.325 -18.412 1.00 76.81 C ATOM 1815 OG1 THR A 195 -17.867 -11.383 -19.402 1.00 76.14 O ATOM 1816 CG2 THR A 195 -18.431 -13.484 -18.322 1.00 70.24 C ATOM 1817 HG1 THR A 195 -17.202 -10.653 -19.476 1.00 0.00 H ATOM 1818 H THR A 195 -15.593 -10.632 -17.973 1.00 0.00 H ATOM 1819 N VAL A 196 -18.162 -12.787 -15.157 1.00 74.64 N ATOM 1820 CA VAL A 196 -18.150 -13.771 -14.090 1.00 72.32 C ATOM 1821 C VAL A 196 -19.172 -14.834 -14.432 1.00 74.58 C ATOM 1822 O VAL A 196 -20.321 -14.515 -14.747 1.00 72.53 O ATOM 1823 CB VAL A 196 -18.484 -13.138 -12.728 1.00 76.61 C ATOM 1824 CG1 VAL A 196 -18.443 -14.189 -11.632 1.00 78.10 C ATOM 1825 CG2 VAL A 196 -17.519 -11.994 -12.426 1.00 68.85 C ATOM 1826 H VAL A 196 -19.022 -12.224 -15.314 1.00 0.00 H ATOM 1827 N SER A 197 -18.775 -16.099 -14.396 1.00 72.40 N ATOM 1828 CA SER A 197 -19.713 -17.138 -14.795 1.00 70.54 C ATOM 1829 C SER A 197 -19.770 -18.318 -13.829 1.00 72.76 C ATOM 1830 O SER A 197 -20.402 -19.339 -14.122 1.00 77.81 O ATOM 1831 CB SER A 197 -19.366 -17.638 -16.205 1.00 82.41 C ATOM 1832 OG SER A 197 -17.999 -17.995 -16.301 1.00 85.12 O ATOM 1833 HG SER A 197 -17.806 -18.313 -17.219 1.00 0.00 H ATOM 1834 H SER A 197 -17.812 -16.344 -14.089 1.00 0.00 H ATOM 1835 N GLY A 198 -19.129 -18.187 -12.677 1.00 75.19 N ATOM 1836 CA GLY A 198 -19.173 -19.253 -11.695 1.00 75.11 C ATOM 1837 C GLY A 198 -18.649 -18.873 -10.327 1.00 75.52 C ATOM 1838 O GLY A 198 -17.950 -17.866 -10.175 1.00 70.96 O ATOM 1839 H GLY A 198 -18.593 -17.318 -12.477 1.00 0.00 H ATOM 1840 N LEU A 199 -18.975 -19.702 -9.335 1.00 76.56 N ATOM 1841 CA LEU A 199 -18.636 -19.439 -7.930 1.00 82.90 C ATOM 1842 C LEU A 199 -17.136 -19.339 -7.657 1.00 81.40 C ATOM 1843 O LEU A 199 -16.707 -18.627 -6.748 1.00 80.20 O ATOM 1844 CB LEU A 199 -19.226 -20.533 -7.039 1.00 83.48 C ATOM 1845 CG LEU A 199 -20.749 -20.651 -7.020 1.00 78.92 C ATOM 1846 CD1 LEU A 199 -21.148 -22.097 -6.806 1.00 81.05 C ATOM 1847 CD2 LEU A 199 -21.347 -19.756 -5.943 1.00 72.51 C ATOM 1848 H LEU A 199 -19.493 -20.574 -9.566 1.00 0.00 H ATOM 1849 N ASP A 200 -16.345 -20.062 -8.441 1.00 79.78 N ATOM 1850 CA ASP A 200 -14.902 -20.096 -8.251 1.00 79.09 C ATOM 1851 C ASP A 200 -14.252 -18.740 -8.497 1.00 78.99 C ATOM 1852 O ASP A 200 -13.118 -18.514 -8.085 1.00 80.23 O ATOM 1853 CB ASP A 200 -14.283 -21.147 -9.171 1.00 77.86 C ATOM 1854 CG ASP A 200 -14.571 -20.873 -10.643 1.00 89.12 C ATOM 1855 OD1 ASP A 200 -13.694 -20.319 -11.341 1.00 85.95 O ATOM 1856 OD2 ASP A 200 -15.698 -21.177 -11.088 1.00 83.40 O ATOM 1857 H ASP A 200 -16.767 -20.619 -9.211 1.00 0.00 H ATOM 1858 N GLN A 201 -14.966 -17.838 -9.167 1.00 74.20 N ATOM 1859 CA GLN A 201 -14.426 -16.509 -9.447 1.00 74.07 C ATOM 1860 C GLN A 201 -14.732 -15.496 -8.351 1.00 76.86 C ATOM 1861 O GLN A 201 -14.281 -14.353 -8.426 1.00 80.90 O ATOM 1862 CB GLN A 201 -14.962 -15.972 -10.771 1.00 75.47 C ATOM 1863 CG GLN A 201 -14.528 -16.760 -11.981 1.00 77.40 C ATOM 1864 CD GLN A 201 -15.283 -16.330 -13.215 1.00 83.70 C ATOM 1865 OE1 GLN A 201 -16.478 -16.585 -13.338 1.00 80.12 O ATOM 1866 NE2 GLN A 201 -14.587 -15.686 -14.143 1.00 91.80 N ATOM 1867 HE22 GLN A 201 -13.576 -15.493 -13.994 1.00 0.00 H ATOM 1868 HE21 GLN A 201 -15.052 -15.375 -15.019 1.00 0.00 H ATOM 1869 H GLN A 201 -15.922 -18.083 -9.496 1.00 0.00 H ATOM 1870 N LEU A 202 -15.516 -15.891 -7.353 1.00 77.63 N ATOM 1871 CA LEU A 202 -15.842 -14.973 -6.255 1.00 77.76 C ATOM 1872 C LEU A 202 -14.828 -15.072 -5.116 1.00 80.95 C ATOM 1873 O LEU A 202 -14.381 -16.173 -4.771 1.00 81.52 O ATOM 1874 CB LEU A 202 -17.251 -15.244 -5.701 1.00 78.15 C ATOM 1875 CG LEU A 202 -18.463 -15.153 -6.635 1.00 82.37 C ATOM 1876 CD1 LEU A 202 -19.753 -15.063 -5.811 1.00 74.42 C ATOM 1877 CD2 LEU A 202 -18.341 -13.999 -7.622 1.00 88.81 C ATOM 1878 H LEU A 202 -15.901 -16.857 -7.350 1.00 0.00 H ATOM 1879 N PRO A 203 -14.463 -13.923 -4.525 1.00 78.51 N ATOM 1880 CA PRO A 203 -13.689 -13.948 -3.277 1.00 80.71 C ATOM 1881 C PRO A 203 -14.405 -14.812 -2.237 1.00 81.01 C ATOM 1882 O PRO A 203 -15.638 -14.852 -2.252 1.00 77.96 O ATOM 1883 CB PRO A 203 -13.653 -12.476 -2.848 1.00 82.62 C ATOM 1884 CG PRO A 203 -13.876 -11.698 -4.124 1.00 81.53 C ATOM 1885 CD PRO A 203 -14.789 -12.551 -4.958 1.00 78.24 C ATOM 1886 N PRO A 204 -13.652 -15.509 -1.366 1.00 89.55 N ATOM 1887 CA PRO A 204 -14.234 -16.385 -0.335 1.00 87.48 C ATOM 1888 C PRO A 204 -15.216 -15.667 0.583 1.00 84.12 C ATOM 1889 O PRO A 204 -16.158 -16.284 1.087 1.00 91.74 O ATOM 1890 CB PRO A 204 -13.008 -16.859 0.458 1.00 90.82 C ATOM 1891 CG PRO A 204 -11.883 -16.780 -0.522 1.00100.92 C ATOM 1892 CD PRO A 204 -12.179 -15.576 -1.377 1.00 97.08 C ATOM 1893 N GLN A 205 -14.992 -14.373 0.793 1.00 77.45 N ATOM 1894 CA GLN A 205 -15.798 -13.592 1.726 1.00 79.98 C ATOM 1895 C GLN A 205 -17.215 -13.329 1.220 1.00 79.93 C ATOM 1896 O GLN A 205 -18.091 -12.977 2.003 1.00 79.90 O ATOM 1897 CB GLN A 205 -15.108 -12.260 2.034 1.00 85.78 C ATOM 1898 CG GLN A 205 -13.768 -12.402 2.741 1.00 93.57 C ATOM 1899 CD GLN A 205 -12.616 -12.676 1.785 1.00101.14 C ATOM 1900 OE1 GLN A 205 -12.817 -12.872 0.583 1.00 95.49 O ATOM 1901 NE2 GLN A 205 -11.401 -12.700 2.320 1.00105.91 N ATOM 1902 HE22 GLN A 205 -11.278 -12.529 3.338 1.00 0.00 H ATOM 1903 HE21 GLN A 205 -10.573 -12.890 1.721 1.00 0.00 H ATOM 1904 H GLN A 205 -14.220 -13.904 0.277 1.00 0.00 H ATOM 1905 N TYR A 206 -17.436 -13.501 -0.085 1.00 72.41 N ATOM 1906 CA TYR A 206 -18.748 -13.255 -0.675 1.00 66.76 C ATOM 1907 C TYR A 206 -19.486 -14.535 -1.043 1.00 72.74 C ATOM 1908 O TYR A 206 -20.669 -14.496 -1.391 1.00 70.20 O ATOM 1909 CB TYR A 206 -18.604 -12.367 -1.917 1.00 68.40 C ATOM 1910 CG TYR A 206 -18.204 -10.951 -1.567 1.00 72.71 C ATOM 1911 CD1 TYR A 206 -19.130 -10.054 -1.040 1.00 65.37 C ATOM 1912 CD2 TYR A 206 -16.896 -10.525 -1.733 1.00 74.70 C ATOM 1913 CE1 TYR A 206 -18.760 -8.763 -0.712 1.00 69.64 C ATOM 1914 CE2 TYR A 206 -16.518 -9.244 -1.411 1.00 74.67 C ATOM 1915 CZ TYR A 206 -17.447 -8.365 -0.901 1.00 73.96 C ATOM 1916 OH TYR A 206 -17.055 -7.085 -0.576 1.00 71.71 O ATOM 1917 HH TYR A 206 -17.832 -6.582 -0.225 1.00 0.00 H ATOM 1918 H TYR A 206 -16.656 -13.817 -0.695 1.00 0.00 H ATOM 1919 N ARG A 207 -18.793 -15.669 -0.967 1.00 73.31 N ATOM 1920 CA ARG A 207 -19.393 -16.944 -1.342 1.00 72.61 C ATOM 1921 C ARG A 207 -20.385 -17.401 -0.296 1.00 75.76 C ATOM 1922 O ARG A 207 -20.113 -17.366 0.907 1.00 80.24 O ATOM 1923 CB ARG A 207 -18.315 -18.020 -1.555 1.00 81.84 C ATOM 1924 CG ARG A 207 -17.328 -17.657 -2.642 1.00 87.12 C ATOM 1925 CD ARG A 207 -16.363 -18.779 -2.916 1.00 99.25 C ATOM 1926 NE ARG A 207 -17.051 -19.997 -3.324 1.00107.08 N ATOM 1927 CZ ARG A 207 -16.497 -20.939 -4.079 1.00100.08 C ATOM 1928 NH1 ARG A 207 -15.248 -20.794 -4.498 1.00 95.22 N ATOM 1929 NH2 ARG A 207 -17.187 -22.025 -4.403 1.00101.52 N ATOM 1930 HE ARG A 207 -18.031 -20.137 -3.006 1.00 0.00 H ATOM 1931 HH12 ARG A 207 -14.809 -21.528 -5.089 1.00 0.00 H ATOM 1932 HH11 ARG A 207 -14.707 -19.946 -4.235 1.00 0.00 H ATOM 1933 HH22 ARG A 207 -16.751 -22.761 -4.994 1.00 0.00 H ATOM 1934 HH21 ARG A 207 -18.164 -22.140 -4.066 1.00 0.00 H ATOM 1935 H ARG A 207 -17.808 -15.645 -0.635 1.00 0.00 H ATOM 1936 N LEU A 208 -21.555 -17.801 -0.764 1.00 66.21 N ATOM 1937 CA LEU A 208 -22.580 -18.338 0.107 1.00 67.24 C ATOM 1938 C LEU A 208 -22.712 -19.820 -0.194 1.00 78.30 C ATOM 1939 O LEU A 208 -22.624 -20.246 -1.350 1.00 86.48 O ATOM 1940 CB LEU A 208 -23.913 -17.622 -0.099 1.00 70.18 C ATOM 1941 CG LEU A 208 -24.197 -16.271 0.566 1.00 78.07 C ATOM 1942 CD1 LEU A 208 -22.989 -15.648 1.269 1.00 80.10 C ATOM 1943 CD2 LEU A 208 -24.783 -15.329 -0.467 1.00 70.22 C ATOM 1944 H LEU A 208 -21.744 -17.728 -1.784 1.00 0.00 H ATOM 1945 N SER A 209 -22.894 -20.604 0.857 1.00 76.47 N ATOM 1946 CA SER A 209 -23.104 -22.032 0.722 1.00 82.62 C ATOM 1947 C SER A 209 -24.470 -22.302 0.132 1.00 79.09 C ATOM 1948 O SER A 209 -25.384 -21.491 0.288 1.00 75.37 O ATOM 1949 CB SER A 209 -22.976 -22.716 2.081 1.00 92.13 C ATOM 1950 OG SER A 209 -21.713 -22.437 2.643 1.00 98.51 O ATOM 1951 HG SER A 209 -21.639 -22.884 3.523 1.00 0.00 H ATOM 1952 H SER A 209 -22.886 -20.183 1.808 1.00 0.00 H ATOM 1953 N PRO A 210 -24.620 -23.447 -0.543 1.00 82.65 N ATOM 1954 CA PRO A 210 -25.954 -23.793 -1.036 1.00 87.56 C ATOM 1955 C PRO A 210 -26.940 -23.946 0.117 1.00 97.11 C ATOM 1956 O PRO A 210 -26.527 -24.192 1.254 1.00100.38 O ATOM 1957 CB PRO A 210 -25.732 -25.122 -1.776 1.00 90.19 C ATOM 1958 CG PRO A 210 -24.397 -25.616 -1.337 1.00 91.66 C ATOM 1959 CD PRO A 210 -23.593 -24.417 -0.957 1.00 88.49 C ATOM 1960 N LEU A 211 -28.224 -23.786 -0.177 1.00100.21 N ATOM 1961 CA LEU A 211 -29.271 -23.803 0.843 1.00108.50 C ATOM 1962 C LEU A 211 -29.280 -25.103 1.650 1.00115.56 C ATOM 1963 O LEU A 211 -29.726 -26.146 1.170 1.00117.06 O ATOM 1964 CB LEU A 211 -30.647 -23.583 0.197 1.00106.77 C ATOM 1965 CG LEU A 211 -31.094 -22.166 -0.192 1.00 99.59 C ATOM 1966 CD1 LEU A 211 -30.031 -21.419 -0.943 1.00 94.13 C ATOM 1967 CD2 LEU A 211 -32.371 -22.206 -1.018 1.00100.01 C ATOM 1968 H LEU A 211 -28.496 -23.643 -1.171 1.00 0.00 H TER 1969 LEU A 211 HETATM 1970 ZN ZN A 1 -26.368 7.435 -17.139 1.00 60.50 ZN HETATM 1971 O HOH 2 -51.778 2.913 -30.358 1.00 82.28 O HETATM 1972 O HOH 3 -22.545 -18.642 -18.729 1.00 84.73 O HETATM 1973 O HOH 4 -30.067 15.325 -0.444 1.00 69.43 O HETATM 1974 O HOH 5 -25.845 3.809 -3.852 1.00 69.39 O HETATM 1975 O HOH 6 -12.908 10.471 -21.350 1.00 82.61 O HETATM 1976 O HOH 7 -19.644 9.692 -33.342 1.00 82.97 O HETATM 1977 O HOH 8 -25.704 9.256 -27.884 1.00 76.38 O HETATM 1978 O HOH 9 -20.593 1.550 -1.405 1.00 66.37 O HETATM 1979 O HOH 10 -23.526 4.489 -16.479 1.00 58.64 O HETATM 1980 O HOH 11 -29.576 -19.425 -16.559 1.00 74.64 O HETATM 1981 O HOH 12 -35.669 0.000 -3.342 1.00 52.42 O HETATM 1982 O HOH 13 -24.874 -18.633 -19.506 1.00 72.61 O HETATM 1983 O HOH 14 -36.436 -7.255 -26.293 1.00 65.57 O HETATM 1984 O HOH 15 -27.003 7.086 -28.270 1.00 67.70 O HETATM 1985 O HOH 16 -30.287 -1.667 -7.149 1.00 49.26 O HETATM 1986 O HOH 17 -27.864 -1.473 -0.088 1.00 62.71 O HETATM 1987 O HOH 18 -16.374 -10.630 -7.346 1.00 84.29 O HETATM 1988 O HOH 19 -31.608 -18.108 -7.480 1.00 63.02 O HETATM 1989 O HOH 20 -35.860 -17.168 -21.207 1.00 77.47 O HETATM 1990 O HOH 21 -33.117 -13.678 -26.250 1.00 73.71 O HETATM 1991 O HOH 22 -32.130 0.000 0.000 1.00 56.63 O HETATM 1992 O HOH 23 -29.560 1.552 -20.789 1.00 55.57 O HETATM 1993 O HOH 24 -26.612 2.155 -19.662 1.00 58.96 O HETATM 1994 O HOH 25 -22.458 -12.417 -1.218 1.00 70.20 O HETATM 1995 O HOH 26 -25.058 15.098 -21.647 1.00 79.52 O HETATM 1996 O HOH 27 -20.119 -21.990 -10.368 1.00 77.47 O HETATM 1997 O HOH 28 -17.387 -8.560 -19.193 1.00 72.32 O HETATM 1998 O HOH 29 -51.219 -14.926 -28.550 1.00 79.21 O HETATM 1999 O HOH 30 -22.433 -20.206 -15.801 1.00 78.41 O HETATM 2000 O HOH 31 -22.778 13.692 -20.638 1.00 69.99 O HETATM 2001 O HOH 32 -37.052 -5.014 -24.166 1.00 63.31 O HETATM 2002 O HOH 33 -38.828 -5.060 -9.950 1.00 51.23 O HETATM 2003 O HOH 34 -19.447 8.595 -25.099 1.00 69.87 O HETATM 2004 O HOH 35 -30.990 -2.008 -33.713 1.00 77.95 O HETATM 2005 O HOH 36 -21.486 3.091 -15.086 1.00 59.31 O HETATM 2006 O HOH 37 -25.330 12.899 -18.789 1.00 72.34 O HETATM 2007 O HOH 38 -14.388 -11.295 -19.219 1.00 73.90 O HETATM 2008 O HOH 39 -49.367 -10.976 -34.236 1.00 78.77 O HETATM 2009 O HOH 40 -23.010 9.886 0.243 1.00 64.64 O HETATM 2010 O HOH 41 -28.071 -23.216 -3.315 1.00 76.46 O HETATM 2011 O HOH 42 -36.612 -2.796 -1.491 1.00 55.50 O HETATM 2012 O HOH 43 -17.105 -12.531 4.727 1.00 79.89 O HETATM 2013 O HOH 44 -22.866 -6.052 -20.661 1.00 94.16 O HETATM 2014 O HOH 45 -19.579 10.868 -23.192 1.00 78.34 O HETATM 2015 CG UNN A 46 -27.907 9.661 -16.642 1.00 0.05 C HETATM 2016 ND1 UNN A 46 -29.173 9.946 -16.974 1.00 -0.26 N HETATM 2017 CE1 UNN A 46 -29.858 9.972 -15.840 1.00 0.09 C HETATM 2018 NE2 UNN A 46 -29.077 9.709 -14.796 1.00 -0.34 N HETATM 2019 CD2 UNN A 46 -27.832 9.499 -15.248 1.00 -0.03 C HETATM 2020 H2 UNN A 46 -26.949 9.255 -14.659 1.00 0.03 H HETATM 2021 H3 UNN A 46 -30.924 10.182 -15.772 1.00 0.11 H HETATM 2022 H1 UNN A 46 -29.541 10.112 -17.922 1.00 0.24 H HETATM 2023 C4 UNN A 46 -26.772 9.513 -17.597 1.00 -0.01 C HETATM 2024 H4 UNN A 46 -25.853 9.279 -17.040 1.00 0.04 H HETATM 2025 H5 UNN A 46 -26.635 10.453 -18.152 1.00 0.04 H HETATM 2026 H6 UNN A 46 -26.991 8.698 -18.303 1.00 0.04 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 363 362 1970 CONECT 874 872 873 1970 CONECT 900 899 1970 CONECT 1970 363 874 900 CONECT 2015 2016 2019 2023 CONECT 2016 2015 2017 2022 CONECT 2017 2016 2018 2021 CONECT 2018 2017 2019 CONECT 2019 2015 2018 2020 CONECT 2020 2019 CONECT 2021 2017 CONECT 2022 2016 CONECT 2023 2015 2024 2025 2026 CONECT 2024 2023 CONECT 2025 2023 CONECT 2026 2023 MASTER 0 0 0 0 0 0 0 0 2025 1 20 17 END
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Related entries of code: 6d2o
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
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Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6d2o
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Beta Carbonic anhydrase
Ligand Name
4MZ
EC.Number
E.C.4.2.1.1
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
Ki=5uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) ChemMedChem Vol. 13: pp. 2024-2029
Ligand Properties
Formula
C
4
H
6
N
2
Molecular Weight
82.104
Exact Mass
82.053
No. of atoms
12
No. of bonds
12
Polar Surface Area
28.68
LOGP Value
0.46 (
Computed with XLOGP3
)
0.72 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 0
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 1
Canonical SMILES
Cc1cnc[nH]1
InChI String
InChI=1S/C4H6N2/c1-4-2-5-3-6-4/h2-3H,1H3,(H,5,6)
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):
Q9HVB9
Entrez Gene ID
NCBI Entrez Gene ID:
881416
ASD
Information of known allosteric effects of PDB entries
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