Browse entries in the PDBbind-CN Database
HEADER 5F02_COMPLEX COMPND 5F02_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 175 ALA PRO ARG SER VAL ASP TRP ARG GLU LYS GLY TYR VAL SEQRES 2 A 175 THR PRO VAL LYS ASN GLN GLY GLN CYS GLY SER CYS TRP SEQRES 3 A 175 ALA PHE SER ALA THR GLY ALA LEU GLU GLY GLN MET PHE SEQRES 4 A 175 ARG LYS THR GLY ARG LEU ILE SER LEU SER GLU GLN ASN SEQRES 5 A 175 LEU VAL ASP CYS SER GLY PRO GLN GLY ASN GLU GLY CYS SEQRES 6 A 175 ASN GLY GLY LEU MET ASP TYR ALA PHE GLN TYR VAL GLN SEQRES 7 A 175 ASP ASN GLY GLY LEU ASP SER GLU GLU SER TYR PRO TYR SEQRES 8 A 175 GLU ALA THR GLU GLU SER CYS LYS TYR ASN PRO LYS TYR SEQRES 9 A 175 SER VAL ALA ASN ASP THR GLY PHE VAL ASP ILE PRO LYS SEQRES 10 A 175 GLN GLU LYS ALA LEU MET LYS ALA VAL ALA THR VAL GLY SEQRES 11 A 175 PRO ILE SER VAL ALA ILE ASP ALA GLY HIS GLU SER PHE SEQRES 12 A 175 LEU PHE TYR LYS GLU GLY ILE TYR PHE GLU PRO ASP CYS SEQRES 13 A 175 SER SER GLU ASP MET ASP HIS GLY VAL LEU VAL VAL GLY SEQRES 14 A 175 TYR GLY PHE GLU SER THR SEQRES 1 A 44 SER ASP ASN ASN LYS TYR TRP LEU VAL LYS ASN SER TRP SEQRES 2 A 44 GLY GLU GLU TRP GLY MET GLY GLY TYR VAL LYS MET ALA SEQRES 3 A 44 LYS ASP ARG ARG ASN HIS CYS GLY ILE ALA SER ALA ALA SEQRES 4 A 44 SER TYR PRO THR VAL HET UNN A 442 66 SSBOND 1 CYS A 22 CYS A 65 SSBOND 2 CYS A 56 CYS A 98 SSBOND 3 CYS A 156 CYS A 209 ATOM 1 N ALA A 1 10.714 6.228 21.720 1.00 38.16 N ATOM 2 CA ALA A 1 10.709 7.226 22.831 1.00 38.57 C ATOM 3 C ALA A 1 9.869 6.681 23.994 1.00 36.14 C ATOM 4 O ALA A 1 8.899 5.966 23.761 1.00 34.13 O ATOM 5 CB ALA A 1 10.158 8.583 22.340 1.00 38.24 C ATOM 6 HN3 ALA A 1 9.738 6.063 21.400 1.00 0.00 H ATOM 7 HN2 ALA A 1 11.125 5.335 22.060 1.00 0.00 H ATOM 8 HN1 ALA A 1 11.282 6.594 20.930 1.00 0.00 H ATOM 9 N PRO A 2 10.245 7.001 25.249 1.00 36.71 N ATOM 10 CA PRO A 2 9.438 6.596 26.405 1.00 35.62 C ATOM 11 C PRO A 2 8.025 7.163 26.330 1.00 31.46 C ATOM 12 O PRO A 2 7.781 8.123 25.591 1.00 29.34 O ATOM 13 CB PRO A 2 10.179 7.211 27.599 1.00 35.53 C ATOM 14 CG PRO A 2 11.533 7.551 27.110 1.00 36.55 C ATOM 15 CD PRO A 2 11.435 7.776 25.647 1.00 41.04 C ATOM 16 N ARG A 3 7.101 6.558 27.067 1.00 30.20 N ATOM 17 CA ARG A 3 5.707 7.021 27.082 1.00 29.56 C ATOM 18 C ARG A 3 5.570 8.369 27.805 1.00 25.41 C ATOM 19 O ARG A 3 4.656 9.151 27.524 1.00 27.99 O ATOM 20 CB ARG A 3 4.772 5.968 27.714 1.00 32.90 C ATOM 21 CG ARG A 3 3.378 5.981 27.084 1.00 35.59 C ATOM 22 CD ARG A 3 2.378 5.028 27.743 1.00 34.98 C ATOM 23 NE ARG A 3 1.031 5.334 27.279 1.00 37.99 N ATOM 24 CZ ARG A 3 -0.081 4.774 27.742 1.00 38.51 C ATOM 25 NH1 ARG A 3 -0.025 3.862 28.700 1.00 33.05 N ATOM 26 NH2 ARG A 3 -1.253 5.131 27.241 1.00 40.32 N ATOM 27 HE ARG A 3 0.933 6.046 26.527 1.00 0.00 H ATOM 28 HH12 ARG A 3 -0.900 3.428 29.057 1.00 0.00 H ATOM 29 HH11 ARG A 3 0.894 3.579 29.096 1.00 0.00 H ATOM 30 HH22 ARG A 3 -2.126 4.695 27.600 1.00 0.00 H ATOM 31 HH21 ARG A 3 -1.300 5.847 26.488 1.00 0.00 H ATOM 32 H ARG A 3 7.370 5.738 27.647 1.00 0.00 H ATOM 33 N SER A 4 6.475 8.630 28.739 1.00 25.81 N ATOM 34 CA SER A 4 6.496 9.895 29.447 1.00 26.40 C ATOM 35 C SER A 4 7.936 10.272 29.759 1.00 27.40 C ATOM 36 O SER A 4 8.785 9.409 30.000 1.00 30.06 O ATOM 37 CB SER A 4 5.670 9.820 30.735 1.00 26.86 C ATOM 38 OG SER A 4 6.409 9.237 31.789 1.00 26.52 O ATOM 39 HG SER A 4 6.678 8.319 31.534 1.00 0.00 H ATOM 40 H SER A 4 7.188 7.909 28.969 1.00 0.00 H ATOM 41 N VAL A 5 8.196 11.572 29.722 1.00 25.73 N ATOM 42 CA VAL A 5 9.505 12.143 30.027 1.00 24.63 C ATOM 43 C VAL A 5 9.256 13.369 30.900 1.00 22.38 C ATOM 44 O VAL A 5 8.324 14.126 30.642 1.00 22.41 O ATOM 45 CB VAL A 5 10.227 12.588 28.719 1.00 23.56 C ATOM 46 CG1 VAL A 5 11.432 13.490 29.027 1.00 23.60 C ATOM 47 CG2 VAL A 5 10.627 11.370 27.839 1.00 24.95 C ATOM 48 H VAL A 5 7.426 12.220 29.462 1.00 0.00 H ATOM 49 N ASP A 6 10.063 13.552 31.944 1.00 22.61 N ATOM 50 CA ASP A 6 10.043 14.780 32.737 1.00 22.11 C ATOM 51 C ASP A 6 11.469 15.121 33.204 1.00 20.78 C ATOM 52 O ASP A 6 11.985 14.560 34.195 1.00 24.31 O ATOM 53 CB ASP A 6 9.077 14.649 33.922 1.00 25.62 C ATOM 54 CG ASP A 6 8.945 15.947 34.716 1.00 27.63 C ATOM 55 OD1 ASP A 6 9.730 16.886 34.441 1.00 26.28 O ATOM 56 OD2 ASP A 6 8.048 16.031 35.600 1.00 30.30 O ATOM 57 H ASP A 6 10.729 12.797 32.203 1.00 0.00 H ATOM 58 N TRP A 7 12.113 16.029 32.476 1.00 21.61 N ATOM 59 CA TRP A 7 13.503 16.379 32.761 1.00 22.24 C ATOM 60 C TRP A 7 13.696 17.063 34.124 1.00 21.47 C ATOM 61 O TRP A 7 14.811 17.104 34.620 1.00 23.13 O ATOM 62 CB TRP A 7 14.120 17.214 31.612 1.00 20.55 C ATOM 63 CG TRP A 7 14.317 16.426 30.368 1.00 19.97 C ATOM 64 CD1 TRP A 7 13.599 16.528 29.229 1.00 19.99 C ATOM 65 CD2 TRP A 7 15.271 15.379 30.149 1.00 18.45 C ATOM 66 NE1 TRP A 7 14.035 15.624 28.305 1.00 21.41 N ATOM 67 CE2 TRP A 7 15.061 14.895 28.841 1.00 21.87 C ATOM 68 CE3 TRP A 7 16.272 14.794 30.930 1.00 22.59 C ATOM 69 CZ2 TRP A 7 15.829 13.857 28.284 1.00 23.74 C ATOM 70 CZ3 TRP A 7 17.030 13.763 30.378 1.00 23.94 C ATOM 71 CH2 TRP A 7 16.800 13.307 29.069 1.00 25.47 C ATOM 72 HE1 TRP A 7 13.649 15.508 27.346 1.00 0.00 H ATOM 73 H TRP A 7 11.619 16.498 31.690 1.00 0.00 H ATOM 74 N ARG A 8 12.631 17.605 34.719 1.00 22.50 N ATOM 75 CA ARG A 8 12.749 18.168 36.077 1.00 22.37 C ATOM 76 C ARG A 8 13.218 17.099 37.071 1.00 25.08 C ATOM 77 O ARG A 8 14.030 17.372 37.969 1.00 26.14 O ATOM 78 CB ARG A 8 11.430 18.760 36.573 1.00 25.24 C ATOM 79 CG ARG A 8 10.899 19.900 35.743 1.00 25.55 C ATOM 80 CD ARG A 8 9.537 20.329 36.217 1.00 28.23 C ATOM 81 NE ARG A 8 8.562 19.245 36.173 1.00 30.95 N ATOM 82 CZ ARG A 8 7.289 19.374 36.535 1.00 34.06 C ATOM 83 NH1 ARG A 8 6.814 20.541 36.966 1.00 34.02 N ATOM 84 NH2 ARG A 8 6.484 18.331 36.450 1.00 34.52 N ATOM 85 HE ARG A 8 8.882 18.314 35.838 1.00 0.00 H ATOM 86 HH12 ARG A 8 5.816 20.625 37.245 1.00 0.00 H ATOM 87 HH11 ARG A 8 7.441 21.369 37.023 1.00 0.00 H ATOM 88 HH22 ARG A 8 5.486 18.420 36.730 1.00 0.00 H ATOM 89 HH21 ARG A 8 6.847 17.421 36.103 1.00 0.00 H ATOM 90 H ARG A 8 11.717 17.630 34.224 1.00 0.00 H ATOM 91 N GLU A 9 12.690 15.888 36.903 1.00 26.25 N ATOM 92 CA GLU A 9 13.064 14.762 37.742 1.00 29.42 C ATOM 93 C GLU A 9 14.557 14.438 37.710 1.00 31.01 C ATOM 94 O GLU A 9 15.102 13.928 38.709 1.00 28.21 O ATOM 95 CB GLU A 9 12.269 13.494 37.359 1.00 28.03 C ATOM 96 CG GLU A 9 10.860 13.513 37.886 1.00 33.24 C ATOM 97 CD GLU A 9 9.956 12.446 37.308 1.00 39.30 C ATOM 98 OE1 GLU A 9 10.425 11.564 36.550 1.00 36.35 O ATOM 99 OE2 GLU A 9 8.751 12.503 37.621 1.00 49.41 O ATOM 100 H GLU A 9 11.989 15.744 36.149 1.00 0.00 H ATOM 101 N LYS A 10 15.210 14.726 36.583 1.00 27.06 N ATOM 102 CA LYS A 10 16.631 14.392 36.392 1.00 27.04 C ATOM 103 C LYS A 10 17.587 15.553 36.707 1.00 27.60 C ATOM 104 O LYS A 10 18.793 15.430 36.497 1.00 30.31 O ATOM 105 CB LYS A 10 16.881 13.886 34.970 1.00 29.89 C ATOM 106 CG LYS A 10 15.918 12.796 34.467 1.00 34.99 C ATOM 107 CD LYS A 10 16.094 11.472 35.180 1.00 41.27 C ATOM 108 CE LYS A 10 15.351 10.328 34.468 1.00 41.60 C ATOM 109 NZ LYS A 10 14.958 9.222 35.409 1.00 50.79 N ATOM 110 HZ1 LYS A 10 15.812 8.824 35.850 1.00 0.00 H ATOM 111 HZ2 LYS A 10 14.330 9.602 36.146 1.00 0.00 H ATOM 112 HZ3 LYS A 10 14.461 8.478 34.879 1.00 0.00 H ATOM 113 H LYS A 10 14.698 15.203 35.813 1.00 0.00 H ATOM 114 N GLY A 11 17.048 16.672 37.199 1.00 27.18 N ATOM 115 CA GLY A 11 17.867 17.814 37.636 1.00 26.71 C ATOM 116 C GLY A 11 18.261 18.814 36.554 1.00 22.17 C ATOM 117 O GLY A 11 19.167 19.637 36.753 1.00 22.39 O ATOM 118 H GLY A 11 16.013 16.738 37.276 1.00 0.00 H ATOM 119 N TYR A 12 17.563 18.772 35.423 1.00 20.16 N ATOM 120 CA TYR A 12 17.913 19.604 34.262 1.00 21.84 C ATOM 121 C TYR A 12 17.305 21.014 34.290 1.00 19.32 C ATOM 122 O TYR A 12 17.652 21.840 33.458 1.00 19.91 O ATOM 123 CB TYR A 12 17.417 18.928 32.982 1.00 19.85 C ATOM 124 CG TYR A 12 18.308 17.869 32.380 1.00 20.20 C ATOM 125 CD1 TYR A 12 18.659 16.725 33.078 1.00 25.01 C ATOM 126 CD2 TYR A 12 18.749 17.987 31.063 1.00 20.07 C ATOM 127 CE1 TYR A 12 19.469 15.741 32.484 1.00 22.84 C ATOM 128 CE2 TYR A 12 19.553 17.024 30.483 1.00 21.15 C ATOM 129 CZ TYR A 12 19.902 15.895 31.192 1.00 21.71 C ATOM 130 OH TYR A 12 20.692 14.928 30.603 1.00 25.18 O ATOM 131 HH TYR A 12 20.845 14.192 31.247 1.00 0.00 H ATOM 132 H TYR A 12 16.746 18.132 35.358 1.00 0.00 H ATOM 133 N VAL A 13 16.391 21.277 35.219 1.00 19.46 N ATOM 134 CA VAL A 13 15.500 22.441 35.123 1.00 19.62 C ATOM 135 C VAL A 13 15.558 23.312 36.377 1.00 18.95 C ATOM 136 O VAL A 13 15.395 22.825 37.517 1.00 23.02 O ATOM 137 CB VAL A 13 14.036 21.995 34.855 1.00 17.95 C ATOM 138 CG1 VAL A 13 13.122 23.210 34.608 1.00 19.51 C ATOM 139 CG2 VAL A 13 13.984 21.007 33.691 1.00 19.71 C ATOM 140 H VAL A 13 16.304 20.641 36.037 1.00 0.00 H ATOM 141 N THR A 14 15.815 24.602 36.183 1.00 18.49 N ATOM 142 CA THR A 14 15.833 25.539 37.306 1.00 19.45 C ATOM 143 C THR A 14 14.409 25.904 37.751 1.00 20.77 C ATOM 144 O THR A 14 13.443 25.639 37.034 1.00 19.86 O ATOM 145 CB THR A 14 16.595 26.844 36.941 1.00 20.04 C ATOM 146 OG1 THR A 14 15.945 27.471 35.828 1.00 21.38 O ATOM 147 CG2 THR A 14 18.072 26.557 36.613 1.00 20.70 C ATOM 148 HG1 THR A 14 15.950 26.854 35.054 1.00 0.00 H ATOM 149 H THR A 14 16.006 24.949 35.221 1.00 0.00 H ATOM 150 N PRO A 15 14.266 26.526 38.934 1.00 20.45 N ATOM 151 CA PRO A 15 12.924 26.985 39.323 1.00 20.12 C ATOM 152 C PRO A 15 12.335 27.971 38.329 1.00 20.50 C ATOM 153 O PRO A 15 13.067 28.601 37.555 1.00 21.45 O ATOM 154 CB PRO A 15 13.143 27.624 40.721 1.00 21.99 C ATOM 155 CG PRO A 15 14.368 26.942 41.242 1.00 23.82 C ATOM 156 CD PRO A 15 15.242 26.670 40.032 1.00 22.81 C ATOM 157 N VAL A 16 11.010 28.046 38.326 1.00 20.56 N ATOM 158 CA VAL A 16 10.256 28.986 37.505 1.00 20.04 C ATOM 159 C VAL A 16 10.638 30.429 37.849 1.00 20.21 C ATOM 160 O VAL A 16 10.709 30.817 39.034 1.00 23.25 O ATOM 161 CB VAL A 16 8.737 28.749 37.684 1.00 18.89 C ATOM 162 CG1 VAL A 16 7.896 29.850 37.013 1.00 21.29 C ATOM 163 CG2 VAL A 16 8.352 27.369 37.137 1.00 20.87 C ATOM 164 H VAL A 16 10.480 27.398 38.944 1.00 0.00 H ATOM 165 N LYS A 17 10.874 31.208 36.795 1.00 21.92 N ATOM 166 CA LYS A 17 11.264 32.603 36.894 1.00 19.94 C ATOM 167 C LYS A 17 10.099 33.450 36.405 1.00 21.15 C ATOM 168 O LYS A 17 9.060 32.923 35.929 1.00 19.77 O ATOM 169 CB LYS A 17 12.524 32.879 36.043 1.00 20.60 C ATOM 170 CG LYS A 17 13.724 31.954 36.365 1.00 20.39 C ATOM 171 CD LYS A 17 14.913 32.183 35.452 1.00 20.94 C ATOM 172 CE LYS A 17 16.097 31.198 35.668 1.00 19.63 C ATOM 173 NZ LYS A 17 17.260 31.492 34.739 1.00 22.12 N ATOM 174 HZ1 LYS A 17 16.943 31.408 33.752 1.00 0.00 H ATOM 175 HZ2 LYS A 17 17.605 32.458 34.912 1.00 0.00 H ATOM 176 HZ3 LYS A 17 18.026 30.811 34.918 1.00 0.00 H ATOM 177 H LYS A 17 10.773 30.793 35.847 1.00 0.00 H ATOM 178 N ASN A 18 10.287 34.764 36.490 1.00 20.96 N ATOM 179 CA ASN A 18 9.235 35.711 36.150 1.00 19.15 C ATOM 180 C ASN A 18 9.817 36.867 35.347 1.00 19.17 C ATOM 181 O ASN A 18 10.554 37.704 35.882 1.00 21.11 O ATOM 182 CB ASN A 18 8.524 36.197 37.421 1.00 21.31 C ATOM 183 CG ASN A 18 7.252 36.945 37.127 1.00 21.86 C ATOM 184 OD1 ASN A 18 7.072 37.476 36.046 1.00 24.82 O ATOM 185 ND2 ASN A 18 6.354 37.004 38.110 1.00 25.91 N ATOM 186 HD22 ASN A 18 6.546 36.537 39.019 1.00 0.00 H ATOM 187 HD21 ASN A 18 5.461 37.517 37.968 1.00 0.00 H ATOM 188 H ASN A 18 11.209 35.124 36.808 1.00 0.00 H ATOM 189 N GLN A 19 9.504 36.889 34.052 1.00 19.25 N ATOM 190 CA GLN A 19 9.958 37.959 33.169 1.00 18.54 C ATOM 191 C GLN A 19 9.424 39.360 33.517 1.00 20.03 C ATOM 192 O GLN A 19 9.941 40.363 33.020 1.00 17.88 O ATOM 193 CB GLN A 19 9.575 37.639 31.722 1.00 17.05 C ATOM 194 CG GLN A 19 8.095 37.633 31.390 1.00 18.23 C ATOM 195 CD GLN A 19 7.824 37.160 29.966 1.00 19.57 C ATOM 196 OE1 GLN A 19 7.757 35.963 29.705 1.00 19.42 O ATOM 197 NE2 GLN A 19 7.682 38.094 29.044 1.00 22.75 N ATOM 198 HE22 GLN A 19 7.746 39.098 29.307 1.00 0.00 H ATOM 199 HE21 GLN A 19 7.506 37.826 28.055 1.00 0.00 H ATOM 200 H GLN A 19 8.920 36.123 33.660 1.00 0.00 H ATOM 201 N GLY A 20 8.358 39.435 34.308 1.00 20.03 N ATOM 202 CA GLY A 20 7.730 40.736 34.585 1.00 19.14 C ATOM 203 C GLY A 20 7.126 41.367 33.333 1.00 20.45 C ATOM 204 O GLY A 20 6.721 40.667 32.404 1.00 24.80 O ATOM 205 H GLY A 20 7.966 38.570 34.733 1.00 0.00 H ATOM 206 N GLN A 21 7.114 42.698 33.276 1.00 23.71 N ATOM 207 CA GLN A 21 6.448 43.418 32.184 1.00 24.37 C ATOM 208 C GLN A 21 7.341 43.631 30.944 1.00 25.40 C ATOM 209 O GLN A 21 6.961 44.335 29.999 1.00 34.44 O ATOM 210 CB GLN A 21 5.881 44.741 32.710 1.00 23.45 C ATOM 211 CG GLN A 21 4.674 44.531 33.620 1.00 23.74 C ATOM 212 CD GLN A 21 4.196 45.819 34.259 1.00 24.00 C ATOM 213 OE1 GLN A 21 4.996 46.668 34.654 1.00 27.85 O ATOM 214 NE2 GLN A 21 2.887 45.978 34.347 1.00 21.54 N ATOM 215 HE22 GLN A 21 2.248 45.234 34.000 1.00 0.00 H ATOM 216 HE21 GLN A 21 2.496 46.847 34.763 1.00 0.00 H ATOM 217 H GLN A 21 7.589 43.241 34.025 1.00 0.00 H ATOM 218 N CYS A 22 8.505 42.992 30.926 1.00 22.10 N ATOM 219 CA CYS A 22 9.444 43.080 29.815 1.00 18.48 C ATOM 220 C CYS A 22 9.153 41.942 28.844 1.00 18.07 C ATOM 221 O CYS A 22 8.869 40.823 29.267 1.00 22.06 O ATOM 222 CB CYS A 22 10.863 42.953 30.390 1.00 20.85 C ATOM 223 SG CYS A 22 12.234 42.774 29.259 1.00 22.02 S ATOM 224 H CYS A 22 8.758 42.401 31.743 1.00 0.00 H ATOM 225 N GLY A 23 9.239 42.227 27.553 1.00 19.58 N ATOM 226 CA GLY A 23 8.978 41.227 26.504 1.00 17.87 C ATOM 227 C GLY A 23 10.197 40.373 26.212 1.00 18.45 C ATOM 228 O GLY A 23 10.717 40.363 25.096 1.00 17.35 O ATOM 229 H GLY A 23 9.501 43.193 27.270 1.00 0.00 H ATOM 230 N SER A 24 10.614 39.648 27.243 1.00 16.97 N ATOM 231 CA SER A 24 11.847 38.875 27.270 1.00 14.88 C ATOM 232 C SER A 24 11.613 37.354 27.317 1.00 14.49 C ATOM 233 O SER A 24 12.537 36.596 27.624 1.00 15.63 O ATOM 234 CB SER A 24 12.707 39.307 28.471 1.00 15.67 C ATOM 235 OG SER A 24 11.966 39.224 29.660 1.00 17.87 O ATOM 236 HG SER A 24 12.533 39.505 30.421 1.00 0.00 H ATOM 237 H SER A 24 10.016 39.631 28.094 1.00 0.00 H ATOM 238 N CYS A 25 10.400 36.907 26.991 1.00 15.58 N ATOM 239 CA CYS A 25 10.093 35.467 27.018 1.00 15.16 C ATOM 240 C CYS A 25 11.139 34.621 26.299 1.00 14.34 C ATOM 241 O CYS A 25 11.546 33.563 26.778 1.00 15.57 O ATOM 242 CB CYS A 25 8.713 35.200 26.404 1.00 15.24 C ATOM 243 SG CYS A 25 8.437 35.814 24.741 1.00 18.01 S ATOM 244 H CYS A 25 9.661 37.584 26.714 1.00 0.00 H ATOM 245 N TRP A 26 11.545 35.124 25.135 1.00 15.20 N ATOM 246 CA TRP A 26 12.561 34.479 24.307 1.00 15.38 C ATOM 247 C TRP A 26 13.866 34.230 25.073 1.00 14.39 C ATOM 248 O TRP A 26 14.529 33.219 24.851 1.00 12.99 O ATOM 249 CB TRP A 26 12.820 35.324 23.045 1.00 15.78 C ATOM 250 CG TRP A 26 13.244 36.758 23.381 1.00 14.63 C ATOM 251 CD1 TRP A 26 12.431 37.840 23.596 1.00 15.02 C ATOM 252 CD2 TRP A 26 14.582 37.222 23.572 1.00 13.92 C ATOM 253 NE1 TRP A 26 13.187 38.949 23.887 1.00 16.10 N ATOM 254 CE2 TRP A 26 14.513 38.597 23.879 1.00 14.43 C ATOM 255 CE3 TRP A 26 15.838 36.606 23.502 1.00 15.48 C ATOM 256 CZ2 TRP A 26 15.663 39.366 24.143 1.00 15.30 C ATOM 257 CZ3 TRP A 26 16.958 37.357 23.761 1.00 15.56 C ATOM 258 CH2 TRP A 26 16.875 38.716 24.086 1.00 16.60 C ATOM 259 HE1 TRP A 26 12.815 39.900 24.082 1.00 0.00 H ATOM 260 H TRP A 26 11.121 36.013 24.801 1.00 0.00 H ATOM 261 N ALA A 27 14.245 35.165 25.937 1.00 14.18 N ATOM 262 CA ALA A 27 15.457 35.033 26.751 1.00 12.22 C ATOM 263 C ALA A 27 15.339 33.940 27.812 1.00 13.61 C ATOM 264 O ALA A 27 16.288 33.184 28.035 1.00 14.87 O ATOM 265 CB ALA A 27 15.837 36.386 27.428 1.00 13.28 C ATOM 266 H ALA A 27 13.662 36.020 26.040 1.00 0.00 H ATOM 267 N PHE A 28 14.162 33.831 28.412 1.00 14.03 N ATOM 268 CA PHE A 28 13.886 32.795 29.400 1.00 15.21 C ATOM 269 C PHE A 28 13.822 31.427 28.749 1.00 14.27 C ATOM 270 O PHE A 28 14.355 30.464 29.284 1.00 14.74 O ATOM 271 CB PHE A 28 12.597 33.127 30.177 1.00 15.59 C ATOM 272 CG PHE A 28 12.797 34.250 31.154 1.00 17.68 C ATOM 273 CD1 PHE A 28 12.662 35.580 30.760 1.00 13.79 C ATOM 274 CD2 PHE A 28 13.208 33.969 32.459 1.00 17.73 C ATOM 275 CE1 PHE A 28 12.918 36.622 31.690 1.00 15.74 C ATOM 276 CE2 PHE A 28 13.459 34.997 33.357 1.00 19.22 C ATOM 277 CZ PHE A 28 13.326 36.319 32.950 1.00 16.51 C ATOM 278 H PHE A 28 13.410 34.507 28.170 1.00 0.00 H ATOM 279 N SER A 29 13.227 31.358 27.560 1.00 13.84 N ATOM 280 CA SER A 29 13.198 30.113 26.805 1.00 15.21 C ATOM 281 C SER A 29 14.623 29.648 26.473 1.00 13.02 C ATOM 282 O SER A 29 14.976 28.486 26.691 1.00 14.63 O ATOM 283 CB SER A 29 12.384 30.258 25.538 1.00 15.23 C ATOM 284 OG SER A 29 12.421 29.062 24.745 1.00 14.97 O ATOM 285 HG SER A 29 12.051 28.308 25.270 1.00 0.00 H ATOM 286 H SER A 29 12.776 32.207 27.164 1.00 0.00 H ATOM 287 N ALA A 30 15.457 30.587 26.042 1.00 12.46 N ATOM 288 CA ALA A 30 16.828 30.298 25.659 1.00 13.46 C ATOM 289 C ALA A 30 17.707 29.897 26.835 1.00 13.20 C ATOM 290 O ALA A 30 18.432 28.889 26.745 1.00 13.98 O ATOM 291 CB ALA A 30 17.439 31.462 24.902 1.00 13.44 C ATOM 292 H ALA A 30 15.115 31.567 25.976 1.00 0.00 H ATOM 293 N THR A 31 17.614 30.620 27.960 1.00 14.90 N ATOM 294 CA THR A 31 18.370 30.210 29.145 1.00 14.72 C ATOM 295 C THR A 31 17.910 28.856 29.654 1.00 14.40 C ATOM 296 O THR A 31 18.731 28.063 30.083 1.00 15.75 O ATOM 297 CB THR A 31 18.301 31.227 30.278 1.00 14.58 C ATOM 298 OG1 THR A 31 16.935 31.476 30.638 1.00 17.21 O ATOM 299 CG2 THR A 31 19.019 32.549 29.893 1.00 16.50 C ATOM 300 HG1 THR A 31 16.904 32.137 31.374 1.00 0.00 H ATOM 301 H THR A 31 17.009 31.466 27.991 1.00 0.00 H ATOM 302 N GLY A 32 16.605 28.595 29.587 1.00 14.88 N ATOM 303 CA GLY A 32 16.073 27.285 29.954 1.00 14.15 C ATOM 304 C GLY A 32 16.718 26.138 29.202 1.00 15.67 C ATOM 305 O GLY A 32 17.174 25.144 29.781 1.00 15.54 O ATOM 306 H GLY A 32 15.952 29.339 29.267 1.00 0.00 H ATOM 307 N ALA A 33 16.773 26.292 27.893 1.00 15.90 N ATOM 308 CA ALA A 33 17.348 25.246 27.047 1.00 13.35 C ATOM 309 C ALA A 33 18.857 25.107 27.298 1.00 14.23 C ATOM 310 O ALA A 33 19.383 23.985 27.365 1.00 15.61 O ATOM 311 CB ALA A 33 17.059 25.513 25.574 1.00 15.62 C ATOM 312 H ALA A 33 16.405 27.163 27.459 1.00 0.00 H ATOM 313 N LEU A 34 19.553 26.235 27.435 1.00 14.58 N ATOM 314 CA LEU A 34 20.999 26.186 27.675 1.00 15.73 C ATOM 315 C LEU A 34 21.328 25.628 29.073 1.00 16.23 C ATOM 316 O LEU A 34 22.304 24.903 29.221 1.00 17.24 O ATOM 317 CB LEU A 34 21.625 27.562 27.474 1.00 14.07 C ATOM 318 CG LEU A 34 23.153 27.664 27.411 1.00 15.88 C ATOM 319 CD1 LEU A 34 23.770 26.674 26.416 1.00 15.65 C ATOM 320 CD2 LEU A 34 23.531 29.087 27.020 1.00 18.02 C ATOM 321 H LEU A 34 19.069 27.153 27.372 1.00 0.00 H ATOM 322 N GLU A 35 20.530 25.977 30.096 1.00 16.17 N ATOM 323 CA GLU A 35 20.673 25.411 31.458 1.00 18.40 C ATOM 324 C GLU A 35 20.647 23.874 31.401 1.00 17.81 C ATOM 325 O GLU A 35 21.466 23.180 32.035 1.00 19.57 O ATOM 326 CB GLU A 35 19.535 25.933 32.355 1.00 16.70 C ATOM 327 CG GLU A 35 19.808 27.343 32.872 1.00 18.67 C ATOM 328 CD GLU A 35 18.588 28.111 33.406 1.00 17.39 C ATOM 329 OE1 GLU A 35 17.443 27.586 33.407 1.00 20.00 O ATOM 330 OE2 GLU A 35 18.797 29.279 33.818 1.00 21.05 O ATOM 331 H GLU A 35 19.779 26.675 29.924 1.00 0.00 H ATOM 332 N GLY A 36 19.698 23.353 30.629 1.00 16.62 N ATOM 333 CA GLY A 36 19.579 21.906 30.432 1.00 16.41 C ATOM 334 C GLY A 36 20.773 21.276 29.733 1.00 16.30 C ATOM 335 O GLY A 36 21.263 20.221 30.144 1.00 18.47 O ATOM 336 H GLY A 36 19.025 23.987 30.154 1.00 0.00 H ATOM 337 N GLN A 37 21.248 21.911 28.654 1.00 15.58 N ATOM 338 CA GLN A 37 22.361 21.340 27.897 1.00 17.52 C ATOM 339 C GLN A 37 23.668 21.430 28.689 1.00 17.78 C ATOM 340 O GLN A 37 24.513 20.516 28.632 1.00 18.15 O ATOM 341 CB GLN A 37 22.475 21.963 26.497 1.00 16.61 C ATOM 342 CG GLN A 37 21.296 21.569 25.606 1.00 16.66 C ATOM 343 CD GLN A 37 21.084 20.065 25.587 1.00 16.63 C ATOM 344 OE1 GLN A 37 21.922 19.337 25.070 1.00 19.32 O ATOM 345 NE2 GLN A 37 19.989 19.588 26.190 1.00 17.41 N ATOM 346 HE22 GLN A 37 19.303 20.243 26.616 1.00 0.00 H ATOM 347 HE21 GLN A 37 19.824 18.562 26.232 1.00 0.00 H ATOM 348 H GLN A 37 20.824 22.812 28.354 1.00 0.00 H ATOM 349 N MET A 38 23.852 22.528 29.414 1.00 17.10 N ATOM 350 CA MET A 38 25.017 22.655 30.273 1.00 18.42 C ATOM 351 C MET A 38 24.975 21.606 31.368 1.00 18.67 C ATOM 352 O MET A 38 26.013 21.032 31.705 1.00 21.36 O ATOM 353 CB MET A 38 25.104 24.057 30.871 1.00 19.03 C ATOM 354 CG MET A 38 25.476 25.142 29.853 1.00 18.69 C ATOM 355 SD MET A 38 27.043 24.925 28.953 1.00 20.23 S ATOM 356 CE MET A 38 28.258 24.769 30.281 1.00 20.99 C ATOM 357 H MET A 38 23.158 23.301 29.366 1.00 0.00 H ATOM 358 N PHE A 39 23.791 21.343 31.915 1.00 19.24 N ATOM 359 CA PHE A 39 23.667 20.313 32.949 1.00 20.83 C ATOM 360 C PHE A 39 24.057 18.952 32.377 1.00 19.26 C ATOM 361 O PHE A 39 24.781 18.210 33.017 1.00 21.75 O ATOM 362 CB PHE A 39 22.264 20.256 33.570 1.00 19.17 C ATOM 363 CG PHE A 39 22.119 19.163 34.594 1.00 22.56 C ATOM 364 CD1 PHE A 39 22.565 19.346 35.899 1.00 25.31 C ATOM 365 CD2 PHE A 39 21.560 17.935 34.248 1.00 21.70 C ATOM 366 CE1 PHE A 39 22.461 18.317 36.848 1.00 26.09 C ATOM 367 CE2 PHE A 39 21.454 16.903 35.199 1.00 25.23 C ATOM 368 CZ PHE A 39 21.908 17.105 36.492 1.00 25.61 C ATOM 369 H PHE A 39 22.950 21.871 31.607 1.00 0.00 H ATOM 370 N ARG A 40 23.592 18.630 31.174 1.00 19.56 N ATOM 371 CA ARG A 40 23.967 17.377 30.541 1.00 21.08 C ATOM 372 C ARG A 40 25.487 17.276 30.384 1.00 22.92 C ATOM 373 O ARG A 40 26.080 16.216 30.640 1.00 27.30 O ATOM 374 CB ARG A 40 23.265 17.219 29.187 1.00 23.73 C ATOM 375 CG ARG A 40 23.689 15.961 28.415 1.00 26.89 C ATOM 376 CD ARG A 40 22.905 15.770 27.124 1.00 31.75 C ATOM 377 NE ARG A 40 21.495 15.436 27.343 1.00 36.05 N ATOM 378 CZ ARG A 40 21.009 14.211 27.542 1.00 37.44 C ATOM 379 NH1 ARG A 40 21.815 13.146 27.585 1.00 40.48 N ATOM 380 NH2 ARG A 40 19.705 14.042 27.721 1.00 31.39 N ATOM 381 HE ARG A 40 20.815 16.223 27.343 1.00 0.00 H ATOM 382 HH12 ARG A 40 21.416 12.198 27.741 1.00 0.00 H ATOM 383 HH11 ARG A 40 22.841 13.265 27.462 1.00 0.00 H ATOM 384 HH22 ARG A 40 19.321 13.088 27.877 1.00 0.00 H ATOM 385 HH21 ARG A 40 19.067 14.863 27.706 1.00 0.00 H ATOM 386 H ARG A 40 22.952 19.283 30.680 1.00 0.00 H ATOM 387 N LYS A 41 26.111 18.378 29.973 1.00 22.38 N ATOM 388 CA LYS A 41 27.560 18.417 29.728 1.00 22.89 C ATOM 389 C LYS A 41 28.410 18.283 31.014 1.00 24.32 C ATOM 390 O LYS A 41 29.372 17.518 31.055 1.00 29.48 O ATOM 391 CB LYS A 41 27.925 19.722 29.021 1.00 23.61 C ATOM 392 CG LYS A 41 29.406 19.871 28.606 1.00 25.89 C ATOM 393 CD LYS A 41 29.637 21.185 27.846 1.00 29.27 C ATOM 394 CE LYS A 41 31.128 21.410 27.493 1.00 35.05 C ATOM 395 NZ LYS A 41 31.566 20.743 26.221 1.00 36.61 N ATOM 396 HZ1 LYS A 41 31.422 19.716 26.302 1.00 0.00 H ATOM 397 HZ2 LYS A 41 31.005 21.111 25.427 1.00 0.00 H ATOM 398 HZ3 LYS A 41 32.574 20.941 26.056 1.00 0.00 H ATOM 399 H LYS A 41 25.553 19.242 29.820 1.00 0.00 H ATOM 400 N THR A 42 28.049 19.033 32.054 1.00 22.80 N ATOM 401 CA THR A 42 28.901 19.193 33.243 1.00 24.49 C ATOM 402 C THR A 42 28.385 18.561 34.537 1.00 26.64 C ATOM 403 O THR A 42 29.150 18.404 35.495 1.00 28.80 O ATOM 404 CB THR A 42 29.098 20.689 33.557 1.00 24.36 C ATOM 405 OG1 THR A 42 27.848 21.237 33.990 1.00 24.71 O ATOM 406 CG2 THR A 42 29.620 21.458 32.326 1.00 25.03 C ATOM 407 HG1 THR A 42 27.964 22.199 34.194 1.00 0.00 H ATOM 408 H THR A 42 27.132 19.523 32.025 1.00 0.00 H ATOM 409 N GLY A 43 27.086 18.268 34.597 1.00 27.16 N ATOM 410 CA GLY A 43 26.451 17.803 35.829 1.00 28.77 C ATOM 411 C GLY A 43 26.117 18.914 36.809 1.00 28.37 C ATOM 412 O GLY A 43 25.681 18.642 37.936 1.00 30.98 O ATOM 413 H GLY A 43 26.506 18.374 33.740 1.00 0.00 H ATOM 414 N ARG A 44 26.314 20.167 36.390 1.00 27.48 N ATOM 415 CA ARG A 44 26.041 21.327 37.237 1.00 25.84 C ATOM 416 C ARG A 44 24.886 22.149 36.690 1.00 22.24 C ATOM 417 O ARG A 44 24.907 22.552 35.533 1.00 22.02 O ATOM 418 CB ARG A 44 27.312 22.173 37.390 1.00 29.33 C ATOM 419 CG ARG A 44 28.435 21.416 38.087 1.00 34.33 C ATOM 420 CD ARG A 44 29.816 22.005 37.827 1.00 38.40 C ATOM 421 NE ARG A 44 30.824 21.353 38.666 1.00 38.28 N ATOM 422 CZ ARG A 44 31.361 20.152 38.440 1.00 33.96 C ATOM 423 NH1 ARG A 44 32.257 19.686 39.294 1.00 33.55 N ATOM 424 NH2 ARG A 44 31.016 19.414 37.378 1.00 28.15 N ATOM 425 HE ARG A 44 31.149 21.869 39.509 1.00 0.00 H ATOM 426 HH12 ARG A 44 32.688 18.753 39.138 1.00 0.00 H ATOM 427 HH11 ARG A 44 32.530 20.253 40.122 1.00 0.00 H ATOM 428 HH22 ARG A 44 31.452 18.482 37.229 1.00 0.00 H ATOM 429 HH21 ARG A 44 30.312 19.773 36.702 1.00 0.00 H ATOM 430 H ARG A 44 26.674 20.323 35.427 1.00 0.00 H ATOM 431 N LEU A 45 23.857 22.345 37.514 1.00 23.25 N ATOM 432 CA LEU A 45 22.717 23.178 37.150 1.00 23.40 C ATOM 433 C LEU A 45 22.973 24.581 37.669 1.00 21.66 C ATOM 434 O LEU A 45 23.027 24.804 38.895 1.00 26.06 O ATOM 435 CB LEU A 45 21.410 22.622 37.731 1.00 23.00 C ATOM 436 CG LEU A 45 20.138 23.357 37.290 1.00 21.17 C ATOM 437 CD1 LEU A 45 19.956 23.124 35.779 1.00 21.78 C ATOM 438 CD2 LEU A 45 18.877 22.987 38.074 1.00 22.09 C ATOM 439 H LEU A 45 23.868 21.888 38.448 1.00 0.00 H ATOM 440 N ILE A 46 23.151 25.522 36.743 1.00 20.76 N ATOM 441 CA ILE A 46 23.448 26.911 37.107 1.00 21.33 C ATOM 442 C ILE A 46 22.490 27.846 36.394 1.00 19.96 C ATOM 443 O ILE A 46 22.392 27.811 35.170 1.00 22.96 O ATOM 444 CB ILE A 46 24.904 27.309 36.789 1.00 22.87 C ATOM 445 CG1 ILE A 46 25.883 26.432 37.588 1.00 24.37 C ATOM 446 CG2 ILE A 46 25.161 28.817 37.122 1.00 20.34 C ATOM 447 CD1 ILE A 46 27.356 26.647 37.222 1.00 28.52 C ATOM 448 H ILE A 46 23.078 25.265 35.738 1.00 0.00 H ATOM 449 N SER A 47 21.757 28.660 37.152 1.00 17.99 N ATOM 450 CA SER A 47 20.818 29.626 36.551 1.00 18.35 C ATOM 451 C SER A 47 21.588 30.662 35.737 1.00 17.31 C ATOM 452 O SER A 47 22.601 31.218 36.212 1.00 19.25 O ATOM 453 CB SER A 47 20.036 30.331 37.645 1.00 19.21 C ATOM 454 OG SER A 47 19.026 31.159 37.130 1.00 23.41 O ATOM 455 HG SER A 47 18.546 31.595 37.878 1.00 0.00 H ATOM 456 H SER A 47 21.848 28.614 38.187 1.00 0.00 H ATOM 457 N LEU A 48 21.104 30.934 34.525 1.00 16.49 N ATOM 458 CA LEU A 48 21.793 31.815 33.563 1.00 16.18 C ATOM 459 C LEU A 48 21.078 33.145 33.465 1.00 16.33 C ATOM 460 O LEU A 48 19.887 33.264 33.804 1.00 17.63 O ATOM 461 CB LEU A 48 21.892 31.136 32.199 1.00 16.48 C ATOM 462 CG LEU A 48 22.628 29.790 32.167 1.00 17.28 C ATOM 463 CD1 LEU A 48 22.533 29.117 30.798 1.00 17.46 C ATOM 464 CD2 LEU A 48 24.091 29.897 32.609 1.00 20.45 C ATOM 465 H LEU A 48 20.199 30.505 34.245 1.00 0.00 H ATOM 466 N SER A 49 21.824 34.149 33.020 1.00 16.18 N ATOM 467 CA SER A 49 21.367 35.546 32.979 1.00 17.19 C ATOM 468 C SER A 49 20.533 35.893 31.731 1.00 14.91 C ATOM 469 O SER A 49 21.068 36.086 30.620 1.00 15.55 O ATOM 470 CB SER A 49 22.592 36.472 33.037 1.00 16.89 C ATOM 471 OG SER A 49 22.212 37.829 32.944 1.00 16.38 O ATOM 472 HG SER A 49 21.610 38.054 33.697 1.00 0.00 H ATOM 473 H SER A 49 22.784 33.936 32.682 1.00 0.00 H ATOM 474 N GLU A 50 19.225 36.012 31.911 1.00 14.97 N ATOM 475 CA GLU A 50 18.365 36.577 30.866 1.00 15.89 C ATOM 476 C GLU A 50 18.735 38.031 30.584 1.00 16.66 C ATOM 477 O GLU A 50 18.616 38.497 29.466 1.00 16.66 O ATOM 478 CB GLU A 50 16.886 36.474 31.235 1.00 16.94 C ATOM 479 CG GLU A 50 16.382 35.040 31.381 1.00 17.19 C ATOM 480 CD GLU A 50 16.698 34.381 32.711 1.00 20.52 C ATOM 481 OE1 GLU A 50 17.006 35.118 33.680 1.00 21.89 O ATOM 482 OE2 GLU A 50 16.652 33.118 32.757 1.00 20.39 O ATOM 483 H GLU A 50 18.802 35.700 32.808 1.00 0.00 H ATOM 484 N GLN A 51 19.126 38.769 31.630 1.00 15.38 N ATOM 485 CA GLN A 51 19.482 40.185 31.479 1.00 15.62 C ATOM 486 C GLN A 51 20.646 40.339 30.473 1.00 15.89 C ATOM 487 O GLN A 51 20.636 41.236 29.614 1.00 16.58 O ATOM 488 CB GLN A 51 19.800 40.840 32.846 1.00 16.61 C ATOM 489 CG GLN A 51 19.771 42.334 32.757 1.00 17.86 C ATOM 490 CD GLN A 51 18.389 42.865 32.415 1.00 18.91 C ATOM 491 OE1 GLN A 51 17.405 42.451 33.017 1.00 20.36 O ATOM 492 NE2 GLN A 51 18.309 43.781 31.441 1.00 22.27 N ATOM 493 HE22 GLN A 51 19.172 44.103 30.958 1.00 0.00 H ATOM 494 HE21 GLN A 51 17.384 44.170 31.168 1.00 0.00 H ATOM 495 H GLN A 51 19.179 38.329 32.571 1.00 0.00 H ATOM 496 N ASN A 52 21.631 39.455 30.572 1.00 14.93 N ATOM 497 CA ASN A 52 22.771 39.433 29.640 1.00 16.70 C ATOM 498 C ASN A 52 22.268 39.315 28.194 1.00 15.89 C ATOM 499 O ASN A 52 22.734 40.027 27.311 1.00 17.07 O ATOM 500 CB ASN A 52 23.658 38.254 30.037 1.00 16.75 C ATOM 501 CG ASN A 52 25.026 38.181 29.331 1.00 15.00 C ATOM 502 OD1 ASN A 52 25.868 37.396 29.788 1.00 17.84 O ATOM 503 ND2 ASN A 52 25.238 38.908 28.232 1.00 15.93 N ATOM 504 HD22 ASN A 52 24.500 39.554 27.886 1.00 0.00 H ATOM 505 HD21 ASN A 52 26.141 38.828 27.722 1.00 0.00 H ATOM 506 H ASN A 52 21.596 38.751 31.337 1.00 0.00 H ATOM 507 N LEU A 53 21.288 38.454 27.964 1.00 13.61 N ATOM 508 CA LEU A 53 20.702 38.316 26.642 1.00 14.37 C ATOM 509 C LEU A 53 19.914 39.565 26.210 1.00 14.09 C ATOM 510 O LEU A 53 20.026 40.026 25.063 1.00 15.77 O ATOM 511 CB LEU A 53 19.786 37.089 26.632 1.00 14.49 C ATOM 512 CG LEU A 53 20.495 35.744 26.777 1.00 14.62 C ATOM 513 CD1 LEU A 53 19.469 34.588 26.810 1.00 15.38 C ATOM 514 CD2 LEU A 53 21.473 35.511 25.612 1.00 17.16 C ATOM 515 H LEU A 53 20.932 37.866 28.744 1.00 0.00 H ATOM 516 N VAL A 54 19.088 40.085 27.120 1.00 15.77 N ATOM 517 CA VAL A 54 18.272 41.258 26.813 1.00 15.02 C ATOM 518 C VAL A 54 19.152 42.467 26.454 1.00 16.82 C ATOM 519 O VAL A 54 18.886 43.158 25.484 1.00 16.80 O ATOM 520 CB VAL A 54 17.324 41.621 27.976 1.00 14.78 C ATOM 521 CG1 VAL A 54 16.699 43.009 27.781 1.00 18.11 C ATOM 522 CG2 VAL A 54 16.222 40.503 28.136 1.00 17.49 C ATOM 523 H VAL A 54 19.024 39.649 28.062 1.00 0.00 H ATOM 524 N ASP A 55 20.205 42.687 27.220 1.00 15.73 N ATOM 525 CA ASP A 55 21.056 43.865 27.068 1.00 16.64 C ATOM 526 C ASP A 55 22.031 43.792 25.902 1.00 17.47 C ATOM 527 O ASP A 55 22.461 44.845 25.402 1.00 22.97 O ATOM 528 CB ASP A 55 21.903 44.095 28.321 1.00 19.05 C ATOM 529 CG ASP A 55 21.090 44.467 29.561 1.00 21.51 C ATOM 530 OD1 ASP A 55 19.910 44.827 29.442 1.00 22.02 O ATOM 531 OD2 ASP A 55 21.667 44.405 30.669 1.00 21.91 O ATOM 532 H ASP A 55 20.438 41.995 27.960 1.00 0.00 H ATOM 533 N CYS A 56 22.441 42.574 25.522 1.00 16.38 N ATOM 534 CA CYS A 56 23.636 42.386 24.683 1.00 15.15 C ATOM 535 C CYS A 56 23.446 41.735 23.300 1.00 15.51 C ATOM 536 O CYS A 56 24.372 41.759 22.503 1.00 18.55 O ATOM 537 CB CYS A 56 24.706 41.577 25.440 1.00 16.79 C ATOM 538 SG CYS A 56 25.118 42.175 27.088 1.00 18.40 S ATOM 539 H CYS A 56 21.901 41.740 25.828 1.00 0.00 H ATOM 540 N SER A 57 22.289 41.142 23.025 1.00 16.78 N ATOM 541 CA SER A 57 22.118 40.355 21.803 1.00 16.90 C ATOM 542 C SER A 57 21.407 41.119 20.667 1.00 15.20 C ATOM 543 O SER A 57 20.866 40.517 19.717 1.00 15.49 O ATOM 544 CB SER A 57 21.447 39.021 22.113 1.00 15.67 C ATOM 545 OG SER A 57 20.146 39.175 22.665 1.00 15.58 O ATOM 546 HG SER A 57 20.206 39.688 23.510 1.00 0.00 H ATOM 547 H SER A 57 21.493 41.239 23.688 1.00 0.00 H ATOM 548 N GLY A 58 21.463 42.444 20.738 1.00 16.71 N ATOM 549 CA GLY A 58 21.018 43.285 19.624 1.00 15.66 C ATOM 550 C GLY A 58 21.654 42.966 18.284 1.00 16.18 C ATOM 551 O GLY A 58 20.964 42.863 17.296 1.00 18.01 O ATOM 552 H GLY A 58 21.830 42.893 21.601 1.00 0.00 H ATOM 553 N PRO A 59 22.980 42.785 18.242 1.00 16.96 N ATOM 554 CA PRO A 59 23.629 42.526 16.950 1.00 17.01 C ATOM 555 C PRO A 59 23.114 41.279 16.239 1.00 16.60 C ATOM 556 O PRO A 59 23.114 41.226 14.999 1.00 19.43 O ATOM 557 CB PRO A 59 25.111 42.392 17.328 1.00 18.25 C ATOM 558 CG PRO A 59 25.248 43.291 18.512 1.00 18.69 C ATOM 559 CD PRO A 59 23.971 43.035 19.299 1.00 19.05 C ATOM 560 N GLN A 60 22.668 40.295 17.032 1.00 17.06 N ATOM 561 CA GLN A 60 22.140 39.036 16.505 1.00 15.26 C ATOM 562 C GLN A 60 20.685 39.130 16.051 1.00 14.54 C ATOM 563 O GLN A 60 20.162 38.160 15.503 1.00 18.29 O ATOM 564 CB GLN A 60 22.310 37.907 17.530 1.00 15.74 C ATOM 565 CG GLN A 60 23.776 37.532 17.757 1.00 15.69 C ATOM 566 CD GLN A 60 24.589 38.554 18.566 1.00 16.58 C ATOM 567 OE1 GLN A 60 24.045 39.326 19.374 1.00 18.68 O ATOM 568 NE2 GLN A 60 25.904 38.531 18.373 1.00 18.47 N ATOM 569 HE22 GLN A 60 26.317 37.868 17.686 1.00 0.00 H ATOM 570 HE21 GLN A 60 26.520 39.176 18.909 1.00 0.00 H ATOM 571 H GLN A 60 22.698 40.431 18.063 1.00 0.00 H ATOM 572 N GLY A 61 20.034 40.271 16.299 1.00 17.86 N ATOM 573 CA GLY A 61 18.648 40.501 15.861 1.00 17.24 C ATOM 574 C GLY A 61 17.628 40.694 16.970 1.00 17.22 C ATOM 575 O GLY A 61 16.476 40.995 16.683 1.00 17.19 O ATOM 576 H GLY A 61 20.525 41.024 16.821 1.00 0.00 H ATOM 577 N ASN A 62 18.014 40.506 18.233 1.00 17.69 N ATOM 578 CA ASN A 62 17.042 40.589 19.331 1.00 15.78 C ATOM 579 C ASN A 62 16.715 42.041 19.635 1.00 16.47 C ATOM 580 O ASN A 62 17.527 42.947 19.375 1.00 18.73 O ATOM 581 CB ASN A 62 17.520 39.820 20.566 1.00 14.78 C ATOM 582 CG ASN A 62 17.442 38.320 20.365 1.00 14.62 C ATOM 583 OD1 ASN A 62 16.503 37.829 19.712 1.00 16.24 O ATOM 584 ND2 ASN A 62 18.407 37.568 20.945 1.00 15.16 N ATOM 585 HD22 ASN A 62 19.172 38.026 21.481 1.00 0.00 H ATOM 586 HD21 ASN A 62 18.384 36.532 20.855 1.00 0.00 H ATOM 587 H ASN A 62 19.012 40.299 18.442 1.00 0.00 H ATOM 588 N GLU A 63 15.509 42.252 20.155 1.00 18.50 N ATOM 589 CA GLU A 63 14.979 43.593 20.387 1.00 19.25 C ATOM 590 C GLU A 63 14.615 43.794 21.859 1.00 18.51 C ATOM 591 O GLU A 63 13.624 44.438 22.193 1.00 20.71 O ATOM 592 CB GLU A 63 13.806 43.853 19.420 1.00 20.28 C ATOM 593 CG GLU A 63 14.300 43.914 17.969 1.00 21.93 C ATOM 594 CD GLU A 63 13.207 44.100 16.906 1.00 31.21 C ATOM 595 OE1 GLU A 63 12.007 43.915 17.206 1.00 31.88 O ATOM 596 OE2 GLU A 63 13.569 44.408 15.736 1.00 35.75 O ATOM 597 H GLU A 63 14.921 41.431 20.406 1.00 0.00 H ATOM 598 N GLY A 64 15.448 43.261 22.755 1.00 18.19 N ATOM 599 CA GLY A 64 15.311 43.562 24.170 1.00 18.41 C ATOM 600 C GLY A 64 13.986 43.197 24.816 1.00 19.62 C ATOM 601 O GLY A 64 13.553 42.042 24.763 1.00 23.35 O ATOM 602 H GLY A 64 16.205 42.622 22.437 1.00 0.00 H ATOM 603 N CYS A 65 13.343 44.189 25.430 1.00 19.68 N ATOM 604 CA CYS A 65 12.038 43.973 26.041 1.00 21.91 C ATOM 605 C CYS A 65 10.879 44.059 25.040 1.00 21.91 C ATOM 606 O CYS A 65 9.713 43.959 25.424 1.00 23.25 O ATOM 607 CB CYS A 65 11.805 44.959 27.204 1.00 24.37 C ATOM 608 SG CYS A 65 12.782 44.647 28.674 1.00 28.20 S ATOM 609 H CYS A 65 13.779 45.132 25.474 1.00 0.00 H ATOM 610 N ASN A 66 11.211 44.212 23.758 1.00 21.27 N ATOM 611 CA ASN A 66 10.228 44.218 22.684 1.00 23.74 C ATOM 612 C ASN A 66 10.228 42.942 21.832 1.00 26.30 C ATOM 613 O ASN A 66 9.635 42.902 20.772 1.00 37.04 O ATOM 614 CB ASN A 66 10.426 45.478 21.856 1.00 27.95 C ATOM 615 CG ASN A 66 10.158 46.757 22.683 1.00 34.72 C ATOM 616 OD1 ASN A 66 10.932 47.718 22.642 1.00 44.92 O ATOM 617 ND2 ASN A 66 9.074 46.745 23.458 1.00 35.93 N ATOM 618 HD22 ASN A 66 8.448 45.915 23.463 1.00 0.00 H ATOM 619 HD21 ASN A 66 8.854 47.566 24.058 1.00 0.00 H ATOM 620 H ASN A 66 12.215 44.332 23.515 1.00 0.00 H ATOM 621 N GLY A 67 10.877 41.891 22.309 1.00 22.58 N ATOM 622 CA GLY A 67 10.820 40.606 21.623 1.00 19.52 C ATOM 623 C GLY A 67 12.156 40.156 21.076 1.00 16.45 C ATOM 624 O GLY A 67 13.142 40.909 21.039 1.00 17.87 O ATOM 625 H GLY A 67 11.434 41.983 23.183 1.00 0.00 H ATOM 626 N GLY A 68 12.169 38.903 20.636 1.00 15.49 N ATOM 627 CA GLY A 68 13.393 38.257 20.200 1.00 16.31 C ATOM 628 C GLY A 68 13.163 36.809 19.846 1.00 15.00 C ATOM 629 O GLY A 68 12.043 36.292 19.949 1.00 16.50 O ATOM 630 H GLY A 68 11.277 38.370 20.603 1.00 0.00 H ATOM 631 N LEU A 69 14.239 36.158 19.431 1.00 16.34 N ATOM 632 CA LEU A 69 14.204 34.748 19.034 1.00 16.13 C ATOM 633 C LEU A 69 15.211 33.958 19.831 1.00 15.10 C ATOM 634 O LEU A 69 16.332 34.430 20.089 1.00 16.69 O ATOM 635 CB LEU A 69 14.533 34.574 17.559 1.00 16.50 C ATOM 636 CG LEU A 69 13.505 35.094 16.549 1.00 18.68 C ATOM 637 CD1 LEU A 69 13.994 34.832 15.116 1.00 21.37 C ATOM 638 CD2 LEU A 69 12.118 34.483 16.767 1.00 18.03 C ATOM 639 H LEU A 69 15.144 36.668 19.385 1.00 0.00 H ATOM 640 N MET A 70 14.814 32.749 20.196 1.00 14.51 N ATOM 641 CA MET A 70 15.707 31.885 20.957 1.00 14.87 C ATOM 642 C MET A 70 16.969 31.578 20.131 1.00 13.80 C ATOM 643 O MET A 70 18.078 31.562 20.677 1.00 15.37 O ATOM 644 CB MET A 70 14.969 30.610 21.405 1.00 15.29 C ATOM 645 CG MET A 70 13.846 30.863 22.439 1.00 16.15 C ATOM 646 SD MET A 70 12.295 31.532 21.811 1.00 16.50 S ATOM 647 CE MET A 70 11.508 30.012 21.193 1.00 16.20 C ATOM 648 H MET A 70 13.863 32.415 19.939 1.00 0.00 H ATOM 649 N ASP A 71 16.817 31.388 18.812 1.00 13.35 N ATOM 650 CA ASP A 71 17.991 31.074 17.994 1.00 14.12 C ATOM 651 C ASP A 71 18.952 32.275 17.926 1.00 13.70 C ATOM 652 O ASP A 71 20.160 32.074 17.856 1.00 15.19 O ATOM 653 CB ASP A 71 17.572 30.624 16.585 1.00 15.75 C ATOM 654 CG ASP A 71 16.957 29.232 16.560 1.00 17.57 C ATOM 655 OD1 ASP A 71 16.999 28.524 17.596 1.00 19.03 O ATOM 656 OD2 ASP A 71 16.435 28.856 15.472 1.00 20.27 O ATOM 657 H ASP A 71 15.876 31.463 18.375 1.00 0.00 H ATOM 658 N TYR A 72 18.416 33.507 17.948 1.00 13.47 N ATOM 659 CA TYR A 72 19.281 34.694 17.949 1.00 15.23 C ATOM 660 C TYR A 72 20.068 34.713 19.273 1.00 13.34 C ATOM 661 O TYR A 72 21.254 35.059 19.292 1.00 14.65 O ATOM 662 CB TYR A 72 18.501 36.015 17.801 1.00 15.91 C ATOM 663 CG TYR A 72 17.803 36.280 16.486 1.00 15.48 C ATOM 664 CD1 TYR A 72 18.082 35.545 15.335 1.00 17.31 C ATOM 665 CD2 TYR A 72 16.877 37.322 16.387 1.00 16.11 C ATOM 666 CE1 TYR A 72 17.443 35.849 14.128 1.00 18.64 C ATOM 667 CE2 TYR A 72 16.232 37.623 15.201 1.00 17.76 C ATOM 668 CZ TYR A 72 16.509 36.891 14.076 1.00 18.33 C ATOM 669 OH TYR A 72 15.834 37.203 12.920 1.00 23.34 O ATOM 670 HH TYR A 72 16.026 38.142 12.670 1.00 0.00 H ATOM 671 H TYR A 72 17.382 33.621 17.964 1.00 0.00 H ATOM 672 N ALA A 73 19.406 34.330 20.373 1.00 14.06 N ATOM 673 CA ALA A 73 20.053 34.208 21.684 1.00 13.81 C ATOM 674 C ALA A 73 21.183 33.158 21.633 1.00 13.73 C ATOM 675 O ALA A 73 22.299 33.405 22.107 1.00 12.66 O ATOM 676 CB ALA A 73 19.035 33.860 22.768 1.00 15.25 C ATOM 677 H ALA A 73 18.393 34.110 20.294 1.00 0.00 H ATOM 678 N PHE A 74 20.910 31.998 21.046 1.00 13.85 N ATOM 679 CA PHE A 74 21.948 30.969 20.961 1.00 14.23 C ATOM 680 C PHE A 74 23.123 31.456 20.118 1.00 13.87 C ATOM 681 O PHE A 74 24.271 31.153 20.403 1.00 14.30 O ATOM 682 CB PHE A 74 21.414 29.643 20.394 1.00 13.48 C ATOM 683 CG PHE A 74 20.255 29.047 21.186 1.00 13.00 C ATOM 684 CD1 PHE A 74 20.220 29.073 22.578 1.00 13.74 C ATOM 685 CD2 PHE A 74 19.182 28.450 20.531 1.00 14.47 C ATOM 686 CE1 PHE A 74 19.142 28.522 23.294 1.00 14.17 C ATOM 687 CE2 PHE A 74 18.099 27.908 21.261 1.00 14.35 C ATOM 688 CZ PHE A 74 18.099 27.950 22.648 1.00 14.30 C ATOM 689 H PHE A 74 19.965 31.822 20.649 1.00 0.00 H ATOM 690 N GLN A 75 22.816 32.188 19.052 1.00 13.98 N ATOM 691 CA GLN A 75 23.871 32.753 18.204 1.00 14.95 C ATOM 692 C GLN A 75 24.737 33.758 18.979 1.00 13.59 C ATOM 693 O GLN A 75 25.957 33.786 18.826 1.00 14.51 O ATOM 694 CB GLN A 75 23.291 33.386 16.938 1.00 16.59 C ATOM 695 CG GLN A 75 24.354 33.745 15.930 1.00 16.42 C ATOM 696 CD GLN A 75 25.104 32.520 15.421 1.00 17.78 C ATOM 697 OE1 GLN A 75 24.489 31.583 14.904 1.00 19.12 O ATOM 698 NE2 GLN A 75 26.434 32.496 15.606 1.00 22.28 N ATOM 699 HE22 GLN A 75 26.913 33.308 16.046 1.00 0.00 H ATOM 700 HE21 GLN A 75 26.985 31.666 15.309 1.00 0.00 H ATOM 701 H GLN A 75 21.818 32.362 18.817 1.00 0.00 H ATOM 702 N TYR A 76 24.088 34.598 19.789 1.00 13.17 N ATOM 703 CA TYR A 76 24.799 35.543 20.659 1.00 14.29 C ATOM 704 C TYR A 76 25.798 34.826 21.554 1.00 12.61 C ATOM 705 O TYR A 76 26.953 35.231 21.677 1.00 14.43 O ATOM 706 CB TYR A 76 23.847 36.381 21.524 1.00 14.09 C ATOM 707 CG TYR A 76 24.580 37.113 22.647 1.00 13.27 C ATOM 708 CD1 TYR A 76 25.330 38.254 22.389 1.00 16.31 C ATOM 709 CD2 TYR A 76 24.601 36.615 23.948 1.00 14.42 C ATOM 710 CE1 TYR A 76 26.038 38.901 23.410 1.00 16.01 C ATOM 711 CE2 TYR A 76 25.304 37.241 24.962 1.00 15.60 C ATOM 712 CZ TYR A 76 25.994 38.396 24.712 1.00 15.79 C ATOM 713 OH TYR A 76 26.695 38.977 25.743 1.00 17.48 O ATOM 714 HH TYR A 76 27.140 39.799 25.416 1.00 0.00 H ATOM 715 H TYR A 76 23.048 34.582 19.804 1.00 0.00 H ATOM 716 N VAL A 77 25.353 33.760 22.204 1.00 13.38 N ATOM 717 CA VAL A 77 26.232 33.056 23.145 1.00 14.39 C ATOM 718 C VAL A 77 27.475 32.530 22.422 1.00 14.25 C ATOM 719 O VAL A 77 28.601 32.657 22.924 1.00 14.97 O ATOM 720 CB VAL A 77 25.475 31.945 23.909 1.00 13.91 C ATOM 721 CG1 VAL A 77 26.423 31.159 24.830 1.00 17.33 C ATOM 722 CG2 VAL A 77 24.322 32.531 24.753 1.00 14.39 C ATOM 723 H VAL A 77 24.382 33.423 22.047 1.00 0.00 H ATOM 724 N GLN A 78 27.275 31.968 21.244 1.00 13.81 N ATOM 725 CA GLN A 78 28.382 31.488 20.402 1.00 14.48 C ATOM 726 C GLN A 78 29.326 32.631 19.946 1.00 14.14 C ATOM 727 O GLN A 78 30.541 32.535 20.101 1.00 16.66 O ATOM 728 CB GLN A 78 27.827 30.772 19.172 1.00 14.33 C ATOM 729 CG GLN A 78 28.936 30.241 18.296 1.00 16.64 C ATOM 730 CD GLN A 78 28.447 29.394 17.146 1.00 20.25 C ATOM 731 OE1 GLN A 78 27.321 29.546 16.678 1.00 21.93 O ATOM 732 NE2 GLN A 78 29.308 28.500 16.671 1.00 23.79 N ATOM 733 HE22 GLN A 78 30.251 28.407 17.100 1.00 0.00 H ATOM 734 HE21 GLN A 78 29.039 27.893 15.870 1.00 0.00 H ATOM 735 H GLN A 78 26.300 31.861 20.899 1.00 0.00 H ATOM 736 N ASP A 79 28.747 33.718 19.445 1.00 15.04 N ATOM 737 CA ASP A 79 29.523 34.882 18.979 1.00 16.33 C ATOM 738 C ASP A 79 30.344 35.486 20.108 1.00 15.88 C ATOM 739 O ASP A 79 31.495 35.890 19.931 1.00 20.32 O ATOM 740 CB ASP A 79 28.601 35.985 18.428 1.00 18.84 C ATOM 741 CG ASP A 79 27.909 35.620 17.100 1.00 20.49 C ATOM 742 OD1 ASP A 79 28.294 34.629 16.426 1.00 21.48 O ATOM 743 OD2 ASP A 79 26.967 36.368 16.716 1.00 22.02 O ATOM 744 H ASP A 79 27.710 33.748 19.379 1.00 0.00 H ATOM 745 N ASN A 80 29.702 35.557 21.256 1.00 14.10 N ATOM 746 CA ASN A 80 30.221 36.237 22.410 1.00 16.17 C ATOM 747 C ASN A 80 31.255 35.419 23.179 1.00 16.91 C ATOM 748 O ASN A 80 32.074 35.957 23.919 1.00 18.38 O ATOM 749 CB ASN A 80 29.049 36.561 23.325 1.00 17.40 C ATOM 750 CG ASN A 80 29.444 37.435 24.466 1.00 16.93 C ATOM 751 OD1 ASN A 80 29.991 38.521 24.251 1.00 19.21 O ATOM 752 ND2 ASN A 80 29.159 36.995 25.708 1.00 17.83 N ATOM 753 HD22 ASN A 80 28.697 36.073 25.840 1.00 0.00 H ATOM 754 HD21 ASN A 80 29.401 37.578 26.535 1.00 0.00 H ATOM 755 H ASN A 80 28.772 35.097 21.331 1.00 0.00 H ATOM 756 N GLY A 81 31.172 34.112 23.019 1.00 18.11 N ATOM 757 CA GLY A 81 32.067 33.183 23.663 1.00 17.94 C ATOM 758 C GLY A 81 31.676 32.853 25.083 1.00 16.87 C ATOM 759 O GLY A 81 32.480 32.296 25.851 1.00 21.98 O ATOM 760 H GLY A 81 30.427 33.734 22.400 1.00 0.00 H ATOM 761 N GLY A 82 30.440 33.188 25.452 1.00 17.29 N ATOM 762 CA GLY A 82 29.983 32.908 26.792 1.00 17.11 C ATOM 763 C GLY A 82 28.698 33.617 27.182 1.00 16.11 C ATOM 764 O GLY A 82 28.141 34.403 26.411 1.00 15.62 O ATOM 765 H GLY A 82 29.804 33.652 24.773 1.00 0.00 H ATOM 766 N LEU A 83 28.236 33.304 28.388 1.00 16.83 N ATOM 767 CA LEU A 83 27.016 33.867 28.972 1.00 17.05 C ATOM 768 C LEU A 83 27.171 33.877 30.495 1.00 17.18 C ATOM 769 O LEU A 83 27.553 32.876 31.091 1.00 17.84 O ATOM 770 CB LEU A 83 25.768 33.058 28.588 1.00 15.24 C ATOM 771 CG LEU A 83 24.419 33.678 29.017 1.00 17.15 C ATOM 772 CD1 LEU A 83 24.165 35.010 28.282 1.00 16.91 C ATOM 773 CD2 LEU A 83 23.270 32.694 28.782 1.00 18.84 C ATOM 774 H LEU A 83 28.774 32.616 28.953 1.00 0.00 H ATOM 775 N ASP A 84 26.866 35.009 31.118 1.00 16.15 N ATOM 776 CA ASP A 84 27.033 35.128 32.552 1.00 17.01 C ATOM 777 C ASP A 84 25.942 34.402 33.314 1.00 17.33 C ATOM 778 O ASP A 84 24.831 34.168 32.809 1.00 17.99 O ATOM 779 CB ASP A 84 27.035 36.597 32.968 1.00 16.67 C ATOM 780 CG ASP A 84 28.334 37.310 32.606 1.00 16.39 C ATOM 781 OD1 ASP A 84 29.389 36.635 32.490 1.00 19.11 O ATOM 782 OD2 ASP A 84 28.303 38.550 32.445 1.00 19.68 O ATOM 783 H ASP A 84 26.504 35.817 30.572 1.00 0.00 H ATOM 784 N SER A 85 26.272 34.069 34.555 1.00 18.22 N ATOM 785 CA SER A 85 25.299 33.518 35.476 1.00 19.59 C ATOM 786 C SER A 85 24.254 34.556 35.879 1.00 19.22 C ATOM 787 O SER A 85 24.501 35.773 35.862 1.00 18.90 O ATOM 788 CB SER A 85 26.006 32.994 36.713 1.00 21.48 C ATOM 789 OG SER A 85 26.531 34.043 37.503 1.00 20.95 O ATOM 790 HG SER A 85 26.983 33.662 38.297 1.00 0.00 H ATOM 791 H SER A 85 27.252 34.207 34.874 1.00 0.00 H ATOM 792 N GLU A 86 23.082 34.062 36.244 1.00 18.26 N ATOM 793 CA GLU A 86 22.027 34.886 36.869 1.00 16.59 C ATOM 794 C GLU A 86 22.582 35.665 38.047 1.00 21.17 C ATOM 795 O GLU A 86 22.297 36.848 38.191 1.00 21.20 O ATOM 796 CB GLU A 86 20.889 33.971 37.338 1.00 20.99 C ATOM 797 CG GLU A 86 19.618 34.673 37.770 1.00 25.66 C ATOM 798 CD GLU A 86 18.745 35.087 36.579 1.00 29.78 C ATOM 799 OE1 GLU A 86 18.855 36.262 36.211 1.00 33.60 O ATOM 800 OE2 GLU A 86 17.965 34.242 36.027 1.00 28.44 O ATOM 801 H GLU A 86 22.896 33.051 36.084 1.00 0.00 H ATOM 802 N GLU A 87 23.360 34.986 38.891 1.00 20.59 N ATOM 803 CA GLU A 87 23.895 35.582 40.120 1.00 21.93 C ATOM 804 C GLU A 87 24.786 36.779 39.800 1.00 21.54 C ATOM 805 O GLU A 87 24.690 37.806 40.450 1.00 22.59 O ATOM 806 CB GLU A 87 24.691 34.522 40.885 1.00 26.21 C ATOM 807 CG GLU A 87 25.313 35.011 42.170 1.00 29.78 C ATOM 808 CD GLU A 87 25.967 33.887 42.971 1.00 35.32 C ATOM 809 OE1 GLU A 87 26.102 32.755 42.460 1.00 39.84 O ATOM 810 OE2 GLU A 87 26.362 34.147 44.117 1.00 47.31 O ATOM 811 H GLU A 87 23.596 33.998 38.670 1.00 0.00 H ATOM 812 N SER A 88 25.636 36.646 38.778 1.00 20.93 N ATOM 813 CA SER A 88 26.581 37.710 38.418 1.00 22.03 C ATOM 814 C SER A 88 25.946 38.870 37.654 1.00 22.49 C ATOM 815 O SER A 88 26.497 39.973 37.611 1.00 21.84 O ATOM 816 CB SER A 88 27.732 37.154 37.575 1.00 20.76 C ATOM 817 OG SER A 88 27.303 36.784 36.284 1.00 20.76 O ATOM 818 HG SER A 88 26.605 36.086 36.357 1.00 0.00 H ATOM 819 H SER A 88 25.628 35.766 38.223 1.00 0.00 H ATOM 820 N TYR A 89 24.811 38.605 37.014 1.00 19.22 N ATOM 821 CA TYR A 89 24.184 39.559 36.108 1.00 17.52 C ATOM 822 C TYR A 89 22.664 39.414 36.281 1.00 18.40 C ATOM 823 O TYR A 89 21.986 38.838 35.449 1.00 17.33 O ATOM 824 CB TYR A 89 24.666 39.258 34.694 1.00 18.62 C ATOM 825 CG TYR A 89 24.487 40.353 33.670 1.00 18.32 C ATOM 826 CD1 TYR A 89 23.540 41.363 33.800 1.00 19.71 C ATOM 827 CD2 TYR A 89 25.276 40.348 32.529 1.00 17.83 C ATOM 828 CE1 TYR A 89 23.410 42.353 32.824 1.00 19.35 C ATOM 829 CE2 TYR A 89 25.150 41.313 31.545 1.00 17.56 C ATOM 830 CZ TYR A 89 24.209 42.305 31.680 1.00 20.06 C ATOM 831 OH TYR A 89 24.086 43.250 30.685 1.00 19.67 O ATOM 832 HH TYR A 89 23.371 43.891 30.927 1.00 0.00 H ATOM 833 H TYR A 89 24.354 37.683 37.165 1.00 0.00 H ATOM 834 N PRO A 90 22.125 39.937 37.391 1.00 20.20 N ATOM 835 CA PRO A 90 20.728 39.675 37.776 1.00 20.37 C ATOM 836 C PRO A 90 19.685 40.351 36.899 1.00 21.11 C ATOM 837 O PRO A 90 19.963 41.356 36.231 1.00 20.72 O ATOM 838 CB PRO A 90 20.635 40.207 39.227 1.00 26.14 C ATOM 839 CG PRO A 90 22.003 40.625 39.613 1.00 26.32 C ATOM 840 CD PRO A 90 22.828 40.759 38.386 1.00 23.00 C ATOM 841 N TYR A 91 18.482 39.789 36.906 1.00 21.86 N ATOM 842 CA TYR A 91 17.412 40.255 36.042 1.00 21.01 C ATOM 843 C TYR A 91 16.772 41.561 36.539 1.00 19.87 C ATOM 844 O TYR A 91 16.460 41.687 37.709 1.00 23.27 O ATOM 845 CB TYR A 91 16.367 39.152 35.894 1.00 21.21 C ATOM 846 CG TYR A 91 15.286 39.477 34.892 1.00 19.58 C ATOM 847 CD1 TYR A 91 15.588 39.614 33.527 1.00 18.60 C ATOM 848 CD2 TYR A 91 13.958 39.591 35.288 1.00 19.13 C ATOM 849 CE1 TYR A 91 14.599 39.915 32.620 1.00 20.26 C ATOM 850 CE2 TYR A 91 12.952 39.890 34.380 1.00 22.37 C ATOM 851 CZ TYR A 91 13.272 40.031 33.042 1.00 20.04 C ATOM 852 OH TYR A 91 12.330 40.330 32.076 1.00 19.41 O ATOM 853 HH TYR A 91 11.640 39.620 32.058 1.00 0.00 H ATOM 854 H TYR A 91 18.301 38.992 37.549 1.00 0.00 H ATOM 855 N GLU A 92 16.608 42.525 35.631 1.00 21.18 N ATOM 856 CA GLU A 92 16.079 43.857 35.926 1.00 21.87 C ATOM 857 C GLU A 92 14.736 44.134 35.256 1.00 20.56 C ATOM 858 O GLU A 92 14.064 45.096 35.595 1.00 25.75 O ATOM 859 CB GLU A 92 17.088 44.917 35.459 1.00 25.96 C ATOM 860 CG GLU A 92 18.409 44.872 36.207 1.00 30.25 C ATOM 861 CD GLU A 92 19.391 45.902 35.694 1.00 39.84 C ATOM 862 OE1 GLU A 92 19.046 47.105 35.717 1.00 50.10 O ATOM 863 OE2 GLU A 92 20.505 45.512 35.264 1.00 43.34 O ATOM 864 H GLU A 92 16.874 42.316 34.648 1.00 0.00 H ATOM 865 N ALA A 93 14.355 43.302 34.297 1.00 22.40 N ATOM 866 CA ALA A 93 13.099 43.479 33.553 1.00 22.26 C ATOM 867 C ALA A 93 13.002 44.806 32.780 1.00 21.62 C ATOM 868 O ALA A 93 11.902 45.290 32.507 1.00 23.27 O ATOM 869 CB ALA A 93 11.892 43.305 34.501 1.00 23.26 C ATOM 870 H ALA A 93 14.967 42.494 34.062 1.00 0.00 H ATOM 871 N THR A 94 14.154 45.392 32.442 1.00 23.76 N ATOM 872 CA THR A 94 14.233 46.552 31.553 1.00 24.78 C ATOM 873 C THR A 94 15.528 46.439 30.778 1.00 24.52 C ATOM 874 O THR A 94 16.519 45.922 31.290 1.00 29.68 O ATOM 875 CB THR A 94 14.256 47.936 32.295 1.00 27.86 C ATOM 876 OG1 THR A 94 15.298 47.952 33.284 1.00 31.45 O ATOM 877 CG2 THR A 94 12.914 48.254 32.953 1.00 27.95 C ATOM 878 HG1 THR A 94 16.172 47.806 32.843 1.00 0.00 H ATOM 879 H THR A 94 15.038 45.005 32.830 1.00 0.00 H ATOM 880 N GLU A 95 15.524 46.914 29.542 1.00 24.25 N ATOM 881 CA GLU A 95 16.722 46.877 28.736 1.00 25.70 C ATOM 882 C GLU A 95 17.712 47.965 29.171 1.00 21.73 C ATOM 883 O GLU A 95 17.344 49.126 29.340 1.00 26.46 O ATOM 884 CB GLU A 95 16.395 47.027 27.268 1.00 27.46 C ATOM 885 CG GLU A 95 17.582 46.619 26.398 1.00 29.36 C ATOM 886 CD GLU A 95 17.501 47.129 24.984 1.00 35.21 C ATOM 887 OE1 GLU A 95 16.385 47.461 24.517 1.00 42.91 O ATOM 888 OE2 GLU A 95 18.572 47.195 24.343 1.00 40.76 O ATOM 889 H GLU A 95 14.650 47.317 29.148 1.00 0.00 H ATOM 890 N GLU A 96 18.961 47.550 29.372 1.00 24.61 N ATOM 891 CA GLU A 96 20.021 48.395 29.882 1.00 24.03 C ATOM 892 C GLU A 96 21.261 48.199 29.008 1.00 23.38 C ATOM 893 O GLU A 96 21.274 47.350 28.120 1.00 20.88 O ATOM 894 CB GLU A 96 20.330 47.998 31.330 1.00 27.71 C ATOM 895 CG GLU A 96 19.141 48.089 32.299 1.00 29.83 C ATOM 896 CD GLU A 96 18.595 49.497 32.436 1.00 32.50 C ATOM 897 OE1 GLU A 96 19.357 50.465 32.225 1.00 38.26 O ATOM 898 OE2 GLU A 96 17.397 49.646 32.763 1.00 42.46 O ATOM 899 H GLU A 96 19.189 46.560 29.150 1.00 0.00 H ATOM 900 N SER A 97 22.300 48.984 29.251 1.00 24.93 N ATOM 901 CA SER A 97 23.567 48.803 28.537 1.00 24.32 C ATOM 902 C SER A 97 24.177 47.416 28.803 1.00 20.79 C ATOM 903 O SER A 97 23.988 46.826 29.843 1.00 20.90 O ATOM 904 CB SER A 97 24.573 49.878 28.955 1.00 26.06 C ATOM 905 OG SER A 97 24.996 49.675 30.296 1.00 29.53 O ATOM 906 HG SER A 97 24.212 49.718 30.898 1.00 0.00 H ATOM 907 H SER A 97 22.215 49.741 29.960 1.00 0.00 H ATOM 908 N CYS A 98 24.910 46.898 27.835 1.00 21.18 N ATOM 909 CA CYS A 98 25.500 45.580 27.977 1.00 21.90 C ATOM 910 C CYS A 98 26.594 45.573 29.058 1.00 20.49 C ATOM 911 O CYS A 98 27.514 46.398 29.026 1.00 24.52 O ATOM 912 CB CYS A 98 26.052 45.113 26.641 1.00 21.60 C ATOM 913 SG CYS A 98 26.749 43.440 26.713 1.00 25.68 S ATOM 914 H CYS A 98 25.066 47.440 26.961 1.00 0.00 H ATOM 915 N LYS A 99 26.458 44.682 30.037 1.00 21.32 N ATOM 916 CA LYS A 99 27.434 44.586 31.139 1.00 20.38 C ATOM 917 C LYS A 99 28.088 43.207 31.222 1.00 18.11 C ATOM 918 O LYS A 99 28.567 42.776 32.291 1.00 21.87 O ATOM 919 CB LYS A 99 26.784 44.965 32.459 1.00 21.68 C ATOM 920 CG LYS A 99 26.270 46.411 32.479 1.00 28.22 C ATOM 921 CD LYS A 99 25.362 46.657 33.659 1.00 31.78 C ATOM 922 CE LYS A 99 24.689 48.015 33.558 1.00 34.71 C ATOM 923 NZ LYS A 99 23.686 48.052 32.467 1.00 30.78 N ATOM 924 HZ1 LYS A 99 24.154 47.850 31.560 1.00 0.00 H ATOM 925 HZ2 LYS A 99 22.953 47.336 32.647 1.00 0.00 H ATOM 926 HZ3 LYS A 99 23.249 48.995 32.431 1.00 0.00 H ATOM 927 H LYS A 99 25.643 44.037 30.025 1.00 0.00 H ATOM 928 N TYR A 100 28.140 42.529 30.079 1.00 19.22 N ATOM 929 CA TYR A 100 28.761 41.217 30.019 1.00 17.74 C ATOM 930 C TYR A 100 30.180 41.245 30.533 1.00 18.02 C ATOM 931 O TYR A 100 30.981 42.078 30.115 1.00 20.07 O ATOM 932 CB TYR A 100 28.763 40.659 28.594 1.00 16.99 C ATOM 933 CG TYR A 100 29.513 39.355 28.511 1.00 17.96 C ATOM 934 CD1 TYR A 100 28.982 38.198 29.072 1.00 17.82 C ATOM 935 CD2 TYR A 100 30.770 39.272 27.895 1.00 18.07 C ATOM 936 CE1 TYR A 100 29.666 36.999 29.025 1.00 18.96 C ATOM 937 CE2 TYR A 100 31.456 38.060 27.834 1.00 18.03 C ATOM 938 CZ TYR A 100 30.905 36.932 28.412 1.00 17.76 C ATOM 939 OH TYR A 100 31.565 35.733 28.360 1.00 18.86 O ATOM 940 HH TYR A 100 31.699 35.472 27.414 1.00 0.00 H ATOM 941 H TYR A 100 27.731 42.943 29.217 1.00 0.00 H ATOM 942 N ASN A 101 30.479 40.333 31.459 1.00 17.16 N ATOM 943 CA ASN A 101 31.816 40.168 31.975 1.00 19.55 C ATOM 944 C ASN A 101 32.261 38.715 31.821 1.00 20.19 C ATOM 945 O ASN A 101 31.722 37.811 32.469 1.00 19.46 O ATOM 946 CB ASN A 101 31.850 40.588 33.433 1.00 22.07 C ATOM 947 CG ASN A 101 33.249 40.639 33.990 1.00 24.60 C ATOM 948 OD1 ASN A 101 34.169 40.045 33.427 1.00 23.39 O ATOM 949 ND2 ASN A 101 33.422 41.356 35.100 1.00 29.75 N ATOM 950 HD22 ASN A 101 32.612 41.840 35.538 1.00 0.00 H ATOM 951 HD21 ASN A 101 34.367 41.432 35.528 1.00 0.00 H ATOM 952 H ASN A 101 29.722 39.719 31.822 1.00 0.00 H ATOM 953 N PRO A 102 33.281 38.488 30.996 1.00 20.00 N ATOM 954 CA PRO A 102 33.705 37.117 30.703 1.00 20.84 C ATOM 955 C PRO A 102 34.212 36.343 31.929 1.00 20.28 C ATOM 956 O PRO A 102 34.181 35.113 31.921 1.00 21.34 O ATOM 957 CB PRO A 102 34.823 37.306 29.684 1.00 23.08 C ATOM 958 CG PRO A 102 35.316 38.699 29.899 1.00 24.36 C ATOM 959 CD PRO A 102 34.097 39.484 30.273 1.00 22.99 C ATOM 960 N LYS A 103 34.662 37.050 32.974 1.00 21.22 N ATOM 961 CA LYS A 103 35.096 36.407 34.198 1.00 21.24 C ATOM 962 C LYS A 103 33.992 35.550 34.823 1.00 20.69 C ATOM 963 O LYS A 103 34.273 34.544 35.466 1.00 23.20 O ATOM 964 CB LYS A 103 35.594 37.476 35.188 1.00 23.64 C ATOM 965 CG LYS A 103 36.189 36.927 36.479 1.00 26.79 C ATOM 966 CD LYS A 103 36.790 38.053 37.301 1.00 30.25 C ATOM 967 CE LYS A 103 37.007 37.620 38.739 1.00 33.18 C ATOM 968 NZ LYS A 103 37.884 38.560 39.476 1.00 38.93 N ATOM 969 HZ1 LYS A 103 38.811 38.607 39.007 1.00 0.00 H ATOM 970 HZ2 LYS A 103 37.449 39.505 39.483 1.00 0.00 H ATOM 971 HZ3 LYS A 103 38.005 38.226 40.453 1.00 0.00 H ATOM 972 H LYS A 103 34.701 38.087 32.905 1.00 0.00 H ATOM 973 N TYR A 104 32.736 35.941 34.610 1.00 20.69 N ATOM 974 CA TYR A 104 31.595 35.262 35.209 1.00 20.51 C ATOM 975 C TYR A 104 30.798 34.423 34.216 1.00 19.81 C ATOM 976 O TYR A 104 29.667 34.004 34.515 1.00 20.89 O ATOM 977 CB TYR A 104 30.702 36.296 35.899 1.00 22.43 C ATOM 978 CG TYR A 104 31.489 37.119 36.913 1.00 24.00 C ATOM 979 CD1 TYR A 104 32.041 36.524 38.035 1.00 29.95 C ATOM 980 CD2 TYR A 104 31.753 38.467 36.691 1.00 25.98 C ATOM 981 CE1 TYR A 104 32.791 37.264 38.949 1.00 31.86 C ATOM 982 CE2 TYR A 104 32.521 39.217 37.597 1.00 28.82 C ATOM 983 CZ TYR A 104 33.030 38.612 38.717 1.00 35.34 C ATOM 984 OH TYR A 104 33.786 39.362 39.607 1.00 45.84 O ATOM 985 HH TYR A 104 34.580 39.725 39.140 1.00 0.00 H ATOM 986 H TYR A 104 32.564 36.761 33.994 1.00 0.00 H ATOM 987 N SER A 105 31.375 34.169 33.041 1.00 18.34 N ATOM 988 CA SER A 105 30.732 33.285 32.078 1.00 18.18 C ATOM 989 C SER A 105 30.718 31.859 32.630 1.00 18.71 C ATOM 990 O SER A 105 31.745 31.349 33.054 1.00 22.24 O ATOM 991 CB SER A 105 31.430 33.298 30.713 1.00 19.70 C ATOM 992 OG SER A 105 30.799 32.337 29.855 1.00 21.24 O ATOM 993 HG SER A 105 30.873 31.436 30.259 1.00 0.00 H ATOM 994 H SER A 105 32.291 34.605 32.810 1.00 0.00 H ATOM 995 N VAL A 106 29.540 31.229 32.588 1.00 18.23 N ATOM 996 CA VAL A 106 29.352 29.856 33.066 1.00 20.18 C ATOM 997 C VAL A 106 28.710 28.932 32.027 1.00 20.31 C ATOM 998 O VAL A 106 28.456 27.761 32.318 1.00 22.94 O ATOM 999 CB VAL A 106 28.508 29.819 34.372 1.00 20.87 C ATOM 1000 CG1 VAL A 106 29.267 30.479 35.525 1.00 20.95 C ATOM 1001 CG2 VAL A 106 27.123 30.485 34.180 1.00 20.75 C ATOM 1002 H VAL A 106 28.720 31.736 32.199 1.00 0.00 H ATOM 1003 N ALA A 107 28.431 29.458 30.835 1.00 19.93 N ATOM 1004 CA ALA A 107 27.810 28.672 29.754 1.00 16.72 C ATOM 1005 C ALA A 107 28.371 29.086 28.402 1.00 17.35 C ATOM 1006 O ALA A 107 28.842 30.218 28.230 1.00 19.09 O ATOM 1007 CB ALA A 107 26.295 28.855 29.759 1.00 17.81 C ATOM 1008 H ALA A 107 28.659 30.458 30.661 1.00 0.00 H ATOM 1009 N ASN A 108 28.327 28.157 27.448 1.00 18.55 N ATOM 1010 CA ASN A 108 28.781 28.422 26.090 1.00 18.26 C ATOM 1011 C ASN A 108 27.895 27.621 25.152 1.00 17.38 C ATOM 1012 O ASN A 108 27.222 26.682 25.579 1.00 20.80 O ATOM 1013 CB ASN A 108 30.226 27.964 25.899 1.00 21.03 C ATOM 1014 CG ASN A 108 31.199 28.644 26.839 1.00 27.71 C ATOM 1015 OD1 ASN A 108 31.471 28.146 27.947 1.00 37.67 O ATOM 1016 ND2 ASN A 108 31.747 29.777 26.404 1.00 33.14 N ATOM 1017 HD22 ASN A 108 31.488 30.155 25.470 1.00 0.00 H ATOM 1018 HD21 ASN A 108 32.434 30.284 26.998 1.00 0.00 H ATOM 1019 H ASN A 108 27.957 27.213 27.680 1.00 0.00 H ATOM 1020 N ASP A 109 27.890 27.978 23.875 1.00 17.86 N ATOM 1021 CA ASP A 109 27.301 27.087 22.889 1.00 16.91 C ATOM 1022 C ASP A 109 28.005 27.234 21.551 1.00 16.47 C ATOM 1023 O ASP A 109 28.761 28.187 21.326 1.00 18.25 O ATOM 1024 CB ASP A 109 25.753 27.136 22.834 1.00 19.55 C ATOM 1025 CG ASP A 109 25.184 28.377 22.199 1.00 21.89 C ATOM 1026 OD1 ASP A 109 25.613 28.775 21.103 1.00 23.60 O ATOM 1027 OD2 ASP A 109 24.195 28.889 22.765 1.00 22.66 O ATOM 1028 H ASP A 109 28.303 28.886 23.582 1.00 0.00 H ATOM 1029 N THR A 110 27.796 26.236 20.711 1.00 16.23 N ATOM 1030 CA THR A 110 28.534 26.064 19.478 1.00 20.18 C ATOM 1031 C THR A 110 27.572 26.085 18.305 1.00 19.66 C ATOM 1032 O THR A 110 27.909 25.628 17.212 1.00 21.78 O ATOM 1033 CB THR A 110 29.268 24.697 19.508 1.00 23.39 C ATOM 1034 OG1 THR A 110 28.294 23.651 19.650 1.00 23.54 O ATOM 1035 CG2 THR A 110 30.284 24.644 20.680 1.00 26.32 C ATOM 1036 HG1 THR A 110 28.753 22.774 19.670 1.00 0.00 H ATOM 1037 H THR A 110 27.063 25.538 20.948 1.00 0.00 H ATOM 1038 N GLY A 111 26.377 26.618 18.534 1.00 18.02 N ATOM 1039 CA GLY A 111 25.326 26.682 17.540 1.00 19.80 C ATOM 1040 C GLY A 111 24.020 26.165 18.105 1.00 17.50 C ATOM 1041 O GLY A 111 23.830 26.093 19.316 1.00 16.84 O ATOM 1042 H GLY A 111 26.186 27.010 19.478 1.00 0.00 H ATOM 1043 N PHE A 112 23.122 25.800 17.212 1.00 16.42 N ATOM 1044 CA PHE A 112 21.817 25.328 17.594 1.00 16.61 C ATOM 1045 C PHE A 112 21.245 24.450 16.493 1.00 16.19 C ATOM 1046 O PHE A 112 21.690 24.472 15.324 1.00 16.20 O ATOM 1047 CB PHE A 112 20.875 26.515 17.905 1.00 16.16 C ATOM 1048 CG PHE A 112 20.744 27.505 16.771 1.00 16.55 C ATOM 1049 CD1 PHE A 112 21.631 28.577 16.655 1.00 18.17 C ATOM 1050 CD2 PHE A 112 19.786 27.323 15.774 1.00 17.55 C ATOM 1051 CE1 PHE A 112 21.540 29.471 15.591 1.00 18.69 C ATOM 1052 CE2 PHE A 112 19.683 28.214 14.706 1.00 19.56 C ATOM 1053 CZ PHE A 112 20.571 29.283 14.604 1.00 20.21 C ATOM 1054 H PHE A 112 23.363 25.855 16.202 1.00 0.00 H ATOM 1055 N VAL A 113 20.264 23.659 16.894 1.00 14.75 N ATOM 1056 CA VAL A 113 19.550 22.740 16.028 1.00 14.77 C ATOM 1057 C VAL A 113 18.089 23.156 15.970 1.00 15.18 C ATOM 1058 O VAL A 113 17.462 23.357 17.007 1.00 15.40 O ATOM 1059 CB VAL A 113 19.656 21.288 16.585 1.00 15.87 C ATOM 1060 CG1 VAL A 113 18.680 20.326 15.898 1.00 18.46 C ATOM 1061 CG2 VAL A 113 21.080 20.795 16.444 1.00 18.31 C ATOM 1062 H VAL A 113 19.986 23.698 17.895 1.00 0.00 H ATOM 1063 N ASP A 114 17.568 23.315 14.753 1.00 17.01 N ATOM 1064 CA ASP A 114 16.152 23.527 14.533 1.00 18.73 C ATOM 1065 C ASP A 114 15.500 22.174 14.265 1.00 18.99 C ATOM 1066 O ASP A 114 15.899 21.444 13.345 1.00 23.02 O ATOM 1067 CB ASP A 114 15.935 24.476 13.349 1.00 20.63 C ATOM 1068 CG ASP A 114 16.262 25.942 13.676 1.00 21.00 C ATOM 1069 OD1 ASP A 114 16.201 26.357 14.852 1.00 24.29 O ATOM 1070 OD2 ASP A 114 16.562 26.701 12.727 1.00 26.33 O ATOM 1071 H ASP A 114 18.203 23.286 13.930 1.00 0.00 H ATOM 1072 N ILE A 115 14.499 21.843 15.067 1.00 17.29 N ATOM 1073 CA ILE A 115 13.832 20.538 15.003 1.00 18.30 C ATOM 1074 C ILE A 115 12.813 20.547 13.861 1.00 16.65 C ATOM 1075 O ILE A 115 12.168 21.576 13.631 1.00 16.40 O ATOM 1076 CB ILE A 115 13.161 20.212 16.359 1.00 18.86 C ATOM 1077 CG1 ILE A 115 14.243 20.151 17.452 1.00 19.41 C ATOM 1078 CG2 ILE A 115 12.332 18.902 16.305 1.00 18.62 C ATOM 1079 CD1 ILE A 115 13.726 20.354 18.802 1.00 19.60 C ATOM 1080 H ILE A 115 14.173 22.536 15.770 1.00 0.00 H ATOM 1081 N PRO A 116 12.695 19.426 13.116 1.00 18.82 N ATOM 1082 CA PRO A 116 11.658 19.372 12.076 1.00 19.75 C ATOM 1083 C PRO A 116 10.276 19.679 12.647 1.00 18.62 C ATOM 1084 O PRO A 116 9.989 19.378 13.825 1.00 18.60 O ATOM 1085 CB PRO A 116 11.736 17.926 11.572 1.00 22.08 C ATOM 1086 CG PRO A 116 13.142 17.506 11.847 1.00 21.41 C ATOM 1087 CD PRO A 116 13.529 18.208 13.122 1.00 18.77 C ATOM 1088 N LYS A 117 9.440 20.288 11.819 1.00 20.70 N ATOM 1089 CA LYS A 117 8.192 20.914 12.252 1.00 19.78 C ATOM 1090 C LYS A 117 7.009 19.923 12.390 1.00 19.14 C ATOM 1091 O LYS A 117 5.916 20.122 11.825 1.00 22.95 O ATOM 1092 CB LYS A 117 7.855 22.063 11.299 1.00 21.14 C ATOM 1093 CG LYS A 117 8.929 23.147 11.201 1.00 22.67 C ATOM 1094 CD LYS A 117 8.542 24.226 10.192 1.00 28.96 C ATOM 1095 CE LYS A 117 9.689 25.208 9.934 1.00 37.80 C ATOM 1096 NZ LYS A 117 9.807 26.247 10.985 1.00 43.35 N ATOM 1097 HZ1 LYS A 117 8.924 26.795 11.030 1.00 0.00 H ATOM 1098 HZ2 LYS A 117 9.980 25.791 11.904 1.00 0.00 H ATOM 1099 HZ3 LYS A 117 10.599 26.881 10.756 1.00 0.00 H ATOM 1100 H LYS A 117 9.684 20.322 10.809 1.00 0.00 H ATOM 1101 N GLN A 118 7.233 18.871 13.174 1.00 20.26 N ATOM 1102 CA GLN A 118 6.226 17.849 13.471 1.00 21.63 C ATOM 1103 C GLN A 118 6.358 17.484 14.928 1.00 19.20 C ATOM 1104 O GLN A 118 7.482 17.458 15.478 1.00 21.40 O ATOM 1105 CB GLN A 118 6.420 16.555 12.662 1.00 25.64 C ATOM 1106 CG GLN A 118 6.571 16.730 11.174 1.00 25.54 C ATOM 1107 CD GLN A 118 8.002 16.498 10.702 1.00 23.66 C ATOM 1108 OE1 GLN A 118 8.749 15.722 11.305 1.00 32.04 O ATOM 1109 NE2 GLN A 118 8.369 17.127 9.615 1.00 27.61 N ATOM 1110 HE22 GLN A 118 7.707 17.772 9.139 1.00 0.00 H ATOM 1111 HE21 GLN A 118 9.323 16.982 9.227 1.00 0.00 H ATOM 1112 H GLN A 118 8.176 18.769 13.600 1.00 0.00 H ATOM 1113 N GLU A 119 5.227 17.165 15.555 1.00 19.93 N ATOM 1114 CA GLU A 119 5.219 16.756 16.952 1.00 20.46 C ATOM 1115 C GLU A 119 5.977 15.450 17.199 1.00 20.33 C ATOM 1116 O GLU A 119 6.515 15.261 18.278 1.00 22.01 O ATOM 1117 CB GLU A 119 3.789 16.649 17.471 1.00 19.60 C ATOM 1118 CG GLU A 119 3.135 18.011 17.700 1.00 20.72 C ATOM 1119 CD GLU A 119 1.769 17.890 18.311 1.00 22.40 C ATOM 1120 OE1 GLU A 119 0.812 17.671 17.554 1.00 24.42 O ATOM 1121 OE2 GLU A 119 1.641 17.994 19.543 1.00 21.49 O ATOM 1122 H GLU A 119 4.328 17.209 15.034 1.00 0.00 H ATOM 1123 N LYS A 120 5.984 14.529 16.230 1.00 22.85 N ATOM 1124 CA LYS A 120 6.762 13.283 16.322 1.00 22.91 C ATOM 1125 C LYS A 120 8.250 13.583 16.507 1.00 21.75 C ATOM 1126 O LYS A 120 8.933 12.985 17.344 1.00 22.63 O ATOM 1127 CB LYS A 120 6.596 12.441 15.047 1.00 26.40 C ATOM 1128 CG LYS A 120 5.181 11.978 14.768 1.00 29.56 C ATOM 1129 CD LYS A 120 4.577 11.277 15.974 1.00 33.16 C ATOM 1130 CE LYS A 120 3.157 11.745 16.219 1.00 32.17 C ATOM 1131 NZ LYS A 120 2.314 10.719 16.889 1.00 31.40 N ATOM 1132 HZ1 LYS A 120 2.268 9.867 16.294 1.00 0.00 H ATOM 1133 HZ2 LYS A 120 2.731 10.477 17.811 1.00 0.00 H ATOM 1134 HZ3 LYS A 120 1.355 11.097 17.029 1.00 0.00 H ATOM 1135 H LYS A 120 5.416 14.700 15.376 1.00 0.00 H ATOM 1136 N ALA A 121 8.746 14.512 15.682 1.00 19.84 N ATOM 1137 CA ALA A 121 10.140 14.969 15.756 1.00 18.83 C ATOM 1138 C ALA A 121 10.431 15.672 17.083 1.00 17.76 C ATOM 1139 O ALA A 121 11.498 15.473 17.693 1.00 17.77 O ATOM 1140 CB ALA A 121 10.486 15.893 14.574 1.00 20.50 C ATOM 1141 H ALA A 121 8.121 14.926 14.961 1.00 0.00 H ATOM 1142 N LEU A 122 9.482 16.491 17.533 1.00 17.79 N ATOM 1143 CA LEU A 122 9.642 17.183 18.809 1.00 16.61 C ATOM 1144 C LEU A 122 9.744 16.178 19.941 1.00 16.98 C ATOM 1145 O LEU A 122 10.584 16.327 20.835 1.00 19.19 O ATOM 1146 CB LEU A 122 8.519 18.197 19.061 1.00 17.49 C ATOM 1147 CG LEU A 122 8.569 18.975 20.383 1.00 17.30 C ATOM 1148 CD1 LEU A 122 9.938 19.702 20.586 1.00 18.53 C ATOM 1149 CD2 LEU A 122 7.390 19.971 20.514 1.00 19.00 C ATOM 1150 H LEU A 122 8.620 16.639 16.971 1.00 0.00 H ATOM 1151 N MET A 123 8.899 15.151 19.896 1.00 19.17 N ATOM 1152 CA MET A 123 8.909 14.120 20.922 1.00 17.98 C ATOM 1153 C MET A 123 10.257 13.414 20.964 1.00 18.73 C ATOM 1154 O MET A 123 10.802 13.213 22.036 1.00 20.62 O ATOM 1155 CB MET A 123 7.766 13.110 20.724 1.00 22.35 C ATOM 1156 CG MET A 123 7.733 12.036 21.795 1.00 24.43 C ATOM 1157 SD MET A 123 6.301 10.963 21.689 1.00 31.27 S ATOM 1158 CE MET A 123 6.631 10.016 20.238 1.00 33.52 C ATOM 1159 H MET A 123 8.219 15.084 19.112 1.00 0.00 H ATOM 1160 N LYS A 124 10.799 13.062 19.802 1.00 18.90 N ATOM 1161 CA LYS A 124 12.107 12.389 19.761 1.00 19.48 C ATOM 1162 C LYS A 124 13.218 13.273 20.331 1.00 19.00 C ATOM 1163 O LYS A 124 14.109 12.771 21.032 1.00 20.93 O ATOM 1164 CB LYS A 124 12.466 11.939 18.353 1.00 20.17 C ATOM 1165 CG LYS A 124 11.587 10.791 17.881 1.00 24.58 C ATOM 1166 CD LYS A 124 11.929 10.372 16.474 1.00 29.00 C ATOM 1167 CE LYS A 124 10.921 9.384 15.917 1.00 35.05 C ATOM 1168 NZ LYS A 124 11.434 8.747 14.655 1.00 33.52 N ATOM 1169 HZ1 LYS A 124 11.609 9.484 13.942 1.00 0.00 H ATOM 1170 HZ2 LYS A 124 12.320 8.242 14.858 1.00 0.00 H ATOM 1171 HZ3 LYS A 124 10.726 8.076 14.294 1.00 0.00 H ATOM 1172 H LYS A 124 10.295 13.264 18.915 1.00 0.00 H ATOM 1173 N ALA A 125 13.161 14.577 20.036 1.00 17.74 N ATOM 1174 CA ALA A 125 14.142 15.532 20.573 1.00 17.76 C ATOM 1175 C ALA A 125 14.037 15.651 22.099 1.00 17.54 C ATOM 1176 O ALA A 125 15.034 15.563 22.798 1.00 20.64 O ATOM 1177 CB ALA A 125 14.009 16.906 19.898 1.00 18.27 C ATOM 1178 H ALA A 125 12.405 14.923 19.412 1.00 0.00 H ATOM 1179 N VAL A 126 12.828 15.830 22.627 1.00 16.20 N ATOM 1180 CA VAL A 126 12.649 15.930 24.074 1.00 16.64 C ATOM 1181 C VAL A 126 13.190 14.662 24.779 1.00 17.39 C ATOM 1182 O VAL A 126 13.882 14.748 25.789 1.00 20.39 O ATOM 1183 CB VAL A 126 11.155 16.218 24.432 1.00 18.34 C ATOM 1184 CG1 VAL A 126 10.936 16.206 25.944 1.00 19.87 C ATOM 1185 CG2 VAL A 126 10.719 17.552 23.807 1.00 18.36 C ATOM 1186 H VAL A 126 12.000 15.900 22.001 1.00 0.00 H ATOM 1187 N ALA A 127 12.873 13.501 24.222 1.00 18.20 N ATOM 1188 CA ALA A 127 13.313 12.210 24.752 1.00 20.66 C ATOM 1189 C ALA A 127 14.833 12.044 24.795 1.00 18.89 C ATOM 1190 O ALA A 127 15.368 11.418 25.719 1.00 23.75 O ATOM 1191 CB ALA A 127 12.689 11.061 23.928 1.00 19.34 C ATOM 1192 H ALA A 127 12.282 13.508 23.366 1.00 0.00 H ATOM 1193 N THR A 128 15.522 12.576 23.790 1.00 18.75 N ATOM 1194 CA THR A 128 16.948 12.291 23.603 1.00 19.61 C ATOM 1195 C THR A 128 17.901 13.453 23.966 1.00 20.42 C ATOM 1196 O THR A 128 19.076 13.217 24.244 1.00 23.43 O ATOM 1197 CB THR A 128 17.252 11.807 22.144 1.00 21.09 C ATOM 1198 OG1 THR A 128 16.885 12.808 21.193 1.00 23.37 O ATOM 1199 CG2 THR A 128 16.516 10.516 21.812 1.00 22.51 C ATOM 1200 HG1 THR A 128 15.917 12.998 21.272 1.00 0.00 H ATOM 1201 H THR A 128 15.038 13.209 23.121 1.00 0.00 H ATOM 1202 N VAL A 129 17.400 14.681 23.989 1.00 16.32 N ATOM 1203 CA VAL A 129 18.239 15.877 24.140 1.00 16.81 C ATOM 1204 C VAL A 129 18.126 16.508 25.534 1.00 17.81 C ATOM 1205 O VAL A 129 19.134 16.815 26.185 1.00 19.06 O ATOM 1206 CB VAL A 129 17.898 16.926 23.044 1.00 14.68 C ATOM 1207 CG1 VAL A 129 18.563 18.266 23.296 1.00 16.75 C ATOM 1208 CG2 VAL A 129 18.263 16.401 21.661 1.00 16.81 C ATOM 1209 H VAL A 129 16.371 14.802 23.896 1.00 0.00 H ATOM 1210 N GLY A 130 16.893 16.719 25.987 1.00 16.78 N ATOM 1211 CA GLY A 130 16.598 17.481 27.199 1.00 16.88 C ATOM 1212 C GLY A 130 15.545 18.526 26.879 1.00 15.08 C ATOM 1213 O GLY A 130 14.860 18.430 25.847 1.00 16.55 O ATOM 1214 H GLY A 130 16.096 16.320 25.450 1.00 0.00 H ATOM 1215 N PRO A 131 15.421 19.547 27.738 1.00 15.29 N ATOM 1216 CA PRO A 131 14.455 20.606 27.489 1.00 14.50 C ATOM 1217 C PRO A 131 14.698 21.326 26.157 1.00 15.01 C ATOM 1218 O PRO A 131 15.849 21.597 25.762 1.00 15.88 O ATOM 1219 CB PRO A 131 14.653 21.545 28.689 1.00 15.98 C ATOM 1220 CG PRO A 131 15.132 20.638 29.783 1.00 18.89 C ATOM 1221 CD PRO A 131 16.010 19.646 29.092 1.00 17.61 C ATOM 1222 N ILE A 132 13.594 21.668 25.501 1.00 15.70 N ATOM 1223 CA ILE A 132 13.622 22.227 24.164 1.00 14.54 C ATOM 1224 C ILE A 132 12.910 23.581 24.175 1.00 14.06 C ATOM 1225 O ILE A 132 11.809 23.691 24.714 1.00 14.85 O ATOM 1226 CB ILE A 132 12.910 21.269 23.161 1.00 15.11 C ATOM 1227 CG1 ILE A 132 13.532 19.860 23.211 1.00 17.38 C ATOM 1228 CG2 ILE A 132 12.860 21.848 21.727 1.00 16.27 C ATOM 1229 CD1 ILE A 132 14.966 19.781 22.818 1.00 19.09 C ATOM 1230 H ILE A 132 12.674 21.529 25.965 1.00 0.00 H ATOM 1231 N SER A 133 13.538 24.598 23.574 1.00 14.71 N ATOM 1232 CA SER A 133 12.891 25.896 23.350 1.00 13.11 C ATOM 1233 C SER A 133 11.822 25.787 22.273 1.00 14.49 C ATOM 1234 O SER A 133 12.088 25.208 21.249 1.00 15.20 O ATOM 1235 CB SER A 133 13.903 26.963 22.928 1.00 13.70 C ATOM 1236 OG SER A 133 14.827 27.272 23.953 1.00 14.39 O ATOM 1237 HG SER A 133 14.339 27.612 24.744 1.00 0.00 H ATOM 1238 H SER A 133 14.519 24.464 23.255 1.00 0.00 H ATOM 1239 N VAL A 134 10.629 26.319 22.526 1.00 13.44 N ATOM 1240 CA VAL A 134 9.531 26.286 21.551 1.00 14.63 C ATOM 1241 C VAL A 134 8.785 27.626 21.551 1.00 15.16 C ATOM 1242 O VAL A 134 8.741 28.368 22.563 1.00 16.46 O ATOM 1243 CB VAL A 134 8.497 25.136 21.818 1.00 12.56 C ATOM 1244 CG1 VAL A 134 9.186 23.756 21.774 1.00 14.91 C ATOM 1245 CG2 VAL A 134 7.790 25.355 23.191 1.00 15.70 C ATOM 1246 H VAL A 134 10.468 26.774 23.447 1.00 0.00 H ATOM 1247 N ALA A 135 8.215 27.897 20.391 1.00 16.22 N ATOM 1248 CA ALA A 135 7.306 28.982 20.138 1.00 14.75 C ATOM 1249 C ALA A 135 5.872 28.443 20.242 1.00 17.13 C ATOM 1250 O ALA A 135 5.551 27.385 19.677 1.00 17.66 O ATOM 1251 CB ALA A 135 7.563 29.513 18.746 1.00 16.39 C ATOM 1252 H ALA A 135 8.443 27.272 19.592 1.00 0.00 H ATOM 1253 N ILE A 136 4.991 29.204 20.892 1.00 17.83 N ATOM 1254 CA ILE A 136 3.563 28.861 20.939 1.00 15.85 C ATOM 1255 C ILE A 136 2.694 30.098 20.722 1.00 18.17 C ATOM 1256 O ILE A 136 3.118 31.227 20.983 1.00 18.86 O ATOM 1257 CB ILE A 136 3.129 28.188 22.294 1.00 18.13 C ATOM 1258 CG1 ILE A 136 3.373 29.122 23.490 1.00 18.53 C ATOM 1259 CG2 ILE A 136 3.827 26.861 22.496 1.00 16.28 C ATOM 1260 CD1 ILE A 136 2.655 28.705 24.805 1.00 20.26 C ATOM 1261 H ILE A 136 5.323 30.062 21.378 1.00 0.00 H ATOM 1262 N ASP A 137 1.476 29.855 20.249 1.00 18.71 N ATOM 1263 CA ASP A 137 0.420 30.850 20.223 1.00 20.25 C ATOM 1264 C ASP A 137 -0.168 30.927 21.626 1.00 20.62 C ATOM 1265 O ASP A 137 -0.954 30.068 22.034 1.00 23.94 O ATOM 1266 CB ASP A 137 -0.655 30.464 19.202 1.00 24.52 C ATOM 1267 CG ASP A 137 -1.783 31.494 19.105 1.00 25.49 C ATOM 1268 OD1 ASP A 137 -1.753 32.517 19.834 1.00 26.55 O ATOM 1269 OD2 ASP A 137 -2.720 31.253 18.303 1.00 26.91 O ATOM 1270 H ASP A 137 1.270 28.905 19.879 1.00 0.00 H ATOM 1271 N ALA A 138 0.246 31.959 22.352 1.00 22.56 N ATOM 1272 CA ALA A 138 -0.213 32.230 23.704 1.00 22.79 C ATOM 1273 C ALA A 138 -1.205 33.412 23.699 1.00 22.31 C ATOM 1274 O ALA A 138 -1.547 33.925 24.755 1.00 28.46 O ATOM 1275 CB ALA A 138 0.991 32.573 24.595 1.00 23.50 C ATOM 1276 H ALA A 138 0.938 32.610 21.929 1.00 0.00 H ATOM 1277 N GLY A 139 -1.640 33.846 22.510 1.00 24.38 N ATOM 1278 CA GLY A 139 -2.413 35.086 22.376 1.00 27.11 C ATOM 1279 C GLY A 139 -3.912 34.926 22.531 1.00 30.74 C ATOM 1280 O GLY A 139 -4.689 35.488 21.737 1.00 37.86 O ATOM 1281 H GLY A 139 -1.424 33.289 21.658 1.00 0.00 H ATOM 1282 N HIS A 140 -4.317 34.167 23.548 1.00 25.53 N ATOM 1283 CA HIS A 140 -5.728 33.976 23.886 1.00 25.06 C ATOM 1284 C HIS A 140 -5.881 34.121 25.394 1.00 22.29 C ATOM 1285 O HIS A 140 -5.036 33.675 26.163 1.00 28.37 O ATOM 1286 CB HIS A 140 -6.244 32.603 23.420 1.00 25.87 C ATOM 1287 CG HIS A 140 -6.180 32.412 21.937 1.00 30.41 C ATOM 1288 ND1 HIS A 140 -5.071 31.894 21.300 1.00 31.06 N ATOM 1289 CD2 HIS A 140 -7.081 32.691 20.961 1.00 28.88 C ATOM 1290 CE1 HIS A 140 -5.291 31.869 19.996 1.00 35.11 C ATOM 1291 NE2 HIS A 140 -6.502 32.345 19.764 1.00 34.70 N ATOM 1292 H HIS A 140 -3.598 33.689 24.128 1.00 0.00 H ATOM 1293 N GLU A 141 -6.984 34.727 25.818 1.00 26.56 N ATOM 1294 CA GLU A 141 -7.210 34.942 27.234 1.00 25.03 C ATOM 1295 C GLU A 141 -7.277 33.624 28.024 1.00 24.17 C ATOM 1296 O GLU A 141 -6.927 33.590 29.184 1.00 25.58 O ATOM 1297 CB GLU A 141 -8.479 35.767 27.433 1.00 29.37 C ATOM 1298 CG GLU A 141 -8.194 37.254 27.736 1.00 37.56 C ATOM 1299 CD GLU A 141 -8.469 38.188 26.583 1.00 49.88 C ATOM 1300 OE1 GLU A 141 -8.174 37.820 25.430 1.00 64.61 O ATOM 1301 OE2 GLU A 141 -8.985 39.306 26.836 1.00 58.42 O ATOM 1302 H GLU A 141 -7.692 35.050 25.128 1.00 0.00 H ATOM 1303 N SER A 142 -7.691 32.538 27.371 1.00 25.42 N ATOM 1304 CA SER A 142 -7.695 31.202 27.990 1.00 25.89 C ATOM 1305 C SER A 142 -6.293 30.803 28.494 1.00 23.53 C ATOM 1306 O SER A 142 -6.149 30.134 29.529 1.00 26.03 O ATOM 1307 CB SER A 142 -8.224 30.154 26.987 1.00 25.35 C ATOM 1308 OG SER A 142 -7.505 30.186 25.771 1.00 26.17 O ATOM 1309 HG SER A 142 -7.871 29.503 25.155 1.00 0.00 H ATOM 1310 H SER A 142 -8.023 32.638 26.390 1.00 0.00 H ATOM 1311 N PHE A 143 -5.263 31.207 27.759 1.00 24.60 N ATOM 1312 CA PHE A 143 -3.874 30.946 28.189 1.00 24.67 C ATOM 1313 C PHE A 143 -3.485 31.816 29.389 1.00 24.88 C ATOM 1314 O PHE A 143 -2.936 31.330 30.385 1.00 21.85 O ATOM 1315 CB PHE A 143 -2.875 31.158 27.039 1.00 24.25 C ATOM 1316 CG PHE A 143 -1.469 30.677 27.357 1.00 23.92 C ATOM 1317 CD1 PHE A 143 -1.142 29.329 27.267 1.00 23.62 C ATOM 1318 CD2 PHE A 143 -0.493 31.571 27.760 1.00 23.79 C ATOM 1319 CE1 PHE A 143 0.159 28.889 27.555 1.00 22.51 C ATOM 1320 CE2 PHE A 143 0.805 31.128 28.062 1.00 24.14 C ATOM 1321 CZ PHE A 143 1.117 29.786 27.955 1.00 20.72 C ATOM 1322 H PHE A 143 -5.437 31.714 26.868 1.00 0.00 H ATOM 1323 N LEU A 144 -3.805 33.101 29.302 1.00 24.94 N ATOM 1324 CA LEU A 144 -3.505 34.046 30.380 1.00 27.01 C ATOM 1325 C LEU A 144 -4.091 33.574 31.705 1.00 26.54 C ATOM 1326 O LEU A 144 -3.455 33.673 32.751 1.00 27.02 O ATOM 1327 CB LEU A 144 -4.048 35.442 30.033 1.00 27.63 C ATOM 1328 CG LEU A 144 -3.709 36.613 30.962 1.00 30.34 C ATOM 1329 CD1 LEU A 144 -2.194 36.715 31.267 1.00 32.41 C ATOM 1330 CD2 LEU A 144 -4.223 37.921 30.351 1.00 33.28 C ATOM 1331 H LEU A 144 -4.282 33.446 28.445 1.00 0.00 H ATOM 1332 N PHE A 145 -5.302 33.036 31.653 1.00 27.07 N ATOM 1333 CA PHE A 145 -5.986 32.630 32.870 1.00 27.62 C ATOM 1334 C PHE A 145 -5.953 31.116 33.129 1.00 28.94 C ATOM 1335 O PHE A 145 -6.633 30.631 34.027 1.00 30.53 O ATOM 1336 CB PHE A 145 -7.403 33.212 32.851 1.00 30.11 C ATOM 1337 CG PHE A 145 -7.412 34.712 32.868 1.00 27.31 C ATOM 1338 CD1 PHE A 145 -7.006 35.389 34.003 1.00 28.36 C ATOM 1339 CD2 PHE A 145 -7.770 35.444 31.744 1.00 28.90 C ATOM 1340 CE1 PHE A 145 -6.976 36.775 34.037 1.00 29.34 C ATOM 1341 CE2 PHE A 145 -7.737 36.828 31.753 1.00 31.16 C ATOM 1342 CZ PHE A 145 -7.338 37.504 32.910 1.00 30.12 C ATOM 1343 H PHE A 145 -5.767 32.903 30.732 1.00 0.00 H ATOM 1344 N TYR A 146 -5.113 30.388 32.384 1.00 28.65 N ATOM 1345 CA TYR A 146 -4.918 28.956 32.599 1.00 27.03 C ATOM 1346 C TYR A 146 -4.534 28.641 34.045 1.00 26.11 C ATOM 1347 O TYR A 146 -3.697 29.332 34.633 1.00 29.28 O ATOM 1348 CB TYR A 146 -3.830 28.426 31.663 1.00 26.54 C ATOM 1349 CG TYR A 146 -3.381 27.010 32.003 1.00 26.61 C ATOM 1350 CD1 TYR A 146 -4.120 25.899 31.598 1.00 23.55 C ATOM 1351 CD2 TYR A 146 -2.245 26.796 32.769 1.00 25.74 C ATOM 1352 CE1 TYR A 146 -3.708 24.621 31.925 1.00 27.45 C ATOM 1353 CE2 TYR A 146 -1.838 25.540 33.105 1.00 27.25 C ATOM 1354 CZ TYR A 146 -2.569 24.443 32.690 1.00 26.38 C ATOM 1355 OH TYR A 146 -2.115 23.177 33.035 1.00 26.15 O ATOM 1356 HH TYR A 146 -2.734 22.495 32.672 1.00 0.00 H ATOM 1357 H TYR A 146 -4.580 30.858 31.625 1.00 0.00 H ATOM 1358 N LYS A 147 -5.143 27.592 34.602 1.00 27.48 N ATOM 1359 CA LYS A 147 -4.924 27.190 36.012 1.00 28.54 C ATOM 1360 C LYS A 147 -4.401 25.758 36.154 1.00 34.41 C ATOM 1361 O LYS A 147 -3.444 25.507 36.890 1.00 30.94 O ATOM 1362 CB LYS A 147 -6.239 27.270 36.789 1.00 32.61 C ATOM 1363 CG LYS A 147 -6.833 28.651 36.919 1.00 41.97 C ATOM 1364 CD LYS A 147 -6.009 29.538 37.823 1.00 46.78 C ATOM 1365 CE LYS A 147 -6.760 30.818 38.168 1.00 57.44 C ATOM 1366 NZ LYS A 147 -7.008 31.654 36.954 1.00 60.61 N ATOM 1367 HZ1 LYS A 147 -6.098 31.913 36.521 1.00 0.00 H ATOM 1368 HZ2 LYS A 147 -7.577 31.113 36.272 1.00 0.00 H ATOM 1369 HZ3 LYS A 147 -7.521 32.516 37.227 1.00 0.00 H ATOM 1370 H LYS A 147 -5.800 27.032 34.022 1.00 0.00 H ATOM 1371 N GLU A 148 -5.062 24.816 35.478 1.00 32.38 N ATOM 1372 CA GLU A 148 -4.730 23.403 35.612 1.00 32.12 C ATOM 1373 C GLU A 148 -5.310 22.602 34.456 1.00 30.18 C ATOM 1374 O GLU A 148 -6.131 23.112 33.687 1.00 33.35 O ATOM 1375 CB GLU A 148 -5.254 22.859 36.952 1.00 39.00 C ATOM 1376 CG GLU A 148 -6.776 22.922 37.113 1.00 43.46 C ATOM 1377 CD GLU A 148 -7.247 22.386 38.454 1.00 52.14 C ATOM 1378 OE1 GLU A 148 -6.450 22.380 39.417 1.00 55.42 O ATOM 1379 OE2 GLU A 148 -8.422 21.972 38.547 1.00 64.24 O ATOM 1380 H GLU A 148 -5.833 25.097 34.840 1.00 0.00 H ATOM 1381 N GLY A 149 -4.856 21.354 34.342 1.00 34.99 N ATOM 1382 CA GLY A 149 -5.311 20.432 33.303 1.00 30.72 C ATOM 1383 C GLY A 149 -4.634 20.614 31.963 1.00 27.91 C ATOM 1384 O GLY A 149 -3.668 21.369 31.840 1.00 29.50 O ATOM 1385 H GLY A 149 -4.145 21.021 35.024 1.00 0.00 H ATOM 1386 N ILE A 150 -5.150 19.920 30.951 1.00 29.36 N ATOM 1387 CA ILE A 150 -4.594 20.000 29.609 1.00 25.62 C ATOM 1388 C ILE A 150 -5.196 21.183 28.853 1.00 27.36 C ATOM 1389 O ILE A 150 -6.395 21.203 28.564 1.00 33.36 O ATOM 1390 CB ILE A 150 -4.805 18.701 28.790 1.00 25.77 C ATOM 1391 CG1 ILE A 150 -4.152 17.513 29.510 1.00 28.10 C ATOM 1392 CG2 ILE A 150 -4.249 18.870 27.344 1.00 26.50 C ATOM 1393 CD1 ILE A 150 -4.363 16.147 28.815 1.00 27.88 C ATOM 1394 H ILE A 150 -5.971 19.305 31.124 1.00 0.00 H ATOM 1395 N TYR A 151 -4.344 22.149 28.518 1.00 26.13 N ATOM 1396 CA TYR A 151 -4.743 23.340 27.770 1.00 24.27 C ATOM 1397 C TYR A 151 -5.074 22.995 26.316 1.00 25.05 C ATOM 1398 O TYR A 151 -4.211 22.520 25.571 1.00 28.04 O ATOM 1399 CB TYR A 151 -3.616 24.408 27.818 1.00 25.71 C ATOM 1400 CG TYR A 151 -3.964 25.687 27.072 1.00 22.32 C ATOM 1401 CD1 TYR A 151 -4.867 26.599 27.602 1.00 25.76 C ATOM 1402 CD2 TYR A 151 -3.431 25.962 25.825 1.00 21.59 C ATOM 1403 CE1 TYR A 151 -5.209 27.756 26.919 1.00 22.96 C ATOM 1404 CE2 TYR A 151 -3.769 27.119 25.131 1.00 23.01 C ATOM 1405 CZ TYR A 151 -4.655 28.021 25.689 1.00 24.45 C ATOM 1406 OH TYR A 151 -4.984 29.161 24.989 1.00 26.16 O ATOM 1407 HH TYR A 151 -5.624 29.699 25.519 1.00 0.00 H ATOM 1408 H TYR A 151 -3.348 22.052 28.802 1.00 0.00 H ATOM 1409 N PHE A 152 -6.331 23.219 25.933 1.00 25.16 N ATOM 1410 CA PHE A 152 -6.746 23.178 24.534 1.00 27.51 C ATOM 1411 C PHE A 152 -7.572 24.436 24.238 1.00 30.00 C ATOM 1412 O PHE A 152 -8.514 24.762 24.963 1.00 30.80 O ATOM 1413 CB PHE A 152 -7.548 21.897 24.212 1.00 26.76 C ATOM 1414 CG PHE A 152 -7.880 21.739 22.744 1.00 31.08 C ATOM 1415 CD1 PHE A 152 -6.963 21.184 21.854 1.00 27.32 C ATOM 1416 CD2 PHE A 152 -9.113 22.140 22.257 1.00 33.26 C ATOM 1417 CE1 PHE A 152 -7.270 21.041 20.487 1.00 35.26 C ATOM 1418 CE2 PHE A 152 -9.432 22.001 20.901 1.00 36.85 C ATOM 1419 CZ PHE A 152 -8.514 21.450 20.016 1.00 34.96 C ATOM 1420 H PHE A 152 -7.044 23.431 26.660 1.00 0.00 H ATOM 1421 N GLU A 153 -7.195 25.128 23.168 1.00 27.65 N ATOM 1422 CA GLU A 153 -7.839 26.335 22.704 1.00 30.34 C ATOM 1423 C GLU A 153 -8.201 26.128 21.241 1.00 30.92 C ATOM 1424 O GLU A 153 -7.330 26.164 20.383 1.00 33.92 O ATOM 1425 CB GLU A 153 -6.884 27.528 22.858 1.00 32.06 C ATOM 1426 CG GLU A 153 -7.319 28.802 22.121 1.00 29.60 C ATOM 1427 CD GLU A 153 -8.768 29.189 22.427 1.00 33.75 C ATOM 1428 OE1 GLU A 153 -9.081 29.398 23.619 1.00 31.54 O ATOM 1429 OE2 GLU A 153 -9.595 29.264 21.476 1.00 36.45 O ATOM 1430 H GLU A 153 -6.380 24.776 22.627 1.00 0.00 H ATOM 1431 N PRO A 154 -9.495 25.927 20.943 1.00 31.91 N ATOM 1432 CA PRO A 154 -9.910 25.674 19.559 1.00 33.33 C ATOM 1433 C PRO A 154 -9.438 26.700 18.536 1.00 30.68 C ATOM 1434 O PRO A 154 -9.276 26.368 17.365 1.00 41.24 O ATOM 1435 CB PRO A 154 -11.434 25.695 19.645 1.00 34.70 C ATOM 1436 CG PRO A 154 -11.731 25.276 21.056 1.00 35.13 C ATOM 1437 CD PRO A 154 -10.628 25.846 21.883 1.00 32.37 C ATOM 1438 N ASP A 155 -9.218 27.935 18.978 1.00 31.28 N ATOM 1439 CA ASP A 155 -8.825 29.033 18.096 1.00 36.62 C ATOM 1440 C ASP A 155 -7.306 29.197 17.974 1.00 34.27 C ATOM 1441 O ASP A 155 -6.844 30.107 17.286 1.00 34.20 O ATOM 1442 CB ASP A 155 -9.450 30.353 18.588 1.00 42.37 C ATOM 1443 CG ASP A 155 -9.341 31.483 17.559 1.00 52.37 C ATOM 1444 OD1 ASP A 155 -9.705 31.269 16.381 1.00 56.20 O ATOM 1445 OD2 ASP A 155 -8.890 32.591 17.934 1.00 66.59 O ATOM 1446 H ASP A 155 -9.330 28.128 19.994 1.00 0.00 H ATOM 1447 N CYS A 156 -6.532 28.325 18.628 1.00 30.93 N ATOM 1448 CA CYS A 156 -5.067 28.403 18.561 1.00 29.82 C ATOM 1449 C CYS A 156 -4.554 28.256 17.122 1.00 28.44 C ATOM 1450 O CYS A 156 -5.111 27.501 16.336 1.00 31.54 O ATOM 1451 CB CYS A 156 -4.403 27.357 19.472 1.00 26.81 C ATOM 1452 SG CYS A 156 -3.287 28.137 20.666 1.00 30.32 S ATOM 1453 H CYS A 156 -6.977 27.576 19.196 1.00 0.00 H ATOM 1454 N SER A 157 -3.497 28.994 16.784 1.00 24.87 N ATOM 1455 CA SER A 157 -2.860 28.885 15.472 1.00 24.80 C ATOM 1456 C SER A 157 -1.641 27.983 15.576 1.00 25.89 C ATOM 1457 O SER A 157 -0.882 28.070 16.556 1.00 28.81 O ATOM 1458 CB SER A 157 -2.388 30.248 14.986 1.00 24.99 C ATOM 1459 OG SER A 157 -1.761 30.152 13.705 1.00 28.21 O ATOM 1460 HG SER A 157 -1.465 31.051 13.415 1.00 0.00 H ATOM 1461 H SER A 157 -3.113 29.669 17.475 1.00 0.00 H ATOM 1462 N SER A 158 -1.443 27.151 14.547 1.00 25.69 N ATOM 1463 CA SER A 158 -0.250 26.309 14.428 1.00 27.41 C ATOM 1464 C SER A 158 0.878 27.020 13.654 1.00 26.59 C ATOM 1465 O SER A 158 1.986 26.483 13.525 1.00 23.91 O ATOM 1466 CB SER A 158 -0.607 24.990 13.725 1.00 28.75 C ATOM 1467 OG SER A 158 -1.490 24.213 14.519 1.00 33.38 O ATOM 1468 HG SER A 158 -1.057 24.005 15.385 1.00 0.00 H ATOM 1469 H SER A 158 -2.166 27.100 13.801 1.00 0.00 H ATOM 1470 N GLU A 159 0.582 28.209 13.123 1.00 28.49 N ATOM 1471 CA GLU A 159 1.507 28.959 12.255 1.00 27.29 C ATOM 1472 C GLU A 159 1.935 30.310 12.844 1.00 29.01 C ATOM 1473 O GLU A 159 3.045 30.787 12.573 1.00 33.34 O ATOM 1474 CB GLU A 159 0.858 29.205 10.885 1.00 29.47 C ATOM 1475 CG GLU A 159 0.670 27.943 10.031 1.00 35.29 C ATOM 1476 CD GLU A 159 -0.641 27.218 10.311 1.00 41.20 C ATOM 1477 OE1 GLU A 159 -1.704 27.882 10.365 1.00 50.12 O ATOM 1478 OE2 GLU A 159 -0.614 25.978 10.464 1.00 49.83 O ATOM 1479 H GLU A 159 -0.347 28.626 13.332 1.00 0.00 H ATOM 1480 N ASP A 160 1.058 30.903 13.655 1.00 29.23 N ATOM 1481 CA ASP A 160 1.211 32.258 14.191 1.00 30.48 C ATOM 1482 C ASP A 160 1.511 32.221 15.702 1.00 26.78 C ATOM 1483 O ASP A 160 0.601 32.312 16.529 1.00 35.37 O ATOM 1484 CB ASP A 160 -0.081 33.049 13.911 1.00 39.44 C ATOM 1485 CG ASP A 160 -0.007 34.516 14.345 1.00 44.58 C ATOM 1486 OD1 ASP A 160 1.087 35.011 14.702 1.00 51.00 O ATOM 1487 OD2 ASP A 160 -1.070 35.180 14.317 1.00 54.99 O ATOM 1488 H ASP A 160 0.208 30.368 13.925 1.00 0.00 H ATOM 1489 N MET A 161 2.787 32.097 16.056 1.00 25.16 N ATOM 1490 CA MET A 161 3.196 31.998 17.463 1.00 21.75 C ATOM 1491 C MET A 161 3.722 33.351 17.937 1.00 20.47 C ATOM 1492 O MET A 161 4.213 34.152 17.131 1.00 23.61 O ATOM 1493 CB MET A 161 4.287 30.937 17.650 1.00 20.96 C ATOM 1494 CG MET A 161 3.879 29.536 17.234 1.00 21.51 C ATOM 1495 SD MET A 161 3.978 29.169 15.472 1.00 23.58 S ATOM 1496 CE MET A 161 5.773 29.162 15.231 1.00 23.82 C ATOM 1497 H MET A 161 3.516 32.069 15.315 1.00 0.00 H ATOM 1498 N ASP A 162 3.633 33.590 19.244 1.00 17.57 N ATOM 1499 CA ASP A 162 3.963 34.892 19.797 1.00 18.77 C ATOM 1500 C ASP A 162 4.631 34.822 21.168 1.00 17.00 C ATOM 1501 O ASP A 162 4.839 35.847 21.825 1.00 19.49 O ATOM 1502 CB ASP A 162 2.701 35.780 19.834 1.00 20.28 C ATOM 1503 CG ASP A 162 1.619 35.268 20.788 1.00 22.98 C ATOM 1504 OD1 ASP A 162 1.792 34.209 21.430 1.00 23.02 O ATOM 1505 OD2 ASP A 162 0.576 35.971 20.916 1.00 28.62 O ATOM 1506 H ASP A 162 3.321 32.830 19.881 1.00 0.00 H ATOM 1507 N HIS A 163 4.965 33.616 21.620 1.00 17.63 N ATOM 1508 CA HIS A 163 5.485 33.439 22.968 1.00 16.35 C ATOM 1509 C HIS A 163 6.484 32.260 23.022 1.00 18.02 C ATOM 1510 O HIS A 163 6.200 31.161 22.543 1.00 19.22 O ATOM 1511 CB HIS A 163 4.323 33.231 23.945 1.00 18.60 C ATOM 1512 CG HIS A 163 4.723 33.241 25.392 1.00 19.38 C ATOM 1513 ND1 HIS A 163 5.444 34.269 25.960 1.00 22.03 N ATOM 1514 CD2 HIS A 163 4.477 32.361 26.392 1.00 21.77 C ATOM 1515 CE1 HIS A 163 5.651 34.007 27.239 1.00 21.66 C ATOM 1516 NE2 HIS A 163 5.064 32.859 27.531 1.00 21.53 N ATOM 1517 H HIS A 163 4.853 32.788 21.001 1.00 0.00 H ATOM 1518 N GLY A 164 7.659 32.524 23.577 1.00 16.23 N ATOM 1519 CA GLY A 164 8.713 31.540 23.691 1.00 16.23 C ATOM 1520 C GLY A 164 8.689 30.923 25.076 1.00 16.11 C ATOM 1521 O GLY A 164 8.754 31.638 26.087 1.00 17.61 O ATOM 1522 H GLY A 164 7.830 33.481 23.947 1.00 0.00 H ATOM 1523 N VAL A 165 8.634 29.590 25.108 1.00 16.16 N ATOM 1524 CA VAL A 165 8.610 28.810 26.351 1.00 15.16 C ATOM 1525 C VAL A 165 9.548 27.595 26.257 1.00 15.22 C ATOM 1526 O VAL A 165 10.346 27.490 25.324 1.00 15.24 O ATOM 1527 CB VAL A 165 7.151 28.397 26.701 1.00 15.85 C ATOM 1528 CG1 VAL A 165 6.303 29.657 27.040 1.00 17.19 C ATOM 1529 CG2 VAL A 165 6.497 27.571 25.566 1.00 18.02 C ATOM 1530 H VAL A 165 8.607 29.077 24.204 1.00 0.00 H ATOM 1531 N LEU A 166 9.455 26.683 27.227 1.00 16.04 N ATOM 1532 CA LEU A 166 10.388 25.574 27.323 1.00 15.04 C ATOM 1533 C LEU A 166 9.638 24.267 27.549 1.00 16.28 C ATOM 1534 O LEU A 166 8.935 24.124 28.541 1.00 18.34 O ATOM 1535 CB LEU A 166 11.385 25.800 28.471 1.00 16.28 C ATOM 1536 CG LEU A 166 12.548 24.787 28.554 1.00 15.74 C ATOM 1537 CD1 LEU A 166 13.614 24.987 27.437 1.00 16.07 C ATOM 1538 CD2 LEU A 166 13.207 24.887 29.920 1.00 17.05 C ATOM 1539 H LEU A 166 8.695 26.769 27.932 1.00 0.00 H ATOM 1540 N VAL A 167 9.806 23.301 26.649 1.00 15.06 N ATOM 1541 CA VAL A 167 9.206 21.976 26.855 1.00 16.65 C ATOM 1542 C VAL A 167 10.205 21.153 27.653 1.00 17.12 C ATOM 1543 O VAL A 167 11.328 20.940 27.215 1.00 16.80 O ATOM 1544 CB VAL A 167 8.856 21.249 25.527 1.00 16.25 C ATOM 1545 CG1 VAL A 167 8.462 19.761 25.781 1.00 17.73 C ATOM 1546 CG2 VAL A 167 7.729 21.958 24.782 1.00 18.34 C ATOM 1547 H VAL A 167 10.367 23.486 25.793 1.00 0.00 H ATOM 1548 N VAL A 168 9.774 20.694 28.819 1.00 18.43 N ATOM 1549 CA VAL A 168 10.625 19.906 29.717 1.00 19.94 C ATOM 1550 C VAL A 168 10.225 18.425 29.788 1.00 19.50 C ATOM 1551 O VAL A 168 10.842 17.645 30.512 1.00 19.68 O ATOM 1552 CB VAL A 168 10.633 20.503 31.148 1.00 18.70 C ATOM 1553 CG1 VAL A 168 11.114 21.977 31.131 1.00 19.14 C ATOM 1554 CG2 VAL A 168 9.248 20.383 31.810 1.00 20.58 C ATOM 1555 H VAL A 168 8.796 20.900 29.108 1.00 0.00 H ATOM 1556 N GLY A 169 9.204 18.038 29.030 1.00 19.17 N ATOM 1557 CA GLY A 169 8.776 16.667 29.003 1.00 19.28 C ATOM 1558 C GLY A 169 7.441 16.526 28.311 1.00 18.87 C ATOM 1559 O GLY A 169 6.946 17.453 27.650 1.00 18.99 O ATOM 1560 H GLY A 169 8.706 18.740 28.446 1.00 0.00 H ATOM 1561 N TYR A 170 6.877 15.341 28.453 1.00 22.35 N ATOM 1562 CA TYR A 170 5.569 15.024 27.906 1.00 22.33 C ATOM 1563 C TYR A 170 5.039 13.805 28.649 1.00 21.99 C ATOM 1564 O TYR A 170 5.773 13.119 29.361 1.00 23.05 O ATOM 1565 CB TYR A 170 5.646 14.755 26.403 1.00 21.70 C ATOM 1566 CG TYR A 170 6.549 13.599 26.015 1.00 21.02 C ATOM 1567 CD1 TYR A 170 6.103 12.287 26.077 1.00 22.18 C ATOM 1568 CD2 TYR A 170 7.849 13.825 25.590 1.00 21.65 C ATOM 1569 CE1 TYR A 170 6.932 11.228 25.736 1.00 22.72 C ATOM 1570 CE2 TYR A 170 8.686 12.785 25.245 1.00 20.72 C ATOM 1571 CZ TYR A 170 8.222 11.480 25.308 1.00 20.45 C ATOM 1572 OH TYR A 170 9.057 10.440 24.969 1.00 23.86 O ATOM 1573 HH TYR A 170 8.572 9.583 25.069 1.00 0.00 H ATOM 1574 H TYR A 170 7.390 14.604 28.978 1.00 0.00 H ATOM 1575 N GLY A 171 3.759 13.536 28.476 1.00 23.27 N ATOM 1576 CA GLY A 171 3.148 12.425 29.166 1.00 24.21 C ATOM 1577 C GLY A 171 1.677 12.343 28.879 1.00 24.43 C ATOM 1578 O GLY A 171 1.202 12.848 27.854 1.00 23.10 O ATOM 1579 H GLY A 171 3.187 14.127 27.839 1.00 0.00 H ATOM 1580 N PHE A 172 0.962 11.700 29.805 1.00 26.27 N ATOM 1581 CA PHE A 172 -0.475 11.503 29.681 1.00 29.48 C ATOM 1582 C PHE A 172 -1.135 11.481 31.059 1.00 32.06 C ATOM 1583 O PHE A 172 -0.525 11.062 32.048 1.00 34.30 O ATOM 1584 CB PHE A 172 -0.756 10.195 28.922 1.00 33.60 C ATOM 1585 CG PHE A 172 -0.255 8.971 29.632 1.00 36.79 C ATOM 1586 CD1 PHE A 172 1.057 8.546 29.474 1.00 34.54 C ATOM 1587 CD2 PHE A 172 -1.102 8.247 30.480 1.00 36.93 C ATOM 1588 CE1 PHE A 172 1.530 7.413 30.145 1.00 38.43 C ATOM 1589 CE2 PHE A 172 -0.640 7.112 31.148 1.00 41.71 C ATOM 1590 CZ PHE A 172 0.683 6.694 30.973 1.00 39.35 C ATOM 1591 H PHE A 172 1.449 11.327 30.645 1.00 0.00 H ATOM 1592 N GLU A 173 -2.368 11.965 31.117 1.00 36.61 N ATOM 1593 CA GLU A 173 -3.172 11.877 32.333 1.00 37.33 C ATOM 1594 C GLU A 173 -3.873 10.521 32.361 1.00 37.47 C ATOM 1595 O GLU A 173 -4.344 10.038 31.335 1.00 39.48 O ATOM 1596 CB GLU A 173 -4.187 13.018 32.398 1.00 39.62 C ATOM 1597 CG GLU A 173 -3.543 14.387 32.660 1.00 42.97 C ATOM 1598 CD GLU A 173 -4.559 15.513 32.789 1.00 46.66 C ATOM 1599 OE1 GLU A 173 -5.632 15.429 32.150 1.00 50.00 O ATOM 1600 OE2 GLU A 173 -4.280 16.489 33.527 1.00 54.06 O ATOM 1601 H GLU A 173 -2.773 12.419 30.274 1.00 0.00 H ATOM 1602 N SER A 174 -3.927 9.904 33.539 1.00 45.86 N ATOM 1603 CA SER A 174 -4.634 8.629 33.700 1.00 47.93 C ATOM 1604 C SER A 174 -6.010 8.892 34.300 1.00 48.04 C ATOM 1605 O SER A 174 -6.220 8.690 35.505 1.00 46.67 O ATOM 1606 CB SER A 174 -3.836 7.654 34.574 1.00 53.93 C ATOM 1607 OG SER A 174 -2.485 7.555 34.159 1.00 65.40 O ATOM 1608 HG SER A 174 -2.006 6.918 34.747 1.00 0.00 H ATOM 1609 H SER A 174 -3.459 10.334 34.362 1.00 0.00 H ATOM 1610 N THR A 175 -6.940 9.337 33.452 1.00 44.65 N ATOM 1611 CA THR A 175 -8.287 9.742 33.889 1.00 42.14 C ATOM 1612 C THR A 175 -9.374 8.992 33.112 1.00 42.08 C ATOM 1613 O THR A 175 -9.078 8.261 32.172 1.00 50.53 O ATOM 1614 CB THR A 175 -8.495 11.266 33.710 1.00 41.77 C ATOM 1615 OG1 THR A 175 -8.225 11.631 32.348 1.00 39.49 O ATOM 1616 CG2 THR A 175 -7.570 12.071 34.652 1.00 41.86 C ATOM 1617 HG1 THR A 175 -8.359 12.606 32.236 1.00 0.00 H ATOM 1618 H THR A 175 -6.704 9.400 32.441 1.00 0.00 H TER 1619 THR A 175 ATOM 1620 N SER A 177 -10.070 12.000 29.595 1.00 44.88 N ATOM 1621 CA SER A 177 -10.145 10.592 29.246 1.00 41.56 C ATOM 1622 C SER A 177 -9.819 10.362 27.767 1.00 39.17 C ATOM 1623 O SER A 177 -8.854 9.657 27.458 1.00 45.81 O ATOM 1624 CB SER A 177 -11.514 10.006 29.610 1.00 37.96 C ATOM 1625 OG SER A 177 -11.541 9.613 30.975 1.00 42.36 O ATOM 1626 HG SER A 177 -10.845 8.927 31.134 1.00 0.00 H ATOM 1627 HN3 SER A 177 -10.752 12.535 29.020 1.00 0.00 H ATOM 1628 HN2 SER A 177 -9.108 12.351 29.411 1.00 0.00 H ATOM 1629 HN1 SER A 177 -10.296 12.119 30.603 1.00 0.00 H ATOM 1630 N ASP A 178 -10.600 10.951 26.853 1.00 32.86 N ATOM 1631 CA ASP A 178 -10.391 10.716 25.395 1.00 31.44 C ATOM 1632 C ASP A 178 -9.193 11.458 24.809 1.00 31.10 C ATOM 1633 O ASP A 178 -8.530 10.961 23.918 1.00 31.03 O ATOM 1634 CB ASP A 178 -11.644 11.061 24.598 1.00 28.95 C ATOM 1635 CG ASP A 178 -12.760 10.027 24.774 1.00 31.56 C ATOM 1636 OD1 ASP A 178 -12.479 8.861 25.144 1.00 38.60 O ATOM 1637 OD2 ASP A 178 -13.920 10.389 24.526 1.00 30.72 O ATOM 1638 H ASP A 178 -11.365 11.583 27.165 1.00 0.00 H ATOM 1639 N ASN A 179 -8.935 12.664 25.292 1.00 30.74 N ATOM 1640 CA ASN A 179 -7.733 13.402 24.895 1.00 27.79 C ATOM 1641 C ASN A 179 -6.897 13.586 26.131 1.00 27.53 C ATOM 1642 O ASN A 179 -7.235 14.412 26.962 1.00 34.88 O ATOM 1643 CB ASN A 179 -8.115 14.756 24.291 1.00 30.84 C ATOM 1644 CG ASN A 179 -8.778 14.621 22.930 1.00 35.03 C ATOM 1645 OD1 ASN A 179 -8.157 14.156 21.971 1.00 37.05 O ATOM 1646 ND2 ASN A 179 -10.048 15.030 22.837 1.00 35.68 N ATOM 1647 HD22 ASN A 179 -10.533 15.416 23.672 1.00 0.00 H ATOM 1648 HD21 ASN A 179 -10.551 14.962 21.929 1.00 0.00 H ATOM 1649 H ASN A 179 -9.599 13.096 25.966 1.00 0.00 H ATOM 1650 N ASN A 180 -5.840 12.786 26.281 1.00 25.34 N ATOM 1651 CA ASN A 180 -5.098 12.761 27.535 1.00 27.13 C ATOM 1652 C ASN A 180 -3.587 12.957 27.421 1.00 24.52 C ATOM 1653 O ASN A 180 -2.907 12.869 28.426 1.00 26.01 O ATOM 1654 CB ASN A 180 -5.415 11.486 28.332 1.00 33.01 C ATOM 1655 CG ASN A 180 -5.124 10.212 27.558 1.00 38.38 C ATOM 1656 OD1 ASN A 180 -4.369 10.204 26.584 1.00 38.71 O ATOM 1657 ND2 ASN A 180 -5.733 9.114 28.001 1.00 48.83 N ATOM 1658 HD22 ASN A 180 -6.363 9.166 28.827 1.00 0.00 H ATOM 1659 HD21 ASN A 180 -5.579 8.204 27.521 1.00 0.00 H ATOM 1660 H ASN A 180 -5.542 12.174 25.495 1.00 0.00 H ATOM 1661 N LYS A 181 -3.057 13.241 26.234 1.00 23.30 N ATOM 1662 CA LYS A 181 -1.609 13.471 26.091 1.00 24.35 C ATOM 1663 C LYS A 181 -1.269 14.950 26.132 1.00 21.30 C ATOM 1664 O LYS A 181 -2.020 15.807 25.637 1.00 23.69 O ATOM 1665 CB LYS A 181 -1.053 12.853 24.807 1.00 24.99 C ATOM 1666 CG LYS A 181 -1.247 11.342 24.746 1.00 28.17 C ATOM 1667 CD LYS A 181 -0.527 10.697 23.563 1.00 28.10 C ATOM 1668 CE LYS A 181 -1.218 10.993 22.222 1.00 31.89 C ATOM 1669 NZ LYS A 181 -0.556 10.370 21.009 1.00 33.33 N ATOM 1670 HZ1 LYS A 181 0.418 10.724 20.927 1.00 0.00 H ATOM 1671 HZ2 LYS A 181 -0.542 9.336 21.116 1.00 0.00 H ATOM 1672 HZ3 LYS A 181 -1.091 10.624 20.154 1.00 0.00 H ATOM 1673 H LYS A 181 -3.672 13.301 25.398 1.00 0.00 H ATOM 1674 N TYR A 182 -0.124 15.249 26.719 1.00 22.16 N ATOM 1675 CA TYR A 182 0.333 16.612 26.813 1.00 21.24 C ATOM 1676 C TYR A 182 1.833 16.783 26.724 1.00 21.32 C ATOM 1677 O TYR A 182 2.614 15.852 27.006 1.00 19.83 O ATOM 1678 CB TYR A 182 -0.157 17.229 28.125 1.00 21.25 C ATOM 1679 CG TYR A 182 0.313 16.503 29.367 1.00 22.59 C ATOM 1680 CD1 TYR A 182 1.563 16.771 29.923 1.00 24.28 C ATOM 1681 CD2 TYR A 182 -0.482 15.519 29.977 1.00 22.02 C ATOM 1682 CE1 TYR A 182 2.000 16.111 31.065 1.00 26.45 C ATOM 1683 CE2 TYR A 182 -0.037 14.858 31.133 1.00 26.69 C ATOM 1684 CZ TYR A 182 1.208 15.156 31.655 1.00 27.92 C ATOM 1685 OH TYR A 182 1.670 14.526 32.775 1.00 31.98 O ATOM 1686 HH TYR A 182 2.572 14.868 32.996 1.00 0.00 H ATOM 1687 H TYR A 182 0.458 14.487 27.121 1.00 0.00 H ATOM 1688 N TRP A 183 2.204 18.015 26.379 1.00 20.21 N ATOM 1689 CA TRP A 183 3.563 18.531 26.553 1.00 20.00 C ATOM 1690 C TRP A 183 3.651 19.253 27.904 1.00 19.04 C ATOM 1691 O TRP A 183 2.774 20.040 28.231 1.00 21.93 O ATOM 1692 CB TRP A 183 3.879 19.544 25.454 1.00 18.25 C ATOM 1693 CG TRP A 183 3.827 18.992 24.075 1.00 19.46 C ATOM 1694 CD1 TRP A 183 2.867 19.209 23.147 1.00 18.93 C ATOM 1695 CD2 TRP A 183 4.785 18.132 23.477 1.00 17.89 C ATOM 1696 NE1 TRP A 183 3.152 18.525 21.998 1.00 19.65 N ATOM 1697 CE2 TRP A 183 4.337 17.857 22.173 1.00 17.65 C ATOM 1698 CE3 TRP A 183 5.989 17.568 23.917 1.00 18.81 C ATOM 1699 CZ2 TRP A 183 5.046 17.044 21.295 1.00 17.48 C ATOM 1700 CZ3 TRP A 183 6.682 16.739 23.054 1.00 16.76 C ATOM 1701 CH2 TRP A 183 6.227 16.510 21.744 1.00 16.38 C ATOM 1702 HE1 TRP A 183 2.569 18.513 21.137 1.00 0.00 H ATOM 1703 H TRP A 183 1.489 18.645 25.963 1.00 0.00 H ATOM 1704 N LEU A 184 4.705 18.994 28.662 1.00 18.97 N ATOM 1705 CA LEU A 184 4.929 19.688 29.926 1.00 18.67 C ATOM 1706 C LEU A 184 5.790 20.919 29.647 1.00 18.67 C ATOM 1707 O LEU A 184 6.959 20.788 29.282 1.00 18.61 O ATOM 1708 CB LEU A 184 5.616 18.765 30.924 1.00 20.40 C ATOM 1709 CG LEU A 184 5.843 19.310 32.344 1.00 20.55 C ATOM 1710 CD1 LEU A 184 4.536 19.714 33.066 1.00 24.28 C ATOM 1711 CD2 LEU A 184 6.614 18.284 33.143 1.00 23.39 C ATOM 1712 H LEU A 184 5.391 18.278 28.349 1.00 0.00 H ATOM 1713 N VAL A 185 5.204 22.100 29.841 1.00 19.73 N ATOM 1714 CA VAL A 185 5.800 23.370 29.394 1.00 17.46 C ATOM 1715 C VAL A 185 6.050 24.302 30.587 1.00 16.94 C ATOM 1716 O VAL A 185 5.145 24.582 31.372 1.00 20.44 O ATOM 1717 CB VAL A 185 4.901 24.053 28.352 1.00 17.31 C ATOM 1718 CG1 VAL A 185 5.364 25.472 28.076 1.00 18.99 C ATOM 1719 CG2 VAL A 185 4.828 23.222 27.032 1.00 20.76 C ATOM 1720 H VAL A 185 4.286 22.126 30.329 1.00 0.00 H ATOM 1721 N LYS A 186 7.300 24.739 30.716 1.00 17.66 N ATOM 1722 CA LYS A 186 7.719 25.738 31.688 1.00 16.73 C ATOM 1723 C LYS A 186 7.518 27.129 31.092 1.00 17.48 C ATOM 1724 O LYS A 186 8.074 27.447 30.040 1.00 17.63 O ATOM 1725 CB LYS A 186 9.204 25.551 32.001 1.00 18.29 C ATOM 1726 CG LYS A 186 9.703 26.340 33.211 1.00 18.00 C ATOM 1727 CD LYS A 186 11.245 26.274 33.329 1.00 17.00 C ATOM 1728 CE LYS A 186 11.756 26.888 34.590 1.00 17.38 C ATOM 1729 NZ LYS A 186 13.213 27.193 34.517 1.00 19.37 N ATOM 1730 HZ1 LYS A 186 13.742 26.314 34.347 1.00 0.00 H ATOM 1731 HZ2 LYS A 186 13.388 27.860 33.738 1.00 0.00 H ATOM 1732 HZ3 LYS A 186 13.522 27.618 35.415 1.00 0.00 H ATOM 1733 H LYS A 186 8.023 24.342 30.083 1.00 0.00 H ATOM 1734 N ASN A 187 6.731 27.951 31.774 1.00 18.26 N ATOM 1735 CA ASN A 187 6.522 29.337 31.391 1.00 16.42 C ATOM 1736 C ASN A 187 7.450 30.246 32.243 1.00 17.71 C ATOM 1737 O ASN A 187 8.179 29.768 33.130 1.00 18.54 O ATOM 1738 CB ASN A 187 5.029 29.691 31.538 1.00 18.05 C ATOM 1739 CG ASN A 187 4.582 30.901 30.703 1.00 17.86 C ATOM 1740 OD1 ASN A 187 5.375 31.530 29.996 1.00 18.65 O ATOM 1741 ND2 ASN A 187 3.278 31.225 30.791 1.00 20.20 N ATOM 1742 HD22 ASN A 187 2.644 30.668 31.399 1.00 0.00 H ATOM 1743 HD21 ASN A 187 2.905 32.032 30.251 1.00 0.00 H ATOM 1744 H ASN A 187 6.243 27.588 32.618 1.00 0.00 H ATOM 1745 N SER A 188 7.438 31.539 31.937 1.00 16.81 N ATOM 1746 CA SER A 188 8.248 32.532 32.643 1.00 16.87 C ATOM 1747 C SER A 188 7.391 33.652 33.226 1.00 18.56 C ATOM 1748 O SER A 188 7.758 34.834 33.177 1.00 18.99 O ATOM 1749 CB SER A 188 9.287 33.091 31.687 1.00 17.19 C ATOM 1750 OG SER A 188 8.672 33.547 30.497 1.00 18.30 O ATOM 1751 HG SER A 188 8.020 34.259 30.716 1.00 0.00 H ATOM 1752 H SER A 188 6.825 31.860 31.160 1.00 0.00 H ATOM 1753 N TRP A 189 6.246 33.258 33.775 1.00 18.32 N ATOM 1754 CA TRP A 189 5.284 34.195 34.349 1.00 18.91 C ATOM 1755 C TRP A 189 5.131 33.991 35.846 1.00 19.97 C ATOM 1756 O TRP A 189 4.128 34.403 36.454 1.00 23.04 O ATOM 1757 CB TRP A 189 3.934 34.029 33.644 1.00 19.29 C ATOM 1758 CG TRP A 189 3.906 34.501 32.233 1.00 19.91 C ATOM 1759 CD1 TRP A 189 4.889 35.183 31.556 1.00 21.80 C ATOM 1760 CD2 TRP A 189 2.801 34.407 31.342 1.00 20.83 C ATOM 1761 NE1 TRP A 189 4.468 35.484 30.289 1.00 23.55 N ATOM 1762 CE2 TRP A 189 3.188 35.015 30.127 1.00 20.86 C ATOM 1763 CE3 TRP A 189 1.529 33.834 31.436 1.00 20.40 C ATOM 1764 CZ2 TRP A 189 2.331 35.083 29.014 1.00 21.47 C ATOM 1765 CZ3 TRP A 189 0.682 33.914 30.335 1.00 21.65 C ATOM 1766 CH2 TRP A 189 1.097 34.517 29.138 1.00 21.28 C ATOM 1767 HE1 TRP A 189 5.026 35.985 29.568 1.00 0.00 H ATOM 1768 H TRP A 189 6.027 32.242 33.797 1.00 0.00 H ATOM 1769 N GLY A 190 6.151 33.385 36.448 1.00 20.34 N ATOM 1770 CA GLY A 190 6.147 33.114 37.878 1.00 22.55 C ATOM 1771 C GLY A 190 5.379 31.856 38.270 1.00 23.63 C ATOM 1772 O GLY A 190 4.695 31.239 37.450 1.00 22.80 O ATOM 1773 H GLY A 190 6.974 33.097 35.881 1.00 0.00 H ATOM 1774 N GLU A 191 5.518 31.470 39.533 1.00 28.61 N ATOM 1775 CA GLU A 191 4.902 30.252 40.077 1.00 25.59 C ATOM 1776 C GLU A 191 3.396 30.310 40.298 1.00 28.81 C ATOM 1777 O GLU A 191 2.758 29.262 40.471 1.00 30.27 O ATOM 1778 CB GLU A 191 5.554 29.891 41.423 1.00 30.10 C ATOM 1779 CG GLU A 191 6.989 29.451 41.286 1.00 35.72 C ATOM 1780 CD GLU A 191 7.599 28.938 42.571 1.00 33.31 C ATOM 1781 OE1 GLU A 191 6.980 29.074 43.644 1.00 33.90 O ATOM 1782 OE2 GLU A 191 8.719 28.397 42.496 1.00 26.39 O ATOM 1783 H GLU A 191 6.092 32.060 40.169 1.00 0.00 H ATOM 1784 N GLU A 192 2.831 31.510 40.328 1.00 27.53 N ATOM 1785 CA GLU A 192 1.402 31.670 40.597 1.00 31.32 C ATOM 1786 C GLU A 192 0.503 31.567 39.360 1.00 27.94 C ATOM 1787 O GLU A 192 -0.719 31.493 39.472 1.00 38.94 O ATOM 1788 CB GLU A 192 1.168 32.964 41.378 1.00 37.17 C ATOM 1789 CG GLU A 192 1.420 32.736 42.859 1.00 46.27 C ATOM 1790 CD GLU A 192 1.935 33.935 43.608 1.00 55.03 C ATOM 1791 OE1 GLU A 192 2.323 34.944 42.974 1.00 64.86 O ATOM 1792 OE2 GLU A 192 1.961 33.852 44.856 1.00 59.71 O ATOM 1793 H GLU A 192 3.415 32.353 40.157 1.00 0.00 H ATOM 1794 N TRP A 193 1.116 31.531 38.184 1.00 24.34 N ATOM 1795 CA TRP A 193 0.394 31.257 36.940 1.00 23.82 C ATOM 1796 C TRP A 193 0.389 29.746 36.717 1.00 23.87 C ATOM 1797 O TRP A 193 1.382 29.059 36.998 1.00 23.92 O ATOM 1798 CB TRP A 193 1.055 31.974 35.768 1.00 24.54 C ATOM 1799 CG TRP A 193 0.392 31.737 34.487 1.00 23.95 C ATOM 1800 CD1 TRP A 193 -0.638 32.457 33.948 1.00 24.22 C ATOM 1801 CD2 TRP A 193 0.687 30.692 33.551 1.00 21.81 C ATOM 1802 NE1 TRP A 193 -0.993 31.932 32.723 1.00 23.22 N ATOM 1803 CE2 TRP A 193 -0.190 30.853 32.456 1.00 21.53 C ATOM 1804 CE3 TRP A 193 1.623 29.638 33.522 1.00 18.58 C ATOM 1805 CZ2 TRP A 193 -0.174 29.999 31.363 1.00 21.13 C ATOM 1806 CZ3 TRP A 193 1.637 28.789 32.424 1.00 19.00 C ATOM 1807 CH2 TRP A 193 0.751 28.985 31.363 1.00 22.08 C ATOM 1808 HE1 TRP A 193 -1.746 32.295 32.104 1.00 0.00 H ATOM 1809 H TRP A 193 2.141 31.703 38.144 1.00 0.00 H ATOM 1810 N GLY A 194 -0.730 29.226 36.226 1.00 25.40 N ATOM 1811 CA GLY A 194 -0.835 27.805 35.871 1.00 26.93 C ATOM 1812 C GLY A 194 -0.575 26.857 37.028 1.00 25.44 C ATOM 1813 O GLY A 194 -0.963 27.140 38.152 1.00 28.90 O ATOM 1814 H GLY A 194 -1.556 29.843 36.089 1.00 0.00 H ATOM 1815 N MET A 195 0.085 25.736 36.738 1.00 26.46 N ATOM 1816 CA MET A 195 0.421 24.723 37.736 1.00 27.30 C ATOM 1817 C MET A 195 1.844 24.938 38.191 1.00 27.09 C ATOM 1818 O MET A 195 2.786 24.371 37.628 1.00 26.94 O ATOM 1819 CB MET A 195 0.269 23.307 37.159 1.00 31.88 C ATOM 1820 CG MET A 195 -1.108 23.023 36.572 1.00 35.51 C ATOM 1821 SD MET A 195 -1.313 21.353 35.893 1.00 41.93 S ATOM 1822 CE MET A 195 -1.232 20.345 37.379 1.00 45.05 C ATOM 1823 H MET A 195 0.375 25.574 35.753 1.00 0.00 H ATOM 1824 N GLY A 196 2.000 25.790 39.200 1.00 26.28 N ATOM 1825 CA GLY A 196 3.311 26.157 39.701 1.00 28.90 C ATOM 1826 C GLY A 196 4.182 26.797 38.625 1.00 24.94 C ATOM 1827 O GLY A 196 5.390 26.674 38.678 1.00 26.86 O ATOM 1828 H GLY A 196 1.156 26.206 39.644 1.00 0.00 H ATOM 1829 N GLY A 197 3.574 27.465 37.639 1.00 21.50 N ATOM 1830 CA GLY A 197 4.328 28.132 36.567 1.00 21.35 C ATOM 1831 C GLY A 197 4.440 27.305 35.294 1.00 19.69 C ATOM 1832 O GLY A 197 5.012 27.768 34.276 1.00 21.64 O ATOM 1833 H GLY A 197 2.535 27.514 37.630 1.00 0.00 H ATOM 1834 N TYR A 198 3.878 26.093 35.359 1.00 21.28 N ATOM 1835 CA TYR A 198 3.841 25.143 34.242 1.00 20.26 C ATOM 1836 C TYR A 198 2.454 25.066 33.604 1.00 18.91 C ATOM 1837 O TYR A 198 1.450 25.404 34.223 1.00 23.95 O ATOM 1838 CB TYR A 198 4.261 23.737 34.726 1.00 22.27 C ATOM 1839 CG TYR A 198 5.742 23.630 34.957 1.00 22.11 C ATOM 1840 CD1 TYR A 198 6.324 24.119 36.112 1.00 24.08 C ATOM 1841 CD2 TYR A 198 6.573 23.090 33.979 1.00 21.94 C ATOM 1842 CE1 TYR A 198 7.690 24.049 36.306 1.00 26.18 C ATOM 1843 CE2 TYR A 198 7.942 23.040 34.151 1.00 22.14 C ATOM 1844 CZ TYR A 198 8.495 23.517 35.316 1.00 23.29 C ATOM 1845 OH TYR A 198 9.845 23.452 35.500 1.00 26.57 O ATOM 1846 HH TYR A 198 10.075 23.835 36.383 1.00 0.00 H ATOM 1847 H TYR A 198 3.440 25.806 36.258 1.00 0.00 H ATOM 1848 N VAL A 199 2.413 24.611 32.362 1.00 20.41 N ATOM 1849 CA VAL A 199 1.182 24.321 31.646 1.00 20.22 C ATOM 1850 C VAL A 199 1.333 22.987 30.905 1.00 21.51 C ATOM 1851 O VAL A 199 2.381 22.699 30.317 1.00 23.17 O ATOM 1852 CB VAL A 199 0.783 25.476 30.655 1.00 20.31 C ATOM 1853 CG1 VAL A 199 1.973 25.880 29.707 1.00 22.44 C ATOM 1854 CG2 VAL A 199 -0.466 25.124 29.836 1.00 21.63 C ATOM 1855 H VAL A 199 3.315 24.452 31.869 1.00 0.00 H ATOM 1856 N LYS A 200 0.320 22.135 31.058 1.00 21.57 N ATOM 1857 CA LYS A 200 0.209 20.903 30.301 1.00 22.11 C ATOM 1858 C LYS A 200 -0.556 21.250 29.041 1.00 21.92 C ATOM 1859 O LYS A 200 -1.760 21.506 29.078 1.00 25.64 O ATOM 1860 CB LYS A 200 -0.509 19.814 31.104 1.00 23.39 C ATOM 1861 CG LYS A 200 0.329 19.259 32.260 1.00 27.41 C ATOM 1862 CD LYS A 200 -0.294 18.010 32.898 1.00 28.75 C ATOM 1863 CE LYS A 200 -1.605 18.310 33.617 1.00 31.44 C ATOM 1864 NZ LYS A 200 -1.935 17.329 34.723 1.00 31.75 N ATOM 1865 HZ1 LYS A 200 -2.013 16.372 34.324 1.00 0.00 H ATOM 1866 HZ2 LYS A 200 -1.180 17.347 35.438 1.00 0.00 H ATOM 1867 HZ3 LYS A 200 -2.838 17.597 35.164 1.00 0.00 H ATOM 1868 H LYS A 200 -0.422 22.363 31.750 1.00 0.00 H ATOM 1869 N MET A 201 0.175 21.306 27.917 1.00 21.78 N ATOM 1870 CA MET A 201 -0.362 21.707 26.609 1.00 21.96 C ATOM 1871 C MET A 201 -0.781 20.482 25.799 1.00 21.06 C ATOM 1872 O MET A 201 -0.088 19.462 25.850 1.00 20.87 O ATOM 1873 CB MET A 201 0.706 22.457 25.807 1.00 21.86 C ATOM 1874 CG MET A 201 1.173 23.784 26.404 1.00 22.87 C ATOM 1875 SD MET A 201 0.065 25.165 26.098 1.00 21.84 S ATOM 1876 CE MET A 201 0.341 25.469 24.348 1.00 20.13 C ATOM 1877 H MET A 201 1.181 21.050 27.975 1.00 0.00 H ATOM 1878 N ALA A 202 -1.889 20.582 25.051 1.00 21.41 N ATOM 1879 CA ALA A 202 -2.395 19.461 24.235 1.00 19.79 C ATOM 1880 C ALA A 202 -1.321 18.927 23.294 1.00 20.65 C ATOM 1881 O ALA A 202 -0.714 19.692 22.558 1.00 21.06 O ATOM 1882 CB ALA A 202 -3.657 19.879 23.424 1.00 22.84 C ATOM 1883 H ALA A 202 -2.411 21.482 25.045 1.00 0.00 H ATOM 1884 N LYS A 203 -1.078 17.617 23.370 1.00 22.38 N ATOM 1885 CA LYS A 203 -0.107 16.924 22.512 1.00 22.10 C ATOM 1886 C LYS A 203 -0.797 15.972 21.517 1.00 23.19 C ATOM 1887 O LYS A 203 -1.775 15.317 21.856 1.00 24.57 O ATOM 1888 CB LYS A 203 0.895 16.154 23.389 1.00 22.17 C ATOM 1889 CG LYS A 203 1.902 15.293 22.627 1.00 20.82 C ATOM 1890 CD LYS A 203 3.030 14.821 23.573 1.00 19.67 C ATOM 1891 CE LYS A 203 3.978 13.846 22.906 1.00 22.31 C ATOM 1892 NZ LYS A 203 3.341 12.546 22.651 1.00 25.41 N ATOM 1893 HZ1 LYS A 203 3.029 12.132 23.552 1.00 0.00 H ATOM 1894 HZ2 LYS A 203 2.520 12.680 22.027 1.00 0.00 H ATOM 1895 HZ3 LYS A 203 4.025 11.910 22.194 1.00 0.00 H ATOM 1896 H LYS A 203 -1.603 17.058 24.073 1.00 0.00 H ATOM 1897 N ASP A 204 -0.255 15.916 20.299 1.00 21.96 N ATOM 1898 CA ASP A 204 -0.761 15.095 19.177 1.00 22.19 C ATOM 1899 C ASP A 204 -2.196 15.456 18.759 1.00 21.99 C ATOM 1900 O ASP A 204 -2.987 14.602 18.369 1.00 23.38 O ATOM 1901 CB ASP A 204 -0.553 13.614 19.484 1.00 22.45 C ATOM 1902 CG ASP A 204 0.920 13.287 19.685 1.00 26.42 C ATOM 1903 OD1 ASP A 204 1.751 13.899 18.972 1.00 26.23 O ATOM 1904 OD2 ASP A 204 1.253 12.447 20.551 1.00 29.04 O ATOM 1905 H ASP A 204 0.591 16.496 20.124 1.00 0.00 H ATOM 1906 N ARG A 205 -2.491 16.756 18.830 1.00 25.25 N ATOM 1907 CA ARG A 205 -3.738 17.309 18.335 1.00 24.76 C ATOM 1908 C ARG A 205 -3.436 18.377 17.268 1.00 22.97 C ATOM 1909 O ARG A 205 -3.707 19.576 17.458 1.00 27.87 O ATOM 1910 CB ARG A 205 -4.597 17.858 19.489 1.00 28.14 C ATOM 1911 CG ARG A 205 -5.053 16.781 20.499 1.00 28.58 C ATOM 1912 CD ARG A 205 -6.089 17.292 21.509 1.00 30.19 C ATOM 1913 NE ARG A 205 -7.377 17.581 20.872 1.00 35.24 N ATOM 1914 CZ ARG A 205 -8.459 18.024 21.518 1.00 34.94 C ATOM 1915 NH1 ARG A 205 -8.424 18.245 22.832 1.00 31.69 N ATOM 1916 NH2 ARG A 205 -9.583 18.255 20.848 1.00 41.07 N ATOM 1917 HE ARG A 205 -7.454 17.431 19.846 1.00 0.00 H ATOM 1918 HH12 ARG A 205 -9.273 18.590 23.324 1.00 0.00 H ATOM 1919 HH11 ARG A 205 -7.548 18.073 23.365 1.00 0.00 H ATOM 1920 HH22 ARG A 205 -10.426 18.600 21.350 1.00 0.00 H ATOM 1921 HH21 ARG A 205 -9.620 18.091 19.822 1.00 0.00 H ATOM 1922 H ARG A 205 -1.797 17.401 19.259 1.00 0.00 H ATOM 1923 N ARG A 206 -2.864 17.901 16.153 1.00 23.91 N ATOM 1924 CA ARG A 206 -2.562 18.717 14.977 1.00 25.88 C ATOM 1925 C ARG A 206 -1.684 19.918 15.315 1.00 24.95 C ATOM 1926 O ARG A 206 -1.956 21.047 14.898 1.00 25.92 O ATOM 1927 CB ARG A 206 -3.853 19.157 14.265 1.00 27.77 C ATOM 1928 CG ARG A 206 -4.742 17.990 13.819 1.00 29.58 C ATOM 1929 CD ARG A 206 -5.900 18.443 12.918 1.00 31.57 C ATOM 1930 NE ARG A 206 -5.442 19.331 11.850 1.00 36.58 N ATOM 1931 CZ ARG A 206 -5.682 20.639 11.814 1.00 36.35 C ATOM 1932 NH1 ARG A 206 -6.390 21.211 12.783 1.00 33.77 N ATOM 1933 NH2 ARG A 206 -5.224 21.370 10.807 1.00 39.06 N ATOM 1934 HE ARG A 206 -4.895 18.914 11.070 1.00 0.00 H ATOM 1935 HH12 ARG A 206 -6.578 22.233 12.755 1.00 0.00 H ATOM 1936 HH11 ARG A 206 -6.756 20.636 13.569 1.00 0.00 H ATOM 1937 HH22 ARG A 206 -5.412 22.393 10.779 1.00 0.00 H ATOM 1938 HH21 ARG A 206 -4.677 20.921 10.045 1.00 0.00 H ATOM 1939 H ARG A 206 -2.620 16.890 16.122 1.00 0.00 H ATOM 1940 N ASN A 207 -0.615 19.663 16.062 1.00 24.29 N ATOM 1941 CA ASN A 207 0.372 20.703 16.381 1.00 21.76 C ATOM 1942 C ASN A 207 -0.307 21.908 17.033 1.00 21.60 C ATOM 1943 O ASN A 207 -0.219 23.039 16.551 1.00 21.82 O ATOM 1944 CB ASN A 207 1.138 21.101 15.116 1.00 22.08 C ATOM 1945 CG ASN A 207 2.318 22.001 15.412 1.00 19.69 C ATOM 1946 OD1 ASN A 207 2.812 22.035 16.550 1.00 19.40 O ATOM 1947 ND2 ASN A 207 2.765 22.745 14.412 1.00 22.59 N ATOM 1948 HD22 ASN A 207 2.317 22.681 13.476 1.00 0.00 H ATOM 1949 HD21 ASN A 207 3.564 23.394 14.563 1.00 0.00 H ATOM 1950 H ASN A 207 -0.473 18.701 16.431 1.00 0.00 H ATOM 1951 N HIS A 208 -0.958 21.638 18.154 1.00 21.60 N ATOM 1952 CA HIS A 208 -1.768 22.630 18.794 1.00 21.06 C ATOM 1953 C HIS A 208 -0.933 23.787 19.319 1.00 22.00 C ATOM 1954 O HIS A 208 0.093 23.587 19.983 1.00 20.96 O ATOM 1955 CB HIS A 208 -2.552 22.024 19.929 1.00 22.06 C ATOM 1956 CG HIS A 208 -3.697 22.874 20.334 1.00 22.91 C ATOM 1957 ND1 HIS A 208 -4.706 23.202 19.455 1.00 24.64 N ATOM 1958 CD2 HIS A 208 -3.969 23.518 21.490 1.00 23.14 C ATOM 1959 CE1 HIS A 208 -5.573 23.984 20.065 1.00 25.22 C ATOM 1960 NE2 HIS A 208 -5.146 24.200 21.298 1.00 22.98 N ATOM 1961 H HIS A 208 -0.880 20.691 18.576 1.00 0.00 H ATOM 1962 N CYS A 209 -1.396 24.990 18.994 1.00 22.34 N ATOM 1963 CA CYS A 209 -0.717 26.242 19.319 1.00 20.73 C ATOM 1964 C CYS A 209 0.674 26.385 18.694 1.00 15.89 C ATOM 1965 O CYS A 209 1.418 27.275 19.070 1.00 20.33 O ATOM 1966 CB CYS A 209 -0.684 26.492 20.832 1.00 22.01 C ATOM 1967 SG CYS A 209 -2.333 26.604 21.607 1.00 26.27 S ATOM 1968 H CYS A 209 -2.297 25.043 18.477 1.00 0.00 H ATOM 1969 N GLY A 210 0.995 25.561 17.698 1.00 20.85 N ATOM 1970 CA GLY A 210 2.241 25.697 16.950 1.00 19.02 C ATOM 1971 C GLY A 210 3.466 25.240 17.707 1.00 16.88 C ATOM 1972 O GLY A 210 4.577 25.624 17.373 1.00 17.35 O ATOM 1973 H GLY A 210 0.337 24.796 17.445 1.00 0.00 H ATOM 1974 N ILE A 211 3.252 24.429 18.739 1.00 17.92 N ATOM 1975 CA ILE A 211 4.335 24.018 19.651 1.00 16.91 C ATOM 1976 C ILE A 211 5.523 23.332 18.938 1.00 16.91 C ATOM 1977 O ILE A 211 6.670 23.477 19.381 1.00 15.84 O ATOM 1978 CB ILE A 211 3.791 23.171 20.839 1.00 18.73 C ATOM 1979 CG1 ILE A 211 4.807 23.184 22.009 1.00 19.52 C ATOM 1980 CG2 ILE A 211 3.398 21.758 20.378 1.00 19.67 C ATOM 1981 CD1 ILE A 211 4.244 22.805 23.393 1.00 21.44 C ATOM 1982 H ILE A 211 2.290 24.073 18.908 1.00 0.00 H ATOM 1983 N ALA A 212 5.266 22.656 17.808 1.00 16.66 N ATOM 1984 CA ALA A 212 6.339 21.995 17.036 1.00 16.49 C ATOM 1985 C ALA A 212 6.846 22.832 15.848 1.00 16.62 C ATOM 1986 O ALA A 212 7.741 22.389 15.117 1.00 20.49 O ATOM 1987 CB ALA A 212 5.896 20.602 16.557 1.00 18.18 C ATOM 1988 H ALA A 212 4.286 22.596 17.466 1.00 0.00 H ATOM 1989 N SER A 213 6.289 24.034 15.658 1.00 16.07 N ATOM 1990 CA SER A 213 6.572 24.838 14.466 1.00 16.31 C ATOM 1991 C SER A 213 7.903 25.602 14.493 1.00 17.18 C ATOM 1992 O SER A 213 8.435 25.951 13.450 1.00 19.41 O ATOM 1993 CB SER A 213 5.425 25.815 14.188 1.00 19.57 C ATOM 1994 OG SER A 213 4.231 25.145 13.853 1.00 22.26 O ATOM 1995 HG SER A 213 3.518 25.810 13.682 1.00 0.00 H ATOM 1996 H SER A 213 5.637 24.408 16.377 1.00 0.00 H ATOM 1997 N ALA A 214 8.436 25.870 15.675 1.00 17.12 N ATOM 1998 CA ALA A 214 9.689 26.607 15.808 1.00 16.25 C ATOM 1999 C ALA A 214 10.419 26.173 17.080 1.00 17.52 C ATOM 2000 O ALA A 214 10.666 26.971 18.012 1.00 17.04 O ATOM 2001 CB ALA A 214 9.453 28.157 15.731 1.00 18.37 C ATOM 2002 H ALA A 214 7.948 25.546 16.534 1.00 0.00 H ATOM 2003 N ALA A 215 10.777 24.891 17.094 1.00 13.97 N ATOM 2004 CA ALA A 215 11.399 24.236 18.272 1.00 14.72 C ATOM 2005 C ALA A 215 12.894 24.122 17.999 1.00 14.68 C ATOM 2006 O ALA A 215 13.301 23.809 16.861 1.00 14.65 O ATOM 2007 CB ALA A 215 10.799 22.836 18.485 1.00 16.85 C ATOM 2008 H ALA A 215 10.613 24.321 16.239 1.00 0.00 H ATOM 2009 N SER A 216 13.717 24.447 18.986 1.00 14.16 N ATOM 2010 CA SER A 216 15.164 24.400 18.798 1.00 16.17 C ATOM 2011 C SER A 216 15.881 24.238 20.131 1.00 14.20 C ATOM 2012 O SER A 216 15.288 24.376 21.170 1.00 13.55 O ATOM 2013 CB SER A 216 15.655 25.662 18.112 1.00 16.65 C ATOM 2014 OG SER A 216 15.486 26.784 18.969 1.00 16.66 O ATOM 2015 HG SER A 216 15.810 27.600 18.511 1.00 0.00 H ATOM 2016 H SER A 216 13.327 24.739 19.905 1.00 0.00 H ATOM 2017 N TYR A 217 17.166 23.917 20.082 1.00 13.66 N ATOM 2018 CA TYR A 217 17.999 23.833 21.280 1.00 13.87 C ATOM 2019 C TYR A 217 19.439 24.124 20.887 1.00 12.95 C ATOM 2020 O TYR A 217 19.820 23.994 19.695 1.00 14.18 O ATOM 2021 CB TYR A 217 17.892 22.430 21.901 1.00 15.54 C ATOM 2022 CG TYR A 217 18.381 21.284 21.001 1.00 16.28 C ATOM 2023 CD1 TYR A 217 17.519 20.634 20.113 1.00 17.30 C ATOM 2024 CD2 TYR A 217 19.701 20.838 21.064 1.00 19.46 C ATOM 2025 CE1 TYR A 217 17.961 19.597 19.304 1.00 18.35 C ATOM 2026 CE2 TYR A 217 20.157 19.796 20.265 1.00 19.85 C ATOM 2027 CZ TYR A 217 19.280 19.166 19.395 1.00 20.12 C ATOM 2028 OH TYR A 217 19.726 18.115 18.624 1.00 22.36 O ATOM 2029 HH TYR A 217 18.982 17.780 18.063 1.00 0.00 H ATOM 2030 H TYR A 217 17.597 23.718 19.157 1.00 0.00 H ATOM 2031 N PRO A 218 20.256 24.562 21.855 1.00 13.36 N ATOM 2032 CA PRO A 218 21.671 24.861 21.594 1.00 13.85 C ATOM 2033 C PRO A 218 22.534 23.601 21.630 1.00 13.28 C ATOM 2034 O PRO A 218 22.267 22.670 22.403 1.00 15.88 O ATOM 2035 CB PRO A 218 22.034 25.771 22.776 1.00 13.54 C ATOM 2036 CG PRO A 218 21.181 25.255 23.887 1.00 15.49 C ATOM 2037 CD PRO A 218 19.890 24.841 23.260 1.00 14.77 C ATOM 2038 N THR A 219 23.582 23.592 20.836 1.00 15.74 N ATOM 2039 CA THR A 219 24.617 22.565 20.938 1.00 17.56 C ATOM 2040 C THR A 219 25.721 23.113 21.839 1.00 18.15 C ATOM 2041 O THR A 219 26.000 24.306 21.811 1.00 20.26 O ATOM 2042 CB THR A 219 25.168 22.170 19.541 1.00 22.62 C ATOM 2043 OG1 THR A 219 25.668 23.323 18.852 1.00 20.36 O ATOM 2044 CG2 THR A 219 24.087 21.510 18.669 1.00 21.44 C ATOM 2045 HG1 THR A 219 26.398 23.732 19.382 1.00 0.00 H ATOM 2046 H THR A 219 23.677 24.336 20.116 1.00 0.00 H ATOM 2047 N VAL A 220 26.318 22.253 22.662 1.00 22.92 N ATOM 2048 CA VAL A 220 27.326 22.704 23.629 1.00 25.48 C ATOM 2049 C VAL A 220 28.619 21.887 23.533 1.00 29.92 C ATOM 2050 O VAL A 220 28.629 20.815 22.920 1.00 34.21 O ATOM 2051 CB VAL A 220 26.793 22.705 25.098 1.00 26.99 C ATOM 2052 CG1 VAL A 220 25.620 23.692 25.236 1.00 23.50 C ATOM 2053 CG2 VAL A 220 26.381 21.296 25.554 1.00 30.06 C ATOM 2054 OXT VAL A 220 29.685 22.292 24.044 1.00 36.29 O ATOM 2055 H VAL A 220 26.066 21.245 22.619 1.00 0.00 H TER 2056 VAL A 220 HETATM 2057 O HOH 1 19.353 48.856 22.890 1.00 21.14 O HETATM 2058 O HOH 2 11.986 11.083 34.873 1.00 45.13 O HETATM 2059 O HOH 3 10.983 24.351 37.456 1.00 30.58 O HETATM 2060 O HOH 4 10.458 29.844 41.534 1.00 34.14 O HETATM 2061 O HOH 5 26.058 36.906 14.491 1.00 31.46 O HETATM 2062 O HOH 6 10.045 44.327 18.724 1.00 37.67 O HETATM 2063 O HOH 7 21.852 45.634 33.137 1.00 33.00 O HETATM 2064 O HOH 8 13.928 47.022 24.930 1.00 29.55 O HETATM 2065 O HOH 9 2.695 9.313 25.919 1.00 32.34 O HETATM 2066 O HOH 10 19.765 45.025 23.761 1.00 31.15 O HETATM 2067 O HOH 11 7.066 25.383 40.106 1.00 32.27 O HETATM 2068 O HOH 12 6.874 48.203 35.460 1.00 47.38 O HETATM 2069 O HOH 13 31.990 29.812 29.831 1.00 45.81 O HETATM 2070 O HOH 14 -3.569 31.751 35.513 1.00 36.66 O HETATM 2071 O HOH 15 22.251 17.606 18.817 1.00 25.77 O HETATM 2072 O HOH 16 19.320 38.080 34.434 1.00 21.04 O HETATM 2073 O HOH 17 21.088 12.691 31.841 1.00 44.57 O HETATM 2074 O HOH 18 -2.986 35.460 34.566 1.00 39.09 O HETATM 2075 O HOH 19 16.441 46.563 22.086 1.00 42.09 O HETATM 2076 O HOH 20 -6.564 17.983 24.640 1.00 37.10 O HETATM 2077 O HOH 21 9.256 31.576 28.667 1.00 21.97 O HETATM 2078 O HOH 22 0.569 16.369 15.263 1.00 34.57 O HETATM 2079 O HOH 23 28.439 40.845 25.055 1.00 22.30 O HETATM 2080 O HOH 24 11.243 8.915 30.928 1.00 36.43 O HETATM 2081 O HOH 25 21.752 43.392 36.246 1.00 29.20 O HETATM 2082 O HOH 26 17.247 13.910 18.810 1.00 34.30 O HETATM 2083 O HOH 27 30.114 32.738 16.043 1.00 36.81 O HETATM 2084 O HOH 28 11.525 25.101 12.650 1.00 40.22 O HETATM 2085 O HOH 29 22.651 32.094 13.042 1.00 24.21 O HETATM 2086 O HOH 30 27.078 23.791 34.118 1.00 28.51 O HETATM 2087 O HOH 31 26.529 26.294 33.449 1.00 23.31 O HETATM 2088 O HOH 32 1.577 24.516 9.997 1.00 37.07 O HETATM 2089 O HOH 33 20.216 10.791 24.375 1.00 42.22 O HETATM 2090 O HOH 34 6.267 45.870 36.881 1.00 39.99 O HETATM 2091 O HOH 35 4.346 13.328 19.412 1.00 28.40 O HETATM 2092 O HOH 36 28.941 33.300 38.450 1.00 33.86 O HETATM 2093 O HOH 37 13.527 47.366 21.994 1.00 38.27 O HETATM 2094 O HOH 38 23.059 20.063 22.730 1.00 28.26 O HETATM 2095 O HOH 39 27.021 42.288 22.516 1.00 32.71 O HETATM 2096 O HOH 40 4.324 36.683 25.485 1.00 38.00 O HETATM 2097 O HOH 41 -3.753 14.140 23.780 1.00 33.16 O HETATM 2098 O HOH 42 33.413 35.607 26.388 1.00 23.89 O HETATM 2099 O HOH 43 21.392 47.489 25.419 1.00 35.61 O HETATM 2100 O HOH 44 36.829 40.536 33.272 1.00 35.52 O HETATM 2101 O HOH 45 36.446 33.285 36.487 1.00 35.35 O HETATM 2102 O HOH 46 25.549 29.071 14.680 1.00 22.71 O HETATM 2103 O HOH 47 4.120 24.512 11.216 1.00 36.35 O HETATM 2104 O HOH 48 17.825 16.428 17.662 1.00 28.58 O HETATM 2105 O HOH 49 29.974 24.974 24.379 1.00 44.77 O HETATM 2106 O HOH 50 0.123 22.362 22.438 1.00 23.98 O HETATM 2107 O HOH 51 8.157 10.381 17.539 1.00 36.40 O HETATM 2108 O HOH 52 23.154 24.103 33.964 1.00 21.66 O HETATM 2109 O HOH 53 10.300 23.249 14.749 1.00 22.67 O HETATM 2110 O HOH 54 -3.399 27.075 12.343 1.00 36.53 O HETATM 2111 O HOH 55 13.771 15.026 16.250 1.00 24.55 O HETATM 2112 O HOH 56 18.066 21.505 27.353 1.00 17.60 O HETATM 2113 O HOH 57 12.741 28.560 30.402 1.00 19.62 O HETATM 2114 O HOH 58 21.564 14.244 24.730 1.00 37.13 O HETATM 2115 O HOH 59 9.723 46.083 33.976 1.00 36.93 O HETATM 2116 O HOH 60 23.228 38.259 42.730 1.00 38.21 O HETATM 2117 O HOH 61 7.511 25.878 18.341 1.00 15.87 O HETATM 2118 O HOH 62 16.109 23.510 31.721 1.00 17.40 O HETATM 2119 O HOH 63 17.294 19.231 12.480 1.00 34.88 O HETATM 2120 O HOH 64 14.793 21.812 10.846 1.00 40.56 O HETATM 2121 O HOH 65 13.097 28.164 18.537 1.00 19.86 O HETATM 2122 O HOH 66 31.465 27.891 20.852 1.00 29.79 O HETATM 2123 O HOH 67 13.193 29.403 32.860 1.00 20.63 O HETATM 2124 O HOH 68 29.172 21.039 19.853 1.00 44.45 O HETATM 2125 O HOH 69 23.777 22.839 14.519 1.00 30.93 O HETATM 2126 O HOH 70 -10.905 37.556 25.860 1.00 40.03 O HETATM 2127 O HOH 71 15.879 29.878 32.649 1.00 20.05 O HETATM 2128 O HOH 72 10.725 30.300 34.105 1.00 20.23 O HETATM 2129 O HOH 73 -3.062 10.314 19.811 1.00 32.64 O HETATM 2130 O HOH 74 31.938 30.515 21.400 1.00 29.30 O HETATM 2131 O HOH 75 15.486 25.610 33.445 1.00 18.97 O HETATM 2132 O HOH 76 -0.910 19.094 19.693 1.00 21.11 O HETATM 2133 O HOH 77 1.310 13.912 16.224 1.00 36.34 O HETATM 2134 O HOH 78 4.711 6.510 31.555 1.00 43.01 O HETATM 2135 O HOH 79 29.989 39.557 21.667 1.00 35.92 O HETATM 2136 O HOH 80 30.485 26.387 33.640 1.00 38.78 O HETATM 2137 O HOH 81 20.454 19.253 39.192 1.00 30.99 O HETATM 2138 O HOH 82 -3.347 30.714 23.356 1.00 31.31 O HETATM 2139 O HOH 83 10.203 29.191 29.585 1.00 18.32 O HETATM 2140 O HOH 84 22.090 16.865 23.782 1.00 27.24 O HETATM 2141 O HOH 85 31.095 43.821 27.933 1.00 31.52 O HETATM 2142 O HOH 86 25.764 19.540 22.281 1.00 44.53 O HETATM 2143 O HOH 87 13.117 25.624 14.738 1.00 23.85 O HETATM 2144 O HOH 88 -2.355 35.334 27.039 1.00 37.65 O HETATM 2145 O HOH 89 -7.318 26.253 33.448 1.00 39.79 O HETATM 2146 O HOH 90 0.287 27.950 40.664 1.00 40.59 O HETATM 2147 O HOH 91 7.114 33.055 41.210 1.00 31.51 O HETATM 2148 O HOH 92 23.841 26.648 33.067 1.00 18.84 O HETATM 2149 O HOH 93 15.259 29.881 38.755 1.00 29.06 O HETATM 2150 O HOH 94 32.721 39.154 24.450 1.00 32.26 O HETATM 2151 O HOH 95 10.160 40.081 37.330 1.00 35.27 O HETATM 2152 O HOH 96 -4.563 16.243 24.519 1.00 34.16 O HETATM 2153 O HOH 97 26.012 22.844 16.101 1.00 28.76 O HETATM 2154 O HOH 98 21.488 35.754 14.869 1.00 20.93 O HETATM 2155 O HOH 99 9.579 26.600 40.494 1.00 30.40 O HETATM 2156 O HOH 100 9.374 33.245 39.608 1.00 32.75 O HETATM 2157 O HOH 101 0.429 38.606 19.891 1.00 42.01 O HETATM 2158 O HOH 102 13.142 48.208 28.725 1.00 35.10 O HETATM 2159 O HOH 103 6.896 35.742 40.586 1.00 35.32 O HETATM 2160 O HOH 104 -7.571 8.881 37.992 1.00 26.34 O HETATM 2161 O HOH 105 15.935 23.073 40.292 1.00 35.58 O HETATM 2162 O HOH 106 -4.128 22.877 14.992 1.00 38.92 O HETATM 2163 O HOH 107 19.350 38.569 12.809 1.00 27.49 O HETATM 2164 O HOH 108 5.180 30.745 34.692 1.00 21.01 O HETATM 2165 O HOH 109 24.613 18.722 26.428 1.00 34.09 O HETATM 2166 O HOH 110 35.479 33.445 30.018 1.00 32.49 O HETATM 2167 O HOH 111 -4.433 12.614 19.800 1.00 39.74 O HETATM 2168 O HOH 112 -8.140 24.147 27.925 1.00 41.73 O HETATM 2169 O HOH 113 -4.904 11.554 23.888 1.00 34.53 O HETATM 2170 O HOH 114 8.091 28.341 11.933 1.00 40.55 O HETATM 2171 O HOH 115 25.104 15.948 38.675 1.00 38.23 O HETATM 2172 O HOH 116 9.434 20.394 16.432 1.00 32.24 O HETATM 2173 O HOH 117 23.285 31.932 38.891 1.00 24.33 O HETATM 2174 O HOH 118 -7.388 18.166 31.215 1.00 41.24 O HETATM 2175 O HOH 119 5.741 13.317 32.212 1.00 34.18 O HETATM 2176 O HOH 120 2.457 10.664 32.024 1.00 36.02 O HETATM 2177 O HOH 121 22.157 44.667 22.413 1.00 19.78 O HETATM 2178 O HOH 122 34.675 33.188 27.471 1.00 32.67 O HETATM 2179 O HOH 123 2.780 17.725 14.156 1.00 39.37 O HETATM 2180 O HOH 124 18.436 44.142 16.798 1.00 30.64 O HETATM 2181 O HOH 125 4.497 37.008 16.931 1.00 37.29 O HETATM 2182 O HOH 126 30.619 44.228 33.698 1.00 43.67 O HETATM 2183 O HOH 127 -11.818 39.837 26.830 1.00 38.66 O HETATM 2184 O HOH 128 5.523 40.789 29.785 1.00 33.38 O HETATM 2185 O HOH 129 4.750 32.626 14.002 1.00 40.31 O HETATM 2186 O HOH 130 8.717 16.324 38.399 1.00 35.56 O HETATM 2187 O HOH 131 12.939 36.478 36.983 1.00 36.51 O HETATM 2188 O HOH 132 1.529 22.206 11.844 1.00 29.71 O HETATM 2189 O HOH 133 1.429 43.273 34.817 1.00 47.24 O HETATM 2190 O HOH 134 22.408 50.657 32.303 1.00 47.18 O HETATM 2191 O HOH 135 2.458 11.975 25.378 1.00 29.04 O HETATM 2192 O HOH 136 10.255 20.671 9.049 1.00 28.89 O HETATM 2193 O HOH 137 -11.054 14.262 26.503 1.00 49.08 O HETATM 2194 O HOH 138 21.888 28.386 40.058 1.00 31.21 O HETATM 2195 O HOH 139 -3.312 25.107 16.791 1.00 31.44 O HETATM 2196 O HOH 140 -9.498 32.817 25.090 1.00 35.89 O HETATM 2197 O HOH 141 18.135 42.113 22.855 1.00 21.39 O HETATM 2198 O HOH 142 0.373 7.878 25.989 1.00 36.67 O HETATM 2199 O HOH 143 24.549 15.414 33.858 1.00 34.62 O HETATM 2200 O HOH 144 15.458 41.072 13.937 1.00 37.11 O HETATM 2201 O HOH 145 32.873 31.984 35.731 1.00 34.07 O HETATM 2202 O HOH 146 12.112 11.475 32.328 1.00 34.50 O HETATM 2203 O HOH 147 13.304 31.334 40.325 1.00 32.96 O HETATM 2204 O HOH 148 19.255 22.853 12.384 1.00 28.67 O HETATM 2205 O HOH 149 8.311 44.231 35.494 1.00 31.15 O HETATM 2206 O HOH 150 -7.358 16.686 17.360 1.00 83.09 O HETATM 2207 O HOH 151 25.335 30.876 40.306 1.00 29.98 O HETATM 2208 O HOH 152 25.070 48.133 25.149 1.00 39.92 O HETATM 2209 O HOH 153 6.194 7.078 23.295 1.00 41.96 O HETATM 2210 O HOH 154 24.123 21.491 40.342 1.00 34.23 O HETATM 2211 O HOH 155 10.387 46.724 30.394 1.00 38.46 O HETATM 2212 O HOH 156 28.566 26.737 14.397 1.00 39.23 O HETATM 2213 O HOH 157 4.616 37.644 28.249 1.00 37.97 O HETATM 2214 O HOH 158 30.036 30.170 23.705 1.00 18.77 O HETATM 2215 O HOH 159 13.553 28.122 15.629 1.00 30.06 O HETATM 2216 O HOH 160 18.419 45.038 21.310 1.00 28.34 O HETATM 2217 O HOH 161 24.118 26.634 14.520 1.00 21.14 O HETATM 2218 O HOH 162 32.350 32.585 17.721 1.00 39.02 O HETATM 2219 O HOH 163 28.185 41.321 34.881 1.00 45.50 O HETATM 2220 O HOH 164 18.394 37.551 38.896 1.00 35.97 O HETATM 2221 O HOH 165 15.296 36.057 35.983 1.00 32.28 O HETATM 2222 O HOH 166 -2.981 29.340 38.656 1.00 31.28 O HETATM 2223 O HOH 167 -9.101 35.396 23.742 1.00 42.56 O HETATM 2224 O HOH 168 31.816 27.631 18.161 1.00 28.92 O HETATM 2225 O HOH 169 13.992 30.780 17.812 1.00 16.23 O HETATM 2226 O HOH 170 2.619 9.749 14.003 1.00 43.07 O HETATM 2227 O HOH 171 3.625 38.360 38.544 1.00 43.23 O HETATM 2228 O HOH 172 3.616 14.656 14.239 1.00 36.16 O HETATM 2229 O HOH 173 5.337 28.940 11.602 1.00 47.29 O HETATM 2230 O HOH 174 35.031 41.702 37.727 1.00 40.91 O HETATM 2231 O HOH 175 29.549 24.927 26.638 1.00 35.18 O HETATM 2232 O HOH 176 33.196 43.477 31.785 1.00 45.69 O HETATM 2233 O HOH 177 20.348 43.480 14.259 1.00 38.97 O HETATM 2234 O HOH 178 8.500 21.994 39.225 1.00 44.25 O HETATM 2235 O HOH 179 7.814 6.491 30.930 1.00 48.18 O HETATM 2236 O HOH 180 5.758 40.267 27.202 1.00 27.82 O HETATM 2237 O HOH 181 -4.517 9.025 23.540 1.00 40.49 O HETATM 2238 O HOH 182 7.739 36.189 13.062 1.00 43.60 O HETATM 2239 O HOH 183 21.841 26.472 12.613 1.00 40.06 O HETATM 2240 O HOH 184 17.064 40.251 12.142 1.00 41.54 O HETATM 2241 O HOH 185 19.715 49.881 26.053 1.00 33.85 O HETATM 2242 O HOH 186 24.800 45.978 23.220 1.00 36.92 O HETATM 2243 O HOH 187 20.504 33.078 14.623 1.00 31.36 O HETATM 2244 O HOH 188 13.774 31.019 14.827 1.00 26.59 O HETATM 2245 O HOH 189 16.120 35.948 38.477 1.00 44.56 O HETATM 2246 O HOH 190 19.974 46.342 17.403 1.00 40.45 O HETATM 2247 O HOH 191 20.972 44.519 38.714 1.00 39.16 O HETATM 2248 O HOH 192 -6.928 12.368 17.934 1.00 38.34 O HETATM 2249 O HOH 193 29.558 24.259 35.208 1.00 34.27 O HETATM 2250 O HOH 194 26.382 24.993 13.860 1.00 45.80 O HETATM 2251 O HOH 195 14.246 7.467 22.615 1.00 36.92 O HETATM 2252 O HOH 196 26.274 43.322 35.718 1.00 46.08 O HETATM 2253 O HOH 197 21.350 32.224 40.754 1.00 44.21 O HETATM 2254 O HOH 198 18.150 50.387 22.080 1.00 24.26 O HETATM 2255 O HOH 199 24.175 33.863 11.695 1.00 43.71 O HETATM 2256 O HOH 200 32.716 43.483 38.398 1.00 36.69 O HETATM 2257 O HOH 201 13.575 8.852 20.358 1.00 36.75 O HETATM 2258 O HOH 202 18.708 11.786 17.695 1.00 31.70 O HETATM 2259 O HOH 203 18.927 15.911 15.262 1.00 37.37 O HETATM 2260 O HOH 204 31.408 32.259 37.807 1.00 40.07 O HETATM 2261 O HOH 205 -2.594 11.150 16.073 1.00 39.14 O HETATM 2262 O HOH 206 32.143 25.266 17.028 1.00 30.29 O HETATM 2263 O HOH 207 23.634 36.564 13.525 1.00 30.06 O HETATM 2264 O HOH 208 -10.118 30.947 31.515 1.00 42.16 O HETATM 2265 O HOH 209 23.135 17.526 21.204 1.00 31.77 O HETATM 2266 O HOH 210 29.789 18.082 19.692 1.00 45.12 O HETATM 2267 O HOH 211 32.373 42.200 23.879 1.00 31.36 O HETATM 2268 O HOH 212 18.827 26.926 40.022 1.00 41.73 O HETATM 2269 O HOH 213 19.502 47.131 19.920 1.00 31.84 O HETATM 2270 O HOH 214 22.142 46.960 21.043 1.00 29.96 O HETATM 2271 O HOH 215 22.183 30.017 11.255 1.00 36.57 O HETATM 2272 O HOH 216 18.395 32.234 13.013 1.00 28.93 O HETATM 2273 O HOH 217 15.647 17.127 15.891 1.00 28.05 O HETATM 2274 O HOH 218 20.458 29.788 41.562 1.00 44.94 O HETATM 2275 O HOH 219 18.260 49.433 20.174 1.00 24.29 O HETATM 2276 O HOH 220 30.230 43.104 25.527 1.00 27.78 O HETATM 2277 O HOH 221 23.909 20.076 14.902 1.00 31.84 O HETATM 2278 O HOH 222 29.073 45.554 24.352 1.00 33.74 O HETATM 2279 N1 UNN A 223 8.508 36.560 19.248 1.00 -0.26 N HETATM 2280 C2 UNN A 223 9.361 35.612 18.559 1.00 0.06 C HETATM 2281 C3 UNN A 223 9.482 34.392 19.513 1.00 0.11 C HETATM 2282 C4 UNN A 223 9.280 34.989 20.886 1.00 0.01 C HETATM 2283 C5 UNN A 223 8.240 36.089 20.594 1.00 0.13 C HETATM 2284 C6 UNN A 223 8.363 37.170 21.683 1.00 0.20 C HETATM 2285 N8 UNN A 223 7.282 37.229 22.500 1.00 -0.30 N HETATM 2286 C10 UNN A 223 7.227 38.068 23.639 1.00 0.08 C HETATM 2287 C11 UNN A 223 7.708 37.412 24.861 1.00 0.04 C HETATM 2288 N12 UNN A 223 7.649 37.928 26.053 1.00 -0.27 N HETATM 2289 H9 UNN A 223 8.002 37.412 26.844 1.00 0.22 H HETATM 2290 H8 UNN A 223 8.146 36.420 24.762 1.00 0.11 H HETATM 2291 C13 UNN A 223 7.443 39.571 23.463 1.00 -0.04 C HETATM 2292 C14 UNN A 223 6.077 39.063 23.779 1.00 -0.04 C HETATM 2293 H12 UNN A 223 5.637 39.255 24.768 1.00 0.02 H HETATM 2294 H13 UNN A 223 5.288 39.100 23.013 1.00 0.02 H HETATM 2295 H10 UNN A 223 7.658 39.980 22.465 1.00 0.02 H HETATM 2296 H11 UNN A 223 8.006 40.136 24.220 1.00 0.02 H HETATM 2297 H7 UNN A 223 6.490 36.656 22.289 1.00 0.18 H HETATM 2298 O9 UNN A 223 9.368 37.877 21.849 1.00 -0.40 O HETATM 2299 H6 UNN A 223 7.224 35.670 20.630 1.00 0.08 H HETATM 2300 H4 UNN A 223 10.214 35.414 21.280 1.00 0.03 H HETATM 2301 H5 UNN A 223 8.889 34.244 21.594 1.00 0.03 H HETATM 2302 S7 UNN A 223 8.337 33.125 19.196 1.00 -0.00 S HETATM 2303 O15 UNN A 223 8.645 32.072 20.089 1.00 -0.17 O HETATM 2304 O16 UNN A 223 7.045 33.716 19.258 1.00 -0.17 O HETATM 2305 C17 UNN A 223 8.639 32.652 17.589 1.00 0.09 C HETATM 2306 C18 UNN A 223 9.757 31.957 17.130 1.00 0.06 C HETATM 2307 C19 UNN A 223 9.956 31.560 15.805 1.00 -0.02 C HETATM 2308 C20 UNN A 223 8.994 31.907 14.856 1.00 0.09 C HETATM 2309 C21 UNN A 223 7.848 32.612 15.258 1.00 -0.03 C HETATM 2310 C22 UNN A 223 7.689 32.972 16.592 1.00 -0.05 C HETATM 2311 H16 UNN A 223 6.800 33.521 16.879 1.00 0.06 H HETATM 2312 H15 UNN A 223 7.089 32.875 14.530 1.00 0.05 H HETATM 2313 O24 UNN A 223 9.271 31.488 13.585 1.00 -0.32 O HETATM 2314 C25 UNN A 223 8.236 31.713 12.625 1.00 0.06 C HETATM 2315 H17 UNN A 223 8.560 31.341 11.642 1.00 0.06 H HETATM 2316 H18 UNN A 223 8.026 32.791 12.558 1.00 0.06 H HETATM 2317 H19 UNN A 223 7.325 31.180 12.936 1.00 0.06 H HETATM 2318 H14 UNN A 223 10.837 30.996 15.521 1.00 0.05 H HETATM 2319 CL2 UNN A 223 10.930 31.508 18.258 1.00 -0.07 CL HETATM 2320 H3 UNN A 223 10.492 33.964 19.434 1.00 0.06 H HETATM 2321 H1 UNN A 223 10.351 36.052 18.371 1.00 0.05 H HETATM 2322 H2 UNN A 223 8.907 35.309 17.604 1.00 0.05 H HETATM 2323 C26 UNN A 223 7.891 37.674 18.738 1.00 0.19 C HETATM 2324 C27 UNN A 223 8.178 38.099 17.323 1.00 0.14 C HETATM 2325 C29 UNN A 223 7.791 37.101 16.168 1.00 -0.03 C HETATM 2326 N30 UNN A 223 6.822 38.085 15.612 1.00 0.22 N HETATM 2327 C31 UNN A 223 7.030 39.009 16.744 1.00 -0.03 C HETATM 2328 H24 UNN A 223 7.368 40.011 16.442 1.00 0.07 H HETATM 2329 H25 UNN A 223 6.158 39.100 17.408 1.00 0.07 H HETATM 2330 H22 UNN A 223 5.880 37.732 15.546 1.00 0.20 H HETATM 2331 H23 UNN A 223 7.100 38.467 14.722 1.00 0.20 H HETATM 2332 H20 UNN A 223 7.326 36.169 16.521 1.00 0.07 H HETATM 2333 H21 UNN A 223 8.622 36.862 15.489 1.00 0.07 H HETATM 2334 C32 UNN A 223 9.529 38.703 17.299 1.00 0.04 C HETATM 2335 N33 UNN A 223 9.801 39.907 17.865 1.00 -0.27 N HETATM 2336 C34 UNN A 223 11.063 40.388 17.762 1.00 0.06 C HETATM 2337 C35 UNN A 223 12.103 39.693 17.113 1.00 0.10 C HETATM 2338 C36 UNN A 223 11.798 38.470 16.538 1.00 0.00 C HETATM 2339 C37 UNN A 223 10.511 37.969 16.625 1.00 -0.01 C HETATM 2340 H28 UNN A 223 10.265 37.014 16.174 1.00 0.09 H HETATM 2341 H27 UNN A 223 12.566 37.907 16.021 1.00 0.08 H HETATM 2342 CL3 UNN A 223 13.688 40.297 17.009 1.00 -0.03 CL HETATM 2343 H26 UNN A 223 11.284 41.355 18.200 1.00 0.09 H HETATM 2344 O28 UNN A 223 7.159 38.358 19.465 1.00 -0.36 O CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 223 222 608 CONECT 538 537 913 CONECT 608 223 607 CONECT 913 538 912 CONECT 1452 1451 1967 CONECT 1620 1621 1627 1628 1629 CONECT 1627 1620 CONECT 1628 1620 CONECT 1629 1620 CONECT 1967 1452 1966 CONECT 2279 2280 2283 2323 CONECT 2280 2279 2281 2321 2322 CONECT 2281 2280 2282 2302 2320 CONECT 2282 2281 2283 2300 2301 CONECT 2283 2279 2282 2284 2299 CONECT 2284 2283 2285 2298 CONECT 2285 2284 2286 2297 CONECT 2286 2285 2287 2291 2292 CONECT 2287 2286 2288 2290 CONECT 2288 2287 2289 CONECT 2289 2288 CONECT 2290 2287 CONECT 2291 2286 2292 2295 2296 CONECT 2292 2286 2291 2293 2294 CONECT 2293 2292 CONECT 2294 2292 CONECT 2295 2291 CONECT 2296 2291 CONECT 2297 2285 CONECT 2298 2284 CONECT 2299 2283 CONECT 2300 2282 CONECT 2301 2282 CONECT 2302 2281 2303 2304 2305 CONECT 2303 2302 CONECT 2304 2302 CONECT 2305 2302 2306 2310 CONECT 2306 2305 2307 2319 CONECT 2307 2306 2308 2318 CONECT 2308 2307 2309 2313 CONECT 2309 2308 2310 2312 CONECT 2310 2305 2309 2311 CONECT 2311 2310 CONECT 2312 2309 CONECT 2313 2308 2314 CONECT 2314 2313 2315 2316 2317 CONECT 2315 2314 CONECT 2316 2314 CONECT 2317 2314 CONECT 2318 2307 CONECT 2319 2306 CONECT 2320 2281 CONECT 2321 2280 CONECT 2322 2280 CONECT 2323 2279 2324 2344 CONECT 2324 2323 2325 2327 2334 CONECT 2325 2324 2326 2332 2333 CONECT 2326 2325 2327 2330 2331 CONECT 2327 2324 2326 2328 2329 CONECT 2328 2327 CONECT 2329 2327 CONECT 2330 2326 CONECT 2331 2326 CONECT 2332 2325 CONECT 2333 2325 CONECT 2334 2324 2335 2339 CONECT 2335 2334 2336 CONECT 2336 2335 2337 2343 CONECT 2337 2336 2338 2342 CONECT 2338 2337 2339 2341 CONECT 2339 2334 2338 2340 CONECT 2340 2339 CONECT 2341 2338 CONECT 2342 2337 CONECT 2343 2336 CONECT 2344 2323 MASTER 0 0 0 0 0 0 0 0 2342 2 80 18 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5f02
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human Cathepsin L
Ligand Name
5T9
EC.Number
E.C.3.4.22.15
Resolution
1.43(Å)
Affinity (Kd/Ki/IC50)
IC50=36nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) J.Med.Chem. Vol. 59: pp. 4087-4102
Ligand Properties
Formula
C
2
5
H
2
8
Cl
2
N
5
O
5
S
Molecular Weight
581.491
Exact Mass
580.119
No. of atoms
66
No. of bonds
70
Polar Surface Area
154.51
LOGP Value
1.19 (
Computed with XLOGP3
)
4.03 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 10
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 5
Canonical SMILES
COc1ccc(c(c1)Cl)S(=O)(=O)[C@@H]1C[C@H](N(C1)C(=O)C1(C[NH2+]C1)c1ccc(cn1)Cl)C(=O)NC1(C=N)CC1
InChI String
InChI=1S/C25H27Cl2N5O5S/c1-37-16-3-4-20(18(27)8-16)38(35,36)17-9-19(22(33)31-24(12-28)6-7-24)32(11-17)23(34)25(13-29-14-25)21-5-2-15(26)10-30-21/h2-5,8,10,12,17,19,28-29H,6-7,9,11,13-14H2,1H3,(H,31,33)/p+1/b28-12+/t17-,19+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P07711
Entrez Gene ID
NCBI Entrez Gene ID:
1514
ASD
Information of known allosteric effects of PDB entries
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