Browse entries in the PDBbind-CN Database
HEADER 5JNC_COMPLEX COMPND 5JNC_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 132 ALA GLU SER HIS TRP CYS TYR GLU VAL GLN ALA GLU SER SEQRES 2 A 132 SER ASN TYR PRO CYS LEU VAL PRO VAL LYS TRP GLY GLY SEQRES 3 A 132 ASN CYS GLN LYS ASP ARG GLN SER PRO ILE ASN ILE VAL SEQRES 4 A 132 THR THR LYS ALA LYS VAL ASP LYS LYS LEU GLY ARG PHE SEQRES 5 A 132 PHE PHE SER GLY TYR ASP LYS LYS GLN THR TRP THR VAL SEQRES 6 A 132 GLN ASN ASN GLY HIS SER VAL MET MET LEU LEU GLU ASN SEQRES 7 A 132 LYS ALA SER ILE SER GLY GLY GLY LEU PRO ALA PRO TYR SEQRES 8 A 132 GLN ALA LYS GLN LEU HIS LEU HIS TRP SER ASP LEU PRO SEQRES 9 A 132 TYR LYS GLY SER GLU HIS SER LEU ASP GLY GLU HIS PHE SEQRES 10 A 132 ALA MET GLU MET HIS ILE VAL HIS GLU LYS GLU LYS GLY SEQRES 11 A 132 THR SER SEQRES 1 A 127 ASP PRO GLU ASP GLU ILE ALA VAL LEU ALA PHE LEU VAL SEQRES 2 A 127 GLU ALA GLY THR GLN VAL ASN GLU GLY PHE GLN PRO LEU SEQRES 3 A 127 VAL GLU ALA LEU SER ASN ILE PRO LYS PRO GLU MET SER SEQRES 4 A 127 THR THR MET ALA GLU SER SER LEU LEU ASP LEU LEU PRO SEQRES 5 A 127 LYS GLU GLU LYS LEU ARG HIS TYR PHE ARG TYR LEU GLY SEQRES 6 A 127 SER LEU THR THR PRO THR CYS ASP GLU LYS VAL VAL TRP SEQRES 7 A 127 THR VAL PHE ARG GLU PRO ILE GLN LEU HIS ARG GLU GLN SEQRES 8 A 127 ILE LEU ALA PHE SER GLN LYS LEU TYR TYR ASP LYS GLU SEQRES 9 A 127 GLN THR VAL SER MET LYS ASP ASN VAL ARG PRO LEU GLN SEQRES 10 A 127 GLN LEU GLY GLN ARG THR VAL ILE LYS SER HET ZN A 1 1 HET MOL A 513 23 SSBOND 1 CYS A 6 CYS A 11G SSBOND 2 CYS A 23 CYS A 203 ATOM 1 N ALA A 1 44.624 -6.042 27.885 1.00 50.98 N ATOM 2 CA ALA A 1 44.906 -5.762 26.456 1.00 46.51 C ATOM 3 C ALA A 1 45.615 -6.942 25.816 1.00 44.66 C ATOM 4 O ALA A 1 46.821 -6.872 25.580 1.00 52.35 O ATOM 5 CB ALA A 1 45.750 -4.494 26.315 1.00 46.37 C ATOM 6 HN3 ALA A 1 45.519 -6.213 28.387 1.00 0.00 H ATOM 7 HN2 ALA A 1 44.017 -6.883 27.959 1.00 0.00 H ATOM 8 HN1 ALA A 1 44.139 -5.225 28.308 1.00 0.00 H ATOM 9 N GLU A 2 44.882 -8.018 25.530 1.00 41.42 N ATOM 10 CA GLU A 2 45.448 -9.141 24.757 1.00 38.92 C ATOM 11 C GLU A 2 45.570 -8.885 23.246 1.00 37.89 C ATOM 12 O GLU A 2 46.308 -9.628 22.576 1.00 34.35 O ATOM 13 CB GLU A 2 44.672 -10.433 24.980 1.00 41.96 C ATOM 14 CG GLU A 2 44.941 -11.058 26.341 1.00 44.32 C ATOM 15 CD GLU A 2 44.659 -12.543 26.385 1.00 47.55 C ATOM 16 OE1 GLU A 2 44.932 -13.155 27.437 1.00 51.28 O ATOM 17 OE2 GLU A 2 44.173 -13.104 25.378 1.00 53.31 O ATOM 18 H GLU A 2 43.896 -8.067 25.857 1.00 0.00 H ATOM 19 N SER A 3 44.837 -7.889 22.712 1.00 31.47 N ATOM 20 CA SER A 3 44.991 -7.432 21.306 1.00 29.70 C ATOM 21 C SER A 3 44.362 -6.051 21.136 1.00 27.76 C ATOM 22 O SER A 3 43.686 -5.552 22.053 1.00 26.47 O ATOM 23 CB SER A 3 44.344 -8.428 20.321 1.00 31.24 C ATOM 24 OG SER A 3 42.955 -8.605 20.602 1.00 30.77 O ATOM 25 HG SER A 3 42.848 -8.955 21.522 1.00 0.00 H ATOM 26 H SER A 3 44.130 -7.418 23.312 1.00 0.00 H ATOM 27 N HIS A 4 44.569 -5.438 19.974 1.00 24.97 N ATOM 28 CA HIS A 4 44.026 -4.079 19.694 1.00 24.89 C ATOM 29 C HIS A 4 42.505 -4.139 19.570 1.00 22.59 C ATOM 30 O HIS A 4 41.943 -5.140 19.068 1.00 19.48 O ATOM 31 CB HIS A 4 44.578 -3.530 18.375 1.00 26.82 C ATOM 32 CG HIS A 4 44.475 -2.046 18.247 1.00 27.95 C ATOM 33 ND1 HIS A 4 43.316 -1.404 17.856 1.00 29.11 N ATOM 34 CD2 HIS A 4 45.390 -1.075 18.452 1.00 28.63 C ATOM 35 CE1 HIS A 4 43.525 -0.103 17.824 1.00 27.78 C ATOM 36 NE2 HIS A 4 44.779 0.119 18.172 1.00 28.98 N ATOM 37 H HIS A 4 45.126 -5.921 19.240 1.00 0.00 H ATOM 38 N TRP A 5 41.846 -3.086 20.043 1.00 20.37 N ATOM 39 CA TRP A 5 40.400 -2.962 19.865 1.00 19.25 C ATOM 40 C TRP A 5 40.046 -2.883 18.373 1.00 19.14 C ATOM 41 O TRP A 5 40.795 -2.312 17.554 1.00 17.75 O ATOM 42 CB TRP A 5 39.846 -1.732 20.604 1.00 18.58 C ATOM 43 CG TRP A 5 40.107 -0.402 19.963 1.00 17.99 C ATOM 44 CD1 TRP A 5 41.148 0.419 20.216 1.00 17.98 C ATOM 45 CD2 TRP A 5 39.292 0.267 18.985 1.00 17.30 C ATOM 46 NE1 TRP A 5 41.040 1.562 19.480 1.00 17.60 N ATOM 47 CE2 TRP A 5 39.912 1.489 18.702 1.00 17.76 C ATOM 48 CE3 TRP A 5 38.089 -0.043 18.342 1.00 17.60 C ATOM 49 CZ2 TRP A 5 39.375 2.417 17.796 1.00 17.36 C ATOM 50 CZ3 TRP A 5 37.560 0.874 17.420 1.00 17.31 C ATOM 51 CH2 TRP A 5 38.205 2.096 17.171 1.00 17.04 C ATOM 52 HE1 TRP A 5 41.706 2.361 19.504 1.00 0.00 H ATOM 53 H TRP A 5 42.366 -2.340 20.547 1.00 0.00 H ATOM 54 N CYS A 6 38.905 -3.456 18.043 1.00 18.80 N ATOM 55 CA CYS A 6 38.391 -3.416 16.703 1.00 19.97 C ATOM 56 C CYS A 6 36.878 -3.384 16.745 1.00 18.42 C ATOM 57 O CYS A 6 36.268 -3.545 17.810 1.00 19.30 O ATOM 58 CB CYS A 6 38.890 -4.630 15.920 1.00 22.76 C ATOM 59 SG CYS A 6 38.266 -6.236 16.492 1.00 25.59 S ATOM 60 H CYS A 6 38.360 -3.953 18.777 1.00 0.00 H ATOM 61 N TYR A 7 36.266 -3.122 15.593 1.00 17.97 N ATOM 62 CA TYR A 7 34.826 -3.335 15.413 1.00 17.70 C ATOM 63 C TYR A 7 34.554 -4.817 15.052 1.00 18.87 C ATOM 64 O TYR A 7 35.445 -5.538 14.583 1.00 17.54 O ATOM 65 CB TYR A 7 34.282 -2.375 14.343 1.00 17.62 C ATOM 66 CG TYR A 7 34.294 -0.914 14.776 1.00 16.62 C ATOM 67 CD1 TYR A 7 33.414 -0.439 15.768 1.00 16.87 C ATOM 68 CD2 TYR A 7 35.167 -0.013 14.204 1.00 16.18 C ATOM 69 CE1 TYR A 7 33.427 0.913 16.151 1.00 16.81 C ATOM 70 CE2 TYR A 7 35.194 1.319 14.593 1.00 16.48 C ATOM 71 CZ TYR A 7 34.325 1.780 15.546 1.00 16.13 C ATOM 72 OH TYR A 7 34.386 3.109 15.865 1.00 16.82 O ATOM 73 HH TYR A 7 33.711 3.311 16.561 1.00 0.00 H ATOM 74 H TYR A 7 36.825 -2.755 14.797 1.00 0.00 H ATOM 75 N GLU A 8 33.333 -5.269 15.324 1.00 20.28 N ATOM 76 CA GLU A 8 32.900 -6.634 15.061 1.00 22.59 C ATOM 77 C GLU A 8 33.212 -7.101 13.616 1.00 21.10 C ATOM 78 O GLU A 8 33.701 -8.220 13.416 1.00 20.55 O ATOM 79 CB GLU A 8 31.383 -6.746 15.346 1.00 25.90 C ATOM 80 CG GLU A 8 30.794 -8.136 15.196 1.00 30.45 C ATOM 81 CD GLU A 8 31.401 -9.195 16.125 1.00 36.21 C ATOM 82 OE1 GLU A 8 31.925 -8.877 17.225 1.00 41.24 O ATOM 83 OE2 GLU A 8 31.327 -10.387 15.760 1.00 44.91 O ATOM 84 H GLU A 8 32.649 -4.610 15.748 1.00 0.00 H ATOM 85 N VAL A 9 32.945 -6.244 12.630 1.00 19.01 N ATOM 86 CA VAL A 9 33.212 -6.574 11.223 1.00 18.95 C ATOM 87 C VAL A 9 34.685 -6.888 10.957 1.00 17.75 C ATOM 88 O VAL A 9 34.989 -7.708 10.099 1.00 15.95 O ATOM 89 CB VAL A 9 32.711 -5.479 10.240 1.00 20.11 C ATOM 90 CG1 VAL A 9 33.517 -4.166 10.383 1.00 20.07 C ATOM 91 CG2 VAL A 9 32.769 -5.991 8.812 1.00 20.37 C ATOM 92 H VAL A 9 32.537 -5.316 12.863 1.00 0.00 H ATOM 93 N GLN A 10 35.593 -6.275 11.712 1.00 18.18 N ATOM 94 CA GLN A 10 37.025 -6.528 11.514 1.00 18.46 C ATOM 95 C GLN A 10 37.363 -7.956 11.946 1.00 19.60 C ATOM 96 O GLN A 10 37.968 -8.697 11.175 1.00 21.29 O ATOM 97 CB GLN A 10 37.879 -5.513 12.230 1.00 18.03 C ATOM 98 CG GLN A 10 37.687 -4.092 11.725 1.00 18.24 C ATOM 99 CD GLN A 10 38.506 -3.074 12.502 1.00 18.58 C ATOM 100 OE1 GLN A 10 38.023 -2.440 13.447 1.00 17.57 O ATOM 101 NE2 GLN A 10 39.757 -2.908 12.103 1.00 18.46 N ATOM 102 HE22 GLN A 10 40.125 -3.461 11.303 1.00 0.00 H ATOM 103 HE21 GLN A 10 40.372 -2.224 12.589 1.00 0.00 H ATOM 104 H GLN A 10 35.285 -5.610 12.450 1.00 0.00 H ATOM 105 N ALA A 11 36.918 -8.352 13.134 1.00 19.29 N ATOM 106 CA ALA A 11 37.101 -9.716 13.627 1.00 20.16 C ATOM 107 C ALA A 11 36.496 -10.748 12.671 1.00 22.00 C ATOM 108 O ALA A 11 37.096 -11.803 12.407 1.00 22.19 O ATOM 109 CB ALA A 11 36.486 -9.874 15.028 1.00 20.46 C ATOM 110 H ALA A 11 36.421 -7.665 13.736 1.00 0.00 H ATOM 111 N GLU A 11A 35.321 -10.434 12.134 1.00 22.76 N ATOM 112 CA GLU A 11A 34.635 -11.341 11.230 1.00 23.80 C ATOM 113 C GLU A 11A 35.284 -11.491 9.852 1.00 23.37 C ATOM 114 O GLU A 11A 35.127 -12.539 9.230 1.00 24.08 O ATOM 115 CB GLU A 11A 33.184 -10.928 11.047 1.00 26.32 C ATOM 116 CG GLU A 11A 32.333 -11.224 12.257 1.00 30.89 C ATOM 117 CD GLU A 11A 30.943 -10.594 12.187 1.00 34.23 C ATOM 118 OE1 GLU A 11A 30.267 -10.589 13.236 1.00 31.97 O ATOM 119 OE2 GLU A 11A 30.536 -10.092 11.099 1.00 39.07 O ATOM 120 H GLU A 11A 34.884 -9.519 12.366 1.00 0.00 H ATOM 121 N SER A 11B 35.973 -10.460 9.373 1.00 22.09 N ATOM 122 CA SER A 11B 36.491 -10.424 7.997 1.00 22.64 C ATOM 123 C SER A 11B 37.995 -10.682 7.900 1.00 23.74 C ATOM 124 O SER A 11B 38.552 -10.670 6.814 1.00 23.24 O ATOM 125 CB SER A 11B 36.226 -9.047 7.392 1.00 23.36 C ATOM 126 OG SER A 11B 34.910 -8.573 7.658 1.00 23.06 O ATOM 127 HG SER A 11B 34.776 -8.505 8.637 1.00 0.00 H ATOM 128 H SER A 11B 36.153 -9.647 9.996 1.00 0.00 H ATOM 129 N SER A 11C 38.666 -10.860 9.025 1.00 24.10 N ATOM 130 CA SER A 11C 40.087 -11.146 9.005 1.00 26.36 C ATOM 131 C SER A 11C 40.375 -12.271 9.994 1.00 27.71 C ATOM 132 O SER A 11C 39.627 -12.494 10.941 1.00 28.80 O ATOM 133 CB SER A 11C 40.873 -9.875 9.346 1.00 27.23 C ATOM 134 OG SER A 11C 42.271 -10.113 9.494 1.00 27.09 O ATOM 135 HG SER A 11C 42.634 -10.476 8.648 1.00 0.00 H ATOM 136 H SER A 11C 38.168 -10.794 9.936 1.00 0.00 H ATOM 137 N ASN A 11D 41.454 -12.991 9.751 1.00 29.49 N ATOM 138 CA ASN A 11D 41.923 -14.013 10.679 1.00 30.80 C ATOM 139 C ASN A 11D 42.851 -13.474 11.762 1.00 30.13 C ATOM 140 O ASN A 11D 43.167 -14.191 12.686 1.00 31.19 O ATOM 141 CB ASN A 11D 42.647 -15.095 9.901 1.00 32.99 C ATOM 142 CG ASN A 11D 41.741 -15.792 8.924 1.00 36.14 C ATOM 143 OD1 ASN A 11D 40.717 -16.335 9.320 1.00 36.19 O ATOM 144 ND2 ASN A 11D 42.110 -15.791 7.641 1.00 37.90 N ATOM 145 HD22 ASN A 11D 42.989 -15.316 7.353 1.00 0.00 H ATOM 146 HD21 ASN A 11D 41.518 -16.265 6.929 1.00 0.00 H ATOM 147 H ASN A 11D 41.985 -12.825 8.872 1.00 0.00 H ATOM 148 N TYR A 11E 43.296 -12.224 11.637 1.00 29.96 N ATOM 149 CA TYR A 11E 44.165 -11.599 12.632 1.00 29.48 C ATOM 150 C TYR A 11E 43.314 -11.276 13.861 1.00 30.66 C ATOM 151 O TYR A 11E 42.248 -10.702 13.717 1.00 30.70 O ATOM 152 CB TYR A 11E 44.762 -10.333 12.021 1.00 29.66 C ATOM 153 CG TYR A 11E 45.936 -9.707 12.746 1.00 29.22 C ATOM 154 CD1 TYR A 11E 45.738 -8.895 13.877 1.00 29.08 C ATOM 155 CD2 TYR A 11E 47.247 -9.882 12.285 1.00 28.36 C ATOM 156 CE1 TYR A 11E 46.806 -8.300 14.535 1.00 26.76 C ATOM 157 CE2 TYR A 11E 48.322 -9.286 12.946 1.00 28.52 C ATOM 158 CZ TYR A 11E 48.085 -8.497 14.069 1.00 27.26 C ATOM 159 OH TYR A 11E 49.126 -7.896 14.710 1.00 26.77 O ATOM 160 HH TYR A 11E 49.758 -8.587 15.031 1.00 0.00 H ATOM 161 H TYR A 11E 43.015 -11.673 10.801 1.00 0.00 H ATOM 162 N PRO A 11F 43.758 -11.661 15.068 1.00 32.95 N ATOM 163 CA PRO A 11F 42.959 -11.432 16.289 1.00 32.23 C ATOM 164 C PRO A 11F 42.853 -9.959 16.725 1.00 30.73 C ATOM 165 O PRO A 11F 43.797 -9.199 16.583 1.00 29.77 O ATOM 166 CB PRO A 11F 43.743 -12.211 17.351 1.00 34.82 C ATOM 167 CG PRO A 11F 45.179 -12.035 16.919 1.00 36.55 C ATOM 168 CD PRO A 11F 45.100 -12.185 15.401 1.00 35.82 C ATOM 169 N CYS A 11G 41.704 -9.581 17.269 1.00 29.04 N ATOM 170 CA CYS A 11G 41.453 -8.209 17.713 1.00 29.92 C ATOM 171 C CYS A 11G 40.321 -8.204 18.750 1.00 27.41 C ATOM 172 O CYS A 11G 39.606 -9.166 18.824 1.00 26.77 O ATOM 173 CB CYS A 11G 41.138 -7.310 16.497 1.00 30.49 C ATOM 174 SG CYS A 11G 39.606 -7.604 15.566 1.00 30.78 S ATOM 175 H CYS A 11G 40.950 -10.288 17.385 1.00 0.00 H ATOM 176 N LEU A 11H 40.202 -7.175 19.590 1.00 27.35 N ATOM 177 CA LEU A 11H 39.156 -7.160 20.652 1.00 27.09 C ATOM 178 C LEU A 11H 37.874 -6.491 20.192 1.00 24.27 C ATOM 179 O LEU A 11H 37.841 -5.269 20.004 1.00 22.89 O ATOM 180 CB LEU A 11H 39.628 -6.436 21.907 1.00 29.00 C ATOM 181 CG LEU A 11H 40.471 -7.177 22.920 1.00 32.13 C ATOM 182 CD1 LEU A 11H 40.698 -6.233 24.094 1.00 33.95 C ATOM 183 CD2 LEU A 11H 39.789 -8.464 23.355 1.00 33.95 C ATOM 184 H LEU A 11H 40.851 -6.367 19.502 1.00 0.00 H ATOM 185 N VAL A 12 36.823 -7.286 20.039 1.00 23.11 N ATOM 186 CA VAL A 12 35.509 -6.783 19.585 1.00 21.03 C ATOM 187 C VAL A 12 34.845 -5.952 20.684 1.00 20.90 C ATOM 188 O VAL A 12 35.284 -6.004 21.857 1.00 19.25 O ATOM 189 CB VAL A 12 34.571 -7.933 19.104 1.00 21.79 C ATOM 190 CG1 VAL A 12 35.154 -8.627 17.886 1.00 21.86 C ATOM 191 CG2 VAL A 12 34.318 -8.962 20.189 1.00 21.94 C ATOM 192 H VAL A 12 36.927 -8.300 20.246 1.00 0.00 H ATOM 193 N PRO A 13 33.800 -5.162 20.324 1.00 20.89 N ATOM 194 CA PRO A 13 33.257 -4.148 21.289 1.00 21.09 C ATOM 195 C PRO A 13 32.863 -4.626 22.677 1.00 21.51 C ATOM 196 O PRO A 13 33.171 -3.981 23.694 1.00 20.34 O ATOM 197 CB PRO A 13 32.058 -3.581 20.532 1.00 20.37 C ATOM 198 CG PRO A 13 32.544 -3.616 19.116 1.00 19.68 C ATOM 199 CD PRO A 13 33.238 -4.943 18.973 1.00 19.57 C ATOM 200 N VAL A 14 32.246 -5.788 22.721 1.00 23.18 N ATOM 201 CA VAL A 14 31.812 -6.344 23.982 1.00 27.27 C ATOM 202 C VAL A 14 32.984 -6.696 24.895 1.00 27.42 C ATOM 203 O VAL A 14 32.799 -6.841 26.089 1.00 29.70 O ATOM 204 CB VAL A 14 30.851 -7.535 23.752 1.00 29.50 C ATOM 205 CG1 VAL A 14 31.621 -8.792 23.340 1.00 29.87 C ATOM 206 CG2 VAL A 14 30.000 -7.776 24.984 1.00 31.91 C ATOM 207 H VAL A 14 32.069 -6.311 21.840 1.00 0.00 H ATOM 208 N LYS A 15 34.189 -6.786 24.342 1.00 28.36 N ATOM 209 CA LYS A 15 35.413 -7.033 25.118 1.00 29.57 C ATOM 210 C LYS A 15 36.313 -5.815 25.283 1.00 27.89 C ATOM 211 O LYS A 15 37.364 -5.950 25.884 1.00 27.18 O ATOM 212 CB LYS A 15 36.227 -8.179 24.467 1.00 34.50 C ATOM 213 CG LYS A 15 35.531 -9.544 24.497 1.00 37.76 C ATOM 214 CD LYS A 15 36.230 -10.581 23.605 1.00 44.89 C ATOM 215 CE LYS A 15 37.293 -11.432 24.322 1.00 49.90 C ATOM 216 NZ LYS A 15 36.843 -12.843 24.573 1.00 50.59 N ATOM 217 HZ1 LYS A 15 35.991 -12.833 25.169 1.00 0.00 H ATOM 218 HZ2 LYS A 15 36.628 -13.304 23.666 1.00 0.00 H ATOM 219 HZ3 LYS A 15 37.600 -13.366 25.058 1.00 0.00 H ATOM 220 H LYS A 15 34.270 -6.676 23.311 1.00 0.00 H ATOM 221 N TRP A 16 35.970 -4.630 24.771 1.00 24.75 N ATOM 222 CA TRP A 16 36.791 -3.412 24.943 1.00 24.04 C ATOM 223 C TRP A 16 37.150 -3.092 26.412 1.00 22.99 C ATOM 224 O TRP A 16 36.361 -3.288 27.266 1.00 24.25 O ATOM 225 CB TRP A 16 36.100 -2.144 24.354 1.00 22.36 C ATOM 226 CG TRP A 16 35.970 -2.131 22.872 1.00 22.06 C ATOM 227 CD1 TRP A 16 36.520 -3.008 22.024 1.00 21.59 C ATOM 228 CD2 TRP A 16 35.270 -1.184 22.063 1.00 20.80 C ATOM 229 NE1 TRP A 16 36.237 -2.687 20.763 1.00 21.00 N ATOM 230 CE2 TRP A 16 35.459 -1.567 20.746 1.00 20.57 C ATOM 231 CE3 TRP A 16 34.519 -0.045 22.327 1.00 21.29 C ATOM 232 CZ2 TRP A 16 34.908 -0.876 19.686 1.00 20.83 C ATOM 233 CZ3 TRP A 16 33.955 0.638 21.253 1.00 21.29 C ATOM 234 CH2 TRP A 16 34.171 0.229 19.965 1.00 20.36 C ATOM 235 HE1 TRP A 16 36.559 -3.209 19.923 1.00 0.00 H ATOM 236 H TRP A 16 35.086 -4.561 24.227 1.00 0.00 H ATOM 237 N GLY A 20 38.356 -2.550 26.630 1.00 31.66 N ATOM 238 CA GLY A 20 38.894 -2.145 27.918 1.00 31.18 C ATOM 239 C GLY A 20 38.681 -0.691 28.352 1.00 32.40 C ATOM 240 O GLY A 20 37.636 -0.162 28.084 1.00 32.37 O ATOM 241 H GLY A 20 38.964 -2.406 25.799 1.00 0.00 H ATOM 242 N GLY A 21 39.662 -0.049 28.998 1.00 30.76 N ATOM 243 CA GLY A 21 39.488 1.314 29.520 1.00 29.36 C ATOM 244 C GLY A 21 38.191 1.453 30.306 1.00 25.82 C ATOM 245 O GLY A 21 37.858 0.606 31.129 1.00 23.00 O ATOM 246 H GLY A 21 40.574 -0.529 29.135 1.00 0.00 H ATOM 247 N ASN A 22 37.430 2.489 29.983 1.00 24.29 N ATOM 248 CA ASN A 22 36.149 2.753 30.633 1.00 23.76 C ATOM 249 C ASN A 22 34.926 2.191 29.909 1.00 23.19 C ATOM 250 O ASN A 22 33.795 2.426 30.331 1.00 21.34 O ATOM 251 CB ASN A 22 36.038 4.265 30.815 1.00 24.82 C ATOM 252 CG ASN A 22 37.140 4.784 31.683 1.00 23.39 C ATOM 253 OD1 ASN A 22 37.247 4.378 32.826 1.00 23.26 O ATOM 254 ND2 ASN A 22 38.013 5.576 31.126 1.00 23.54 N ATOM 255 HD22 ASN A 22 37.875 5.895 30.146 1.00 0.00 H ATOM 256 HD21 ASN A 22 38.847 5.889 31.662 1.00 0.00 H ATOM 257 H ASN A 22 37.757 3.138 29.239 1.00 0.00 H ATOM 258 N CYS A 23 35.173 1.407 28.853 1.00 23.11 N ATOM 259 CA CYS A 23 34.129 0.919 27.964 1.00 22.57 C ATOM 260 C CYS A 23 33.071 0.036 28.608 1.00 23.14 C ATOM 261 O CYS A 23 31.955 -0.075 28.083 1.00 22.31 O ATOM 262 CB CYS A 23 34.749 0.210 26.767 1.00 22.41 C ATOM 263 SG CYS A 23 35.906 1.244 25.844 1.00 22.95 S ATOM 264 H CYS A 23 36.157 1.134 28.658 1.00 0.00 H ATOM 265 N GLN A 24 33.427 -0.588 29.734 1.00 24.96 N ATOM 266 CA GLN A 24 32.539 -1.482 30.447 1.00 25.79 C ATOM 267 C GLN A 24 31.804 -0.805 31.601 1.00 26.08 C ATOM 268 O GLN A 24 31.170 -1.484 32.379 1.00 29.86 O ATOM 269 CB GLN A 24 33.330 -2.716 30.950 1.00 26.57 C ATOM 270 CG GLN A 24 33.962 -3.568 29.852 1.00 27.29 C ATOM 271 CD GLN A 24 32.950 -4.080 28.820 1.00 29.44 C ATOM 272 OE1 GLN A 24 31.856 -4.471 29.185 1.00 33.52 O ATOM 273 NE2 GLN A 24 33.320 -4.078 27.528 1.00 30.36 N ATOM 274 HE22 GLN A 24 34.264 -3.736 27.258 1.00 0.00 H ATOM 275 HE21 GLN A 24 32.662 -4.419 26.798 1.00 0.00 H ATOM 276 H GLN A 24 34.381 -0.425 30.114 1.00 0.00 H ATOM 277 N LYS A 25 31.850 0.520 31.699 1.00 25.92 N ATOM 278 CA LYS A 25 31.128 1.264 32.732 1.00 25.85 C ATOM 279 C LYS A 25 29.706 1.524 32.292 1.00 24.92 C ATOM 280 O LYS A 25 29.279 0.953 31.296 1.00 24.11 O ATOM 281 CB LYS A 25 31.898 2.535 33.101 1.00 27.62 C ATOM 282 CG LYS A 25 33.166 2.156 33.838 1.00 28.60 C ATOM 283 CD LYS A 25 33.999 3.367 34.166 1.00 31.89 C ATOM 284 CE LYS A 25 35.282 2.907 34.828 1.00 33.81 C ATOM 285 NZ LYS A 25 36.005 4.089 35.346 1.00 36.50 N ATOM 286 HZ1 LYS A 25 36.226 4.731 34.558 1.00 0.00 H ATOM 287 HZ2 LYS A 25 35.408 4.582 36.040 1.00 0.00 H ATOM 288 HZ3 LYS A 25 36.888 3.782 35.802 1.00 0.00 H ATOM 289 H LYS A 25 32.423 1.050 31.012 1.00 0.00 H ATOM 290 N ASP A 26 28.966 2.358 33.028 1.00 26.28 N ATOM 291 CA ASP A 26 27.499 2.414 32.898 1.00 26.82 C ATOM 292 C ASP A 26 26.835 3.736 32.491 1.00 22.24 C ATOM 293 O ASP A 26 25.596 3.867 32.589 1.00 24.32 O ATOM 294 CB ASP A 26 26.850 1.842 34.163 1.00 31.69 C ATOM 295 CG ASP A 26 27.212 2.590 35.395 1.00 36.88 C ATOM 296 OD1 ASP A 26 27.408 1.901 36.423 1.00 44.99 O ATOM 297 OD2 ASP A 26 27.311 3.844 35.343 1.00 42.58 O ATOM 298 H ASP A 26 29.438 2.985 33.711 1.00 0.00 H ATOM 299 N ARG A 27 27.639 4.695 32.062 1.00 19.03 N ATOM 300 CA ARG A 27 27.121 5.892 31.395 1.00 18.02 C ATOM 301 C ARG A 27 27.720 5.935 29.967 1.00 16.79 C ATOM 302 O ARG A 27 28.292 6.913 29.530 1.00 16.93 O ATOM 303 CB ARG A 27 27.388 7.160 32.233 1.00 17.98 C ATOM 304 CG ARG A 27 26.612 7.231 33.557 1.00 17.80 C ATOM 305 CD ARG A 27 27.126 8.347 34.485 1.00 17.96 C ATOM 306 NE ARG A 27 27.052 9.708 33.921 1.00 17.90 N ATOM 307 CZ ARG A 27 28.095 10.367 33.396 1.00 18.82 C ATOM 308 NH1 ARG A 27 29.280 9.799 33.358 1.00 19.96 N ATOM 309 NH2 ARG A 27 27.973 11.591 32.894 1.00 18.00 N ATOM 310 HE ARG A 27 26.130 10.188 33.931 1.00 0.00 H ATOM 311 HH12 ARG A 27 30.089 10.310 32.951 1.00 0.00 H ATOM 312 HH11 ARG A 27 29.409 8.838 33.735 1.00 0.00 H ATOM 313 HH22 ARG A 27 28.803 12.074 32.494 1.00 0.00 H ATOM 314 HH21 ARG A 27 27.048 12.066 32.901 1.00 0.00 H ATOM 315 H ARG A 27 28.665 4.597 32.202 1.00 0.00 H ATOM 316 N GLN A 28 27.548 4.836 29.238 1.00 16.15 N ATOM 317 CA GLN A 28 28.160 4.662 27.939 1.00 15.16 C ATOM 318 C GLN A 28 27.260 5.173 26.797 1.00 14.24 C ATOM 319 O GLN A 28 26.036 5.339 26.965 1.00 14.43 O ATOM 320 CB GLN A 28 28.543 3.178 27.736 1.00 15.13 C ATOM 321 CG GLN A 28 29.672 2.693 28.638 1.00 15.29 C ATOM 322 CD GLN A 28 31.010 3.297 28.285 1.00 14.66 C ATOM 323 OE1 GLN A 28 31.585 2.974 27.246 1.00 13.51 O ATOM 324 NE2 GLN A 28 31.506 4.216 29.143 1.00 14.94 N ATOM 325 HE22 GLN A 28 30.982 4.455 30.009 1.00 0.00 H ATOM 326 HE21 GLN A 28 32.412 4.684 28.937 1.00 0.00 H ATOM 327 H GLN A 28 26.951 4.073 29.616 1.00 0.00 H ATOM 328 N SER A 29 27.875 5.361 25.635 1.00 13.18 N ATOM 329 CA SER A 29 27.196 5.742 24.373 1.00 12.90 C ATOM 330 C SER A 29 27.650 4.812 23.260 1.00 13.25 C ATOM 331 O SER A 29 28.740 4.280 23.365 1.00 13.08 O ATOM 332 CB SER A 29 27.558 7.192 24.008 1.00 12.81 C ATOM 333 OG SER A 29 27.066 8.125 24.977 1.00 11.45 O ATOM 334 HG SER A 29 26.080 8.055 25.030 1.00 0.00 H ATOM 335 H SER A 29 28.907 5.232 25.608 1.00 0.00 H ATOM 336 N PRO A 30 26.883 4.614 22.189 1.00 12.80 N ATOM 337 CA PRO A 30 25.624 5.287 21.879 1.00 13.47 C ATOM 338 C PRO A 30 24.427 4.630 22.532 1.00 14.17 C ATOM 339 O PRO A 30 24.536 3.550 23.140 1.00 14.89 O ATOM 340 CB PRO A 30 25.532 5.118 20.352 1.00 13.63 C ATOM 341 CG PRO A 30 26.156 3.771 20.119 1.00 13.62 C ATOM 342 CD PRO A 30 27.302 3.712 21.107 1.00 13.48 C ATOM 343 N ILE A 31 23.289 5.282 22.405 1.00 14.42 N ATOM 344 CA ILE A 31 21.996 4.762 22.886 1.00 14.64 C ATOM 345 C ILE A 31 20.910 4.850 21.818 1.00 15.06 C ATOM 346 O ILE A 31 21.051 5.576 20.805 1.00 14.67 O ATOM 347 CB ILE A 31 21.506 5.546 24.137 1.00 15.37 C ATOM 348 CG1 ILE A 31 21.301 7.047 23.835 1.00 15.36 C ATOM 349 CG2 ILE A 31 22.497 5.390 25.289 1.00 15.30 C ATOM 350 CD1 ILE A 31 20.509 7.792 24.898 1.00 16.02 C ATOM 351 H ILE A 31 23.304 6.213 21.941 1.00 0.00 H ATOM 352 N ASN A 32 19.820 4.131 22.085 1.00 15.15 N ATOM 353 CA ASN A 32 18.508 4.369 21.453 1.00 14.72 C ATOM 354 C ASN A 32 17.808 5.488 22.185 1.00 15.41 C ATOM 355 O ASN A 32 17.829 5.519 23.433 1.00 15.80 O ATOM 356 CB ASN A 32 17.603 3.141 21.530 1.00 14.15 C ATOM 357 CG ASN A 32 16.250 3.368 20.846 1.00 14.18 C ATOM 358 OD1 ASN A 32 16.198 3.763 19.649 1.00 13.24 O ATOM 359 ND2 ASN A 32 15.152 3.122 21.588 1.00 12.89 N ATOM 360 HD22 ASN A 32 15.251 2.798 22.571 1.00 0.00 H ATOM 361 HD21 ASN A 32 14.206 3.257 21.177 1.00 0.00 H ATOM 362 H ASN A 32 19.899 3.359 22.777 1.00 0.00 H ATOM 363 N ILE A 33 17.163 6.370 21.414 1.00 15.38 N ATOM 364 CA ILE A 33 16.375 7.449 21.947 1.00 16.49 C ATOM 365 C ILE A 33 14.902 7.232 21.632 1.00 17.17 C ATOM 366 O ILE A 33 14.489 7.258 20.457 1.00 16.40 O ATOM 367 CB ILE A 33 16.877 8.802 21.377 1.00 16.80 C ATOM 368 CG1 ILE A 33 18.273 9.057 21.948 1.00 17.75 C ATOM 369 CG2 ILE A 33 15.929 9.953 21.728 1.00 17.00 C ATOM 370 CD1 ILE A 33 18.995 10.241 21.357 1.00 18.90 C ATOM 371 H ILE A 33 17.234 6.271 20.381 1.00 0.00 H ATOM 372 N VAL A 34 14.094 7.034 22.679 1.00 18.59 N ATOM 373 CA VAL A 34 12.635 7.067 22.514 1.00 19.14 C ATOM 374 C VAL A 34 12.201 8.534 22.516 1.00 19.72 C ATOM 375 O VAL A 34 12.063 9.155 23.581 1.00 19.88 O ATOM 376 CB VAL A 34 11.870 6.270 23.588 1.00 18.94 C ATOM 377 CG1 VAL A 34 10.382 6.355 23.303 1.00 19.16 C ATOM 378 CG2 VAL A 34 12.325 4.821 23.611 1.00 18.02 C ATOM 379 H VAL A 34 14.502 6.855 23.619 1.00 0.00 H ATOM 380 N THR A 35 11.962 9.064 21.313 1.00 20.21 N ATOM 381 CA THR A 35 11.733 10.485 21.129 1.00 21.78 C ATOM 382 C THR A 35 10.571 11.031 21.965 1.00 22.69 C ATOM 383 O THR A 35 10.707 12.095 22.552 1.00 22.63 O ATOM 384 CB THR A 35 11.493 10.870 19.660 1.00 22.20 C ATOM 385 OG1 THR A 35 10.330 10.209 19.152 1.00 24.10 O ATOM 386 CG2 THR A 35 12.715 10.560 18.807 1.00 22.56 C ATOM 387 HG1 THR A 35 10.456 9.229 19.212 1.00 0.00 H ATOM 388 H THR A 35 11.939 8.438 20.482 1.00 0.00 H ATOM 389 N THR A 36 9.463 10.299 22.039 1.00 21.96 N ATOM 390 CA THR A 36 8.291 10.786 22.771 1.00 24.65 C ATOM 391 C THR A 36 8.463 10.763 24.282 1.00 24.94 C ATOM 392 O THR A 36 7.739 11.445 24.973 1.00 26.16 O ATOM 393 CB THR A 36 7.026 9.974 22.433 1.00 25.79 C ATOM 394 OG1 THR A 36 7.357 8.577 22.449 1.00 28.09 O ATOM 395 CG2 THR A 36 6.510 10.355 21.071 1.00 26.22 C ATOM 396 HG1 THR A 36 8.061 8.398 21.777 1.00 0.00 H ATOM 397 H THR A 36 9.428 9.370 21.572 1.00 0.00 H ATOM 398 N LYS A 37 9.422 9.995 24.798 1.00 26.34 N ATOM 399 CA LYS A 37 9.730 10.004 26.227 1.00 25.35 C ATOM 400 C LYS A 37 10.790 11.010 26.643 1.00 25.62 C ATOM 401 O LYS A 37 10.976 11.232 27.825 1.00 27.43 O ATOM 402 CB LYS A 37 10.143 8.610 26.680 1.00 25.26 C ATOM 403 CG LYS A 37 9.032 7.607 26.450 1.00 25.90 C ATOM 404 CD LYS A 37 9.295 6.281 27.135 1.00 26.14 C ATOM 405 CE LYS A 37 8.205 5.282 26.745 1.00 27.25 C ATOM 406 NZ LYS A 37 8.279 4.061 27.605 1.00 28.92 N ATOM 407 HZ1 LYS A 37 9.209 3.610 27.486 1.00 0.00 H ATOM 408 HZ2 LYS A 37 8.149 4.331 28.601 1.00 0.00 H ATOM 409 HZ3 LYS A 37 7.531 3.395 27.325 1.00 0.00 H ATOM 410 H LYS A 37 9.966 9.372 24.167 1.00 0.00 H ATOM 411 N ALA A 38 11.526 11.599 25.717 1.00 26.46 N ATOM 412 CA ALA A 38 12.482 12.641 26.117 1.00 26.53 C ATOM 413 C ALA A 38 11.696 13.902 26.497 1.00 25.96 C ATOM 414 O ALA A 38 10.884 14.370 25.714 1.00 23.02 O ATOM 415 CB ALA A 38 13.472 12.930 24.990 1.00 26.82 C ATOM 416 H ALA A 38 11.430 11.328 24.717 1.00 0.00 H ATOM 417 N LYS A 39 11.920 14.440 27.697 1.00 29.02 N ATOM 418 CA LYS A 39 11.244 15.680 28.118 1.00 32.17 C ATOM 419 C LYS A 39 11.827 16.940 27.476 1.00 30.32 C ATOM 420 O LYS A 39 13.040 17.085 27.350 1.00 27.70 O ATOM 421 CB LYS A 39 11.300 15.857 29.636 1.00 37.85 C ATOM 422 CG LYS A 39 10.363 14.947 30.412 1.00 46.07 C ATOM 423 CD LYS A 39 8.895 15.218 30.071 1.00 52.11 C ATOM 424 CE LYS A 39 7.974 14.996 31.262 1.00 56.22 C ATOM 425 NZ LYS A 39 8.299 13.747 31.998 1.00 56.78 N ATOM 426 HZ1 LYS A 39 8.202 12.933 31.358 1.00 0.00 H ATOM 427 HZ2 LYS A 39 9.276 13.798 32.350 1.00 0.00 H ATOM 428 HZ3 LYS A 39 7.646 13.639 32.800 1.00 0.00 H ATOM 429 H LYS A 39 12.585 13.975 28.348 1.00 0.00 H ATOM 430 N VAL A 40 10.952 17.870 27.130 1.00 29.57 N ATOM 431 CA VAL A 40 11.375 19.183 26.671 1.00 31.02 C ATOM 432 C VAL A 40 11.981 19.937 27.839 1.00 28.97 C ATOM 433 O VAL A 40 11.384 19.992 28.883 1.00 29.02 O ATOM 434 CB VAL A 40 10.202 20.033 26.130 1.00 32.94 C ATOM 435 CG1 VAL A 40 10.724 21.387 25.628 1.00 34.67 C ATOM 436 CG2 VAL A 40 9.469 19.301 25.020 1.00 33.05 C ATOM 437 H VAL A 40 9.936 17.656 27.188 1.00 0.00 H ATOM 438 N ASP A 41 13.170 20.488 27.662 1.00 29.32 N ATOM 439 CA ASP A 41 13.771 21.394 28.632 1.00 29.63 C ATOM 440 C ASP A 41 13.873 22.743 27.918 1.00 31.17 C ATOM 441 O ASP A 41 14.573 22.861 26.934 1.00 29.52 O ATOM 442 CB ASP A 41 15.128 20.863 29.069 1.00 29.02 C ATOM 443 CG ASP A 41 15.854 21.783 30.044 1.00 32.85 C ATOM 444 OD1 ASP A 41 15.584 22.999 30.057 1.00 35.35 O ATOM 445 OD2 ASP A 41 16.733 21.293 30.799 1.00 33.60 O ATOM 446 H ASP A 41 13.698 20.265 26.794 1.00 0.00 H ATOM 447 N LYS A 42 13.189 23.753 28.455 1.00 35.85 N ATOM 448 CA LYS A 42 13.099 25.094 27.852 1.00 40.41 C ATOM 449 C LYS A 42 14.449 25.787 27.747 1.00 36.26 C ATOM 450 O LYS A 42 14.638 26.658 26.908 1.00 34.91 O ATOM 451 CB LYS A 42 12.168 26.003 28.676 1.00 47.03 C ATOM 452 CG LYS A 42 10.694 25.593 28.721 1.00 55.66 C ATOM 453 CD LYS A 42 10.035 26.101 30.018 1.00 63.07 C ATOM 454 CE LYS A 42 8.819 25.298 30.476 1.00 66.73 C ATOM 455 NZ LYS A 42 7.532 26.007 30.224 1.00 70.43 N ATOM 456 HZ1 LYS A 42 7.529 26.911 30.738 1.00 0.00 H ATOM 457 HZ2 LYS A 42 7.430 26.186 29.205 1.00 0.00 H ATOM 458 HZ3 LYS A 42 6.742 25.417 30.554 1.00 0.00 H ATOM 459 H LYS A 42 12.690 23.585 29.352 1.00 0.00 H ATOM 460 N LYS A 43 15.382 25.392 28.596 1.00 33.03 N ATOM 461 CA LYS A 43 16.719 25.953 28.572 1.00 33.60 C ATOM 462 C LYS A 43 17.609 25.491 27.382 1.00 31.06 C ATOM 463 O LYS A 43 18.727 25.987 27.235 1.00 28.14 O ATOM 464 CB LYS A 43 17.390 25.697 29.930 1.00 35.84 C ATOM 465 CG LYS A 43 16.563 26.322 31.040 1.00 40.21 C ATOM 466 CD LYS A 43 17.250 26.469 32.384 1.00 46.15 C ATOM 467 CE LYS A 43 16.392 27.399 33.248 1.00 52.02 C ATOM 468 NZ LYS A 43 16.735 27.442 34.699 1.00 56.99 N ATOM 469 HZ1 LYS A 43 16.632 26.491 35.107 1.00 0.00 H ATOM 470 HZ2 LYS A 43 17.717 27.765 34.812 1.00 0.00 H ATOM 471 HZ3 LYS A 43 16.094 28.100 35.186 1.00 0.00 H ATOM 472 H LYS A 43 15.151 24.661 29.299 1.00 0.00 H ATOM 473 N LEU A 44 17.131 24.550 26.554 1.00 28.33 N ATOM 474 CA LEU A 44 17.886 24.065 25.375 1.00 24.62 C ATOM 475 C LEU A 44 17.564 24.948 24.192 1.00 22.30 C ATOM 476 O LEU A 44 16.642 24.686 23.432 1.00 22.65 O ATOM 477 CB LEU A 44 17.552 22.597 25.070 1.00 23.26 C ATOM 478 CG LEU A 44 17.895 21.576 26.148 1.00 22.24 C ATOM 479 CD1 LEU A 44 17.633 20.133 25.673 1.00 21.92 C ATOM 480 CD2 LEU A 44 19.302 21.770 26.653 1.00 21.16 C ATOM 481 H LEU A 44 16.193 24.145 26.747 1.00 0.00 H ATOM 482 N GLY A 45 18.327 26.022 24.058 1.00 21.92 N ATOM 483 CA GLY A 45 18.056 27.025 23.065 1.00 20.31 C ATOM 484 C GLY A 45 18.842 26.713 21.825 1.00 20.24 C ATOM 485 O GLY A 45 19.499 25.663 21.729 1.00 19.62 O ATOM 486 H GLY A 45 19.145 26.143 24.689 1.00 0.00 H ATOM 487 N ARG A 46 18.790 27.633 20.878 1.00 18.76 N ATOM 488 CA ARG A 46 19.500 27.435 19.606 1.00 19.74 C ATOM 489 C ARG A 46 21.022 27.364 19.814 1.00 18.83 C ATOM 490 O ARG A 46 21.538 27.911 20.784 1.00 16.77 O ATOM 491 CB ARG A 46 19.155 28.536 18.603 1.00 20.18 C ATOM 492 CG ARG A 46 19.465 29.943 19.112 1.00 21.12 C ATOM 493 CD ARG A 46 19.497 30.940 18.005 1.00 21.66 C ATOM 494 NE ARG A 46 20.669 30.728 17.188 1.00 22.27 N ATOM 495 CZ ARG A 46 21.041 31.519 16.190 1.00 24.61 C ATOM 496 NH1 ARG A 46 20.321 32.610 15.858 1.00 25.72 N ATOM 497 NH2 ARG A 46 22.147 31.207 15.518 1.00 24.76 N ATOM 498 HE ARG A 46 21.262 29.899 17.396 1.00 0.00 H ATOM 499 HH12 ARG A 46 20.630 33.217 15.072 1.00 0.00 H ATOM 500 HH11 ARG A 46 19.457 32.844 16.388 1.00 0.00 H ATOM 501 HH22 ARG A 46 22.464 31.808 14.731 1.00 0.00 H ATOM 502 HH21 ARG A 46 22.694 30.362 15.780 1.00 0.00 H ATOM 503 H ARG A 46 18.243 28.504 21.034 1.00 0.00 H ATOM 504 N PHE A 47 21.717 26.677 18.912 1.00 18.42 N ATOM 505 CA PHE A 47 23.188 26.725 18.895 1.00 20.24 C ATOM 506 C PHE A 47 23.675 27.979 18.200 1.00 20.25 C ATOM 507 O PHE A 47 22.954 28.547 17.391 1.00 21.19 O ATOM 508 CB PHE A 47 23.777 25.505 18.192 1.00 20.19 C ATOM 509 CG PHE A 47 23.772 24.273 19.042 1.00 19.87 C ATOM 510 CD1 PHE A 47 22.675 23.441 19.068 1.00 19.52 C ATOM 511 CD2 PHE A 47 24.862 23.971 19.828 1.00 20.02 C ATOM 512 CE1 PHE A 47 22.677 22.301 19.860 1.00 21.12 C ATOM 513 CE2 PHE A 47 24.885 22.827 20.605 1.00 20.18 C ATOM 514 CZ PHE A 47 23.799 21.985 20.622 1.00 20.45 C ATOM 515 H PHE A 47 21.214 26.098 18.209 1.00 0.00 H ATOM 516 N PHE A 48 24.884 28.419 18.544 1.00 21.27 N ATOM 517 CA PHE A 48 25.589 29.443 17.760 1.00 21.72 C ATOM 518 C PHE A 48 26.837 28.777 17.270 1.00 21.81 C ATOM 519 O PHE A 48 27.604 28.237 18.052 1.00 20.58 O ATOM 520 CB PHE A 48 25.888 30.714 18.570 1.00 22.09 C ATOM 521 CG PHE A 48 24.643 31.457 18.970 1.00 22.83 C ATOM 522 CD1 PHE A 48 23.877 31.014 20.023 1.00 23.36 C ATOM 523 CD2 PHE A 48 24.209 32.561 18.248 1.00 24.70 C ATOM 524 CE1 PHE A 48 22.700 31.649 20.374 1.00 23.26 C ATOM 525 CE2 PHE A 48 23.040 33.230 18.605 1.00 24.32 C ATOM 526 CZ PHE A 48 22.275 32.753 19.662 1.00 23.85 C ATOM 527 H PHE A 48 25.342 28.027 19.391 1.00 0.00 H ATOM 528 N PHE A 49 26.990 28.756 15.955 1.00 23.24 N ATOM 529 CA PHE A 49 28.153 28.187 15.311 1.00 24.55 C ATOM 530 C PHE A 49 29.082 29.364 15.001 1.00 27.49 C ATOM 531 O PHE A 49 28.608 30.434 14.610 1.00 29.90 O ATOM 532 CB PHE A 49 27.719 27.427 14.053 1.00 24.80 C ATOM 533 CG PHE A 49 26.722 26.311 14.323 1.00 24.42 C ATOM 534 CD1 PHE A 49 27.142 25.035 14.697 1.00 25.06 C ATOM 535 CD2 PHE A 49 25.357 26.538 14.229 1.00 24.83 C ATOM 536 CE1 PHE A 49 26.219 24.015 14.953 1.00 24.54 C ATOM 537 CE2 PHE A 49 24.426 25.521 14.499 1.00 26.33 C ATOM 538 CZ PHE A 49 24.861 24.255 14.868 1.00 24.72 C ATOM 539 H PHE A 49 26.242 29.166 15.360 1.00 0.00 H ATOM 540 N SER A 50 30.383 29.226 15.261 1.00 27.08 N ATOM 541 CA SER A 50 31.354 30.191 14.755 1.00 26.39 C ATOM 542 C SER A 50 32.352 29.441 13.946 1.00 24.51 C ATOM 543 O SER A 50 32.792 28.377 14.366 1.00 23.14 O ATOM 544 CB SER A 50 32.070 30.903 15.880 1.00 28.63 C ATOM 545 OG SER A 50 31.111 31.551 16.682 1.00 33.70 O ATOM 546 HG SER A 50 30.610 32.205 16.132 1.00 0.00 H ATOM 547 H SER A 50 30.710 28.420 15.832 1.00 0.00 H ATOM 548 N GLY A 50A 32.703 30.003 12.792 1.00 22.51 N ATOM 549 CA GLY A 50A 33.650 29.399 11.864 1.00 22.21 C ATOM 550 C GLY A 50A 33.066 28.335 10.949 1.00 21.71 C ATOM 551 O GLY A 50A 33.770 27.790 10.107 1.00 23.49 O ATOM 552 H GLY A 50A 32.280 30.919 12.540 1.00 0.00 H ATOM 553 N TYR A 51 31.774 28.069 11.079 1.00 21.73 N ATOM 554 CA TYR A 51 31.114 26.990 10.343 1.00 22.52 C ATOM 555 C TYR A 51 30.731 27.370 8.918 1.00 24.74 C ATOM 556 O TYR A 51 30.570 26.488 8.069 1.00 25.27 O ATOM 557 CB TYR A 51 29.869 26.507 11.094 1.00 20.21 C ATOM 558 CG TYR A 51 30.098 25.429 12.134 1.00 18.66 C ATOM 559 CD1 TYR A 51 30.817 25.687 13.318 1.00 18.20 C ATOM 560 CD2 TYR A 51 29.536 24.164 11.972 1.00 18.55 C ATOM 561 CE1 TYR A 51 30.975 24.711 14.292 1.00 17.15 C ATOM 562 CE2 TYR A 51 29.683 23.171 12.938 1.00 18.45 C ATOM 563 CZ TYR A 51 30.410 23.440 14.099 1.00 18.49 C ATOM 564 OH TYR A 51 30.533 22.422 15.032 1.00 17.02 O ATOM 565 HH TYR A 51 31.068 22.743 15.801 1.00 0.00 H ATOM 566 H TYR A 51 31.207 28.650 11.729 1.00 0.00 H ATOM 567 N ASP A 52 30.576 28.670 8.664 1.00 27.74 N ATOM 568 CA ASP A 52 30.238 29.195 7.350 1.00 30.76 C ATOM 569 C ASP A 52 31.491 29.477 6.505 1.00 28.93 C ATOM 570 O ASP A 52 31.412 29.544 5.304 1.00 28.53 O ATOM 571 CB ASP A 52 29.420 30.485 7.514 1.00 37.39 C ATOM 572 CG ASP A 52 28.401 30.719 6.374 1.00 43.98 C ATOM 573 OD1 ASP A 52 27.906 29.754 5.752 1.00 48.22 O ATOM 574 OD2 ASP A 52 28.074 31.902 6.109 1.00 54.08 O ATOM 575 H ASP A 52 30.703 29.344 9.446 1.00 0.00 H ATOM 576 N LYS A 53 32.633 29.626 7.145 1.00 28.23 N ATOM 577 CA LYS A 53 33.899 29.970 6.501 1.00 30.80 C ATOM 578 C LYS A 53 34.409 28.860 5.594 1.00 30.74 C ATOM 579 O LYS A 53 34.549 27.729 6.034 1.00 27.99 O ATOM 580 CB LYS A 53 34.916 30.198 7.606 1.00 34.00 C ATOM 581 CG LYS A 53 36.263 30.776 7.217 1.00 40.27 C ATOM 582 CD LYS A 53 36.822 31.494 8.464 1.00 46.22 C ATOM 583 CE LYS A 53 38.336 31.683 8.480 1.00 50.73 C ATOM 584 NZ LYS A 53 38.837 32.824 7.664 1.00 51.95 N ATOM 585 HZ1 LYS A 53 38.564 32.684 6.670 1.00 0.00 H ATOM 586 HZ2 LYS A 53 38.422 33.710 8.017 1.00 0.00 H ATOM 587 HZ3 LYS A 53 39.873 32.872 7.737 1.00 0.00 H ATOM 588 H LYS A 53 32.634 29.490 8.176 1.00 0.00 H ATOM 589 N LYS A 54 34.695 29.188 4.339 1.00 31.48 N ATOM 590 CA LYS A 54 35.347 28.235 3.427 1.00 36.05 C ATOM 591 C LYS A 54 36.797 27.999 3.843 1.00 35.38 C ATOM 592 O LYS A 54 37.514 28.944 4.124 1.00 38.27 O ATOM 593 CB LYS A 54 35.331 28.727 1.978 1.00 37.50 C ATOM 594 CG LYS A 54 33.968 28.980 1.376 1.00 40.82 C ATOM 595 CD LYS A 54 33.104 27.728 1.407 1.00 45.87 C ATOM 596 CE LYS A 54 31.796 27.891 0.646 1.00 47.26 C ATOM 597 NZ LYS A 54 31.306 26.548 0.238 1.00 50.47 N ATOM 598 HZ1 LYS A 54 32.014 26.093 -0.372 1.00 0.00 H ATOM 599 HZ2 LYS A 54 31.150 25.965 1.085 1.00 0.00 H ATOM 600 HZ3 LYS A 54 30.412 26.650 -0.283 1.00 0.00 H ATOM 601 H LYS A 54 34.453 30.139 3.994 1.00 0.00 H ATOM 602 N GLN A 55 37.198 26.734 3.913 1.00 34.10 N ATOM 603 CA GLN A 55 38.562 26.320 4.252 1.00 34.71 C ATOM 604 C GLN A 55 38.965 25.176 3.333 1.00 33.45 C ATOM 605 O GLN A 55 38.105 24.580 2.684 1.00 33.49 O ATOM 606 CB GLN A 55 38.604 25.764 5.682 1.00 36.54 C ATOM 607 CG GLN A 55 38.056 26.663 6.782 1.00 38.66 C ATOM 608 CD GLN A 55 39.049 27.616 7.397 1.00 41.61 C ATOM 609 OE1 GLN A 55 38.774 28.158 8.452 1.00 45.49 O ATOM 610 NE2 GLN A 55 40.194 27.839 6.760 1.00 45.25 N ATOM 611 HE22 GLN A 55 40.391 27.356 5.860 1.00 0.00 H ATOM 612 HE21 GLN A 55 40.893 28.497 7.161 1.00 0.00 H ATOM 613 H GLN A 55 36.499 25.990 3.714 1.00 0.00 H ATOM 614 N THR A 56 40.258 24.856 3.307 1.00 31.10 N ATOM 615 CA THR A 56 40.745 23.623 2.718 1.00 30.06 C ATOM 616 C THR A 56 41.199 22.697 3.837 1.00 31.24 C ATOM 617 O THR A 56 42.355 22.696 4.252 1.00 36.14 O ATOM 618 CB THR A 56 41.913 23.867 1.780 1.00 30.20 C ATOM 619 OG1 THR A 56 42.897 24.655 2.456 1.00 29.82 O ATOM 620 CG2 THR A 56 41.438 24.564 0.543 1.00 29.79 C ATOM 621 HG1 THR A 56 43.210 24.171 3.261 1.00 0.00 H ATOM 622 H THR A 56 40.945 25.516 3.725 1.00 0.00 H ATOM 623 N TRP A 57 40.277 21.885 4.306 1.00 26.93 N ATOM 624 CA TRP A 57 40.516 21.085 5.471 1.00 24.98 C ATOM 625 C TRP A 57 41.466 19.937 5.145 1.00 23.49 C ATOM 626 O TRP A 57 41.466 19.403 4.030 1.00 23.51 O ATOM 627 CB TRP A 57 39.170 20.530 5.979 1.00 24.08 C ATOM 628 CG TRP A 57 38.145 21.570 6.285 1.00 22.56 C ATOM 629 CD1 TRP A 57 37.091 21.946 5.512 1.00 22.51 C ATOM 630 CD2 TRP A 57 38.076 22.358 7.461 1.00 22.49 C ATOM 631 NE1 TRP A 57 36.356 22.919 6.141 1.00 22.85 N ATOM 632 CE2 TRP A 57 36.945 23.189 7.344 1.00 22.44 C ATOM 633 CE3 TRP A 57 38.864 22.448 8.611 1.00 22.99 C ATOM 634 CZ2 TRP A 57 36.578 24.086 8.333 1.00 22.94 C ATOM 635 CZ3 TRP A 57 38.494 23.355 9.596 1.00 23.19 C ATOM 636 CH2 TRP A 57 37.362 24.154 9.449 1.00 22.19 C ATOM 637 HE1 TRP A 57 35.498 23.373 5.767 1.00 0.00 H ATOM 638 H TRP A 57 39.358 21.822 3.823 1.00 0.00 H ATOM 639 N THR A 58 42.257 19.552 6.141 1.00 22.93 N ATOM 640 CA THR A 58 42.995 18.304 6.107 1.00 22.04 C ATOM 641 C THR A 58 42.094 17.176 6.582 1.00 21.69 C ATOM 642 O THR A 58 41.478 17.259 7.642 1.00 20.23 O ATOM 643 CB THR A 58 44.251 18.366 6.973 1.00 23.78 C ATOM 644 OG1 THR A 58 45.119 19.382 6.441 1.00 26.51 O ATOM 645 CG2 THR A 58 44.978 17.027 7.011 1.00 23.17 C ATOM 646 HG1 THR A 58 44.652 20.255 6.457 1.00 0.00 H ATOM 647 H THR A 58 42.350 20.167 6.974 1.00 0.00 H ATOM 648 N VAL A 59 42.053 16.103 5.799 1.00 21.15 N ATOM 649 CA VAL A 59 41.262 14.919 6.138 1.00 20.94 C ATOM 650 C VAL A 59 42.157 13.689 6.100 1.00 21.79 C ATOM 651 O VAL A 59 43.047 13.587 5.239 1.00 20.50 O ATOM 652 CB VAL A 59 39.999 14.785 5.234 1.00 19.92 C ATOM 653 CG1 VAL A 59 40.336 14.475 3.791 1.00 19.49 C ATOM 654 CG2 VAL A 59 39.103 13.709 5.778 1.00 20.09 C ATOM 655 H VAL A 59 42.602 16.105 4.915 1.00 0.00 H ATOM 656 N GLN A 60 41.952 12.772 7.051 1.00 22.94 N ATOM 657 CA GLN A 60 42.788 11.582 7.125 1.00 24.84 C ATOM 658 C GLN A 60 42.052 10.307 7.510 1.00 22.12 C ATOM 659 O GLN A 60 41.057 10.338 8.192 1.00 22.03 O ATOM 660 CB GLN A 60 43.956 11.836 8.070 1.00 29.30 C ATOM 661 CG GLN A 60 43.572 12.033 9.514 1.00 32.77 C ATOM 662 CD GLN A 60 44.778 12.413 10.380 1.00 36.72 C ATOM 663 OE1 GLN A 60 45.496 13.361 10.071 1.00 38.63 O ATOM 664 NE2 GLN A 60 44.993 11.676 11.468 1.00 38.33 N ATOM 665 HE22 GLN A 60 44.360 10.882 11.692 1.00 0.00 H ATOM 666 HE21 GLN A 60 45.794 11.894 12.094 1.00 0.00 H ATOM 667 H GLN A 60 41.189 12.910 7.744 1.00 0.00 H ATOM 668 N ASN A 61 42.575 9.189 7.052 1.00 20.68 N ATOM 669 CA ASN A 61 42.114 7.876 7.443 1.00 20.39 C ATOM 670 C ASN A 61 42.878 7.512 8.695 1.00 20.57 C ATOM 671 O ASN A 61 44.064 7.223 8.601 1.00 22.92 O ATOM 672 CB ASN A 61 42.420 6.894 6.298 1.00 19.66 C ATOM 673 CG ASN A 61 41.988 5.468 6.578 1.00 19.09 C ATOM 674 OD1 ASN A 61 41.882 5.030 7.714 1.00 18.74 O ATOM 675 ND2 ASN A 61 41.755 4.726 5.516 1.00 19.63 N ATOM 676 HD22 ASN A 61 41.856 5.134 4.565 1.00 0.00 H ATOM 677 HD21 ASN A 61 41.470 3.732 5.628 1.00 0.00 H ATOM 678 H ASN A 61 43.361 9.254 6.374 1.00 0.00 H ATOM 679 N ASN A 62 42.220 7.516 9.859 1.00 20.38 N ATOM 680 CA ASN A 62 42.893 7.130 11.110 1.00 20.19 C ATOM 681 C ASN A 62 42.857 5.638 11.433 1.00 20.31 C ATOM 682 O ASN A 62 43.261 5.250 12.510 1.00 19.21 O ATOM 683 CB ASN A 62 42.354 7.942 12.293 1.00 20.56 C ATOM 684 CG ASN A 62 40.921 7.593 12.650 1.00 20.59 C ATOM 685 OD1 ASN A 62 40.361 6.620 12.176 1.00 18.82 O ATOM 686 ND2 ASN A 62 40.325 8.408 13.485 1.00 22.81 N ATOM 687 HD22 ASN A 62 40.838 9.228 13.867 1.00 0.00 H ATOM 688 HD21 ASN A 62 39.339 8.235 13.766 1.00 0.00 H ATOM 689 H ASN A 62 41.219 7.796 9.881 1.00 0.00 H ATOM 690 N GLY A 63 42.349 4.802 10.523 1.00 20.67 N ATOM 691 CA GLY A 63 42.277 3.353 10.755 1.00 20.48 C ATOM 692 C GLY A 63 40.901 2.854 11.181 1.00 21.12 C ATOM 693 O GLY A 63 40.630 1.666 11.139 1.00 20.55 O ATOM 694 H GLY A 63 41.994 5.188 9.625 1.00 0.00 H ATOM 695 N HIS A 64 40.033 3.742 11.637 1.00 22.09 N ATOM 696 CA HIS A 64 38.639 3.346 11.974 1.00 23.50 C ATOM 697 C HIS A 64 37.580 4.351 11.585 1.00 20.64 C ATOM 698 O HIS A 64 36.413 4.133 11.886 1.00 19.18 O ATOM 699 CB HIS A 64 38.514 3.004 13.468 1.00 26.58 C ATOM 700 CG HIS A 64 39.364 3.842 14.345 1.00 32.53 C ATOM 701 ND1 HIS A 64 40.668 3.502 14.655 1.00 36.67 N ATOM 702 CD2 HIS A 64 39.112 5.018 14.973 1.00 37.41 C ATOM 703 CE1 HIS A 64 41.187 4.443 15.428 1.00 39.80 C ATOM 704 NE2 HIS A 64 40.263 5.371 15.641 1.00 40.61 N ATOM 705 H HIS A 64 40.329 4.731 11.762 1.00 0.00 H ATOM 706 N SER A 65 38.000 5.442 10.940 1.00 19.06 N ATOM 707 CA SER A 65 37.124 6.449 10.393 1.00 18.46 C ATOM 708 C SER A 65 37.926 7.396 9.456 1.00 18.71 C ATOM 709 O SER A 65 39.146 7.226 9.215 1.00 18.39 O ATOM 710 CB SER A 65 36.403 7.234 11.518 1.00 18.12 C ATOM 711 OG SER A 65 35.423 8.090 10.974 1.00 17.68 O ATOM 712 HG SER A 65 34.756 7.553 10.478 1.00 0.00 H ATOM 713 H SER A 65 39.025 5.574 10.825 1.00 0.00 H ATOM 714 N VAL A 66 37.209 8.367 8.903 1.00 19.07 N ATOM 715 CA VAL A 66 37.810 9.437 8.151 1.00 19.39 C ATOM 716 C VAL A 66 37.523 10.652 8.994 1.00 19.41 C ATOM 717 O VAL A 66 36.405 10.831 9.475 1.00 19.29 O ATOM 718 CB VAL A 66 37.280 9.534 6.689 1.00 19.56 C ATOM 719 CG1 VAL A 66 35.789 9.799 6.609 1.00 19.53 C ATOM 720 CG2 VAL A 66 37.975 10.625 5.937 1.00 21.44 C ATOM 721 H VAL A 66 36.175 8.354 9.017 1.00 0.00 H ATOM 722 N MET A 67 38.548 11.483 9.156 1.00 20.86 N ATOM 723 CA MET A 67 38.577 12.537 10.165 1.00 20.67 C ATOM 724 C MET A 67 39.101 13.864 9.608 1.00 20.56 C ATOM 725 O MET A 67 40.225 13.935 9.121 1.00 22.19 O ATOM 726 CB MET A 67 39.441 12.085 11.310 1.00 22.10 C ATOM 727 CG MET A 67 39.524 13.087 12.432 1.00 24.82 C ATOM 728 SD MET A 67 40.404 12.403 13.855 1.00 27.88 S ATOM 729 CE MET A 67 41.985 11.917 13.109 1.00 30.07 C ATOM 730 H MET A 67 39.372 11.376 8.531 1.00 0.00 H ATOM 731 N MET A 68 38.296 14.906 9.687 1.00 19.40 N ATOM 732 CA MET A 68 38.738 16.234 9.330 1.00 19.92 C ATOM 733 C MET A 68 39.302 16.879 10.570 1.00 20.30 C ATOM 734 O MET A 68 38.663 16.829 11.645 1.00 20.01 O ATOM 735 CB MET A 68 37.585 17.078 8.824 1.00 19.93 C ATOM 736 CG MET A 68 37.045 16.612 7.472 1.00 21.44 C ATOM 737 SD MET A 68 35.460 17.301 6.993 1.00 19.74 S ATOM 738 CE MET A 68 35.710 19.051 7.166 1.00 19.77 C ATOM 739 H MET A 68 37.319 14.768 10.015 1.00 0.00 H ATOM 740 N LEU A 69 40.470 17.508 10.419 1.00 19.15 N ATOM 741 CA LEU A 69 41.121 18.180 11.532 1.00 19.87 C ATOM 742 C LEU A 69 40.613 19.611 11.554 1.00 20.54 C ATOM 743 O LEU A 69 40.795 20.337 10.590 1.00 20.54 O ATOM 744 CB LEU A 69 42.639 18.135 11.381 1.00 20.61 C ATOM 745 CG LEU A 69 43.255 16.763 11.062 1.00 21.77 C ATOM 746 CD1 LEU A 69 44.760 16.907 10.866 1.00 22.20 C ATOM 747 CD2 LEU A 69 42.945 15.748 12.144 1.00 21.53 C ATOM 748 H LEU A 69 40.925 17.518 9.484 1.00 0.00 H ATOM 749 N LEU A 70 39.931 20.004 12.624 1.00 21.27 N ATOM 750 CA LEU A 70 39.305 21.323 12.675 1.00 23.29 C ATOM 751 C LEU A 70 40.137 22.376 13.408 1.00 25.93 C ATOM 752 O LEU A 70 39.929 23.575 13.194 1.00 24.39 O ATOM 753 CB LEU A 70 37.906 21.241 13.258 1.00 22.72 C ATOM 754 CG LEU A 70 37.026 20.184 12.574 1.00 22.81 C ATOM 755 CD1 LEU A 70 35.658 20.178 13.232 1.00 22.99 C ATOM 756 CD2 LEU A 70 36.906 20.351 11.063 1.00 22.85 C ATOM 757 H LEU A 70 39.841 19.363 13.438 1.00 0.00 H ATOM 758 N GLU A 71 41.037 21.941 14.290 1.00 29.49 N ATOM 759 CA GLU A 71 42.074 22.817 14.825 1.00 33.86 C ATOM 760 C GLU A 71 41.559 24.179 15.325 1.00 32.15 C ATOM 761 O GLU A 71 42.033 25.224 14.898 1.00 32.40 O ATOM 762 CB GLU A 71 43.139 23.009 13.736 1.00 38.42 C ATOM 763 CG GLU A 71 43.433 21.713 12.987 1.00 42.70 C ATOM 764 CD GLU A 71 44.767 21.718 12.306 1.00 45.94 C ATOM 765 OE1 GLU A 71 45.047 22.687 11.554 1.00 50.46 O ATOM 766 OE2 GLU A 71 45.515 20.739 12.520 1.00 48.78 O ATOM 767 H GLU A 71 40.999 20.951 14.605 1.00 0.00 H ATOM 768 N ASN A 72 40.582 24.112 16.183 1.00 32.30 N ATOM 769 CA ASN A 72 40.036 25.281 16.757 1.00 32.41 C ATOM 770 C ASN A 72 39.545 26.364 15.814 1.00 30.32 C ATOM 771 O ASN A 72 39.144 27.387 16.303 1.00 33.14 O ATOM 772 CB ASN A 72 41.007 25.809 17.800 1.00 33.00 C ATOM 773 CG ASN A 72 41.355 24.764 18.849 1.00 33.60 C ATOM 774 OD1 ASN A 72 40.727 23.763 18.963 1.00 31.58 O ATOM 775 ND2 ASN A 72 42.366 25.019 19.589 1.00 38.70 N ATOM 776 HD22 ASN A 72 42.893 25.906 19.461 1.00 0.00 H ATOM 777 HD21 ASN A 72 42.661 24.339 20.319 1.00 0.00 H ATOM 778 H ASN A 72 40.198 23.183 16.450 1.00 0.00 H ATOM 779 N LYS A 76 39.519 26.095 14.503 1.00 23.23 N ATOM 780 CA LYS A 76 39.045 27.032 13.498 1.00 26.20 C ATOM 781 C LYS A 76 37.544 27.212 13.487 1.00 24.51 C ATOM 782 O LYS A 76 37.003 27.890 12.661 1.00 26.01 O ATOM 783 CB LYS A 76 39.588 26.734 12.092 1.00 29.25 C ATOM 784 CG LYS A 76 41.061 26.389 12.087 1.00 32.35 C ATOM 785 CD LYS A 76 41.743 26.501 10.742 1.00 36.73 C ATOM 786 CE LYS A 76 43.147 27.051 10.929 1.00 40.45 C ATOM 787 NZ LYS A 76 43.991 27.204 9.716 1.00 45.89 N ATOM 788 HZ1 LYS A 76 44.117 26.276 9.263 1.00 0.00 H ATOM 789 HZ2 LYS A 76 43.526 27.855 9.052 1.00 0.00 H ATOM 790 HZ3 LYS A 76 44.919 27.587 9.987 1.00 0.00 H ATOM 791 H LYS A 76 39.857 25.164 14.186 1.00 0.00 H ATOM 792 N ALA A 77 36.890 26.581 14.439 1.00 22.02 N ATOM 793 CA ALA A 77 35.473 26.705 14.654 1.00 20.93 C ATOM 794 C ALA A 77 35.108 26.372 16.089 1.00 20.02 C ATOM 795 O ALA A 77 35.868 25.712 16.803 1.00 19.58 O ATOM 796 CB ALA A 77 34.737 25.818 13.681 1.00 21.01 C ATOM 797 H ALA A 77 37.429 25.957 15.073 1.00 0.00 H ATOM 798 N SER A 78 33.954 26.875 16.506 1.00 19.47 N ATOM 799 CA SER A 78 33.472 26.732 17.888 1.00 20.03 C ATOM 800 C SER A 78 31.971 26.884 17.941 1.00 18.93 C ATOM 801 O SER A 78 31.363 27.331 16.979 1.00 20.17 O ATOM 802 CB SER A 78 34.118 27.779 18.817 1.00 19.43 C ATOM 803 OG SER A 78 34.032 29.073 18.252 1.00 19.20 O ATOM 804 HG SER A 78 34.503 29.084 17.382 1.00 0.00 H ATOM 805 H SER A 78 33.363 27.394 15.825 1.00 0.00 H ATOM 806 N ILE A 79 31.399 26.488 19.077 1.00 18.37 N ATOM 807 CA ILE A 79 29.976 26.511 19.320 1.00 17.19 C ATOM 808 C ILE A 79 29.700 27.066 20.701 1.00 18.24 C ATOM 809 O ILE A 79 30.552 26.980 21.619 1.00 17.53 O ATOM 810 CB ILE A 79 29.349 25.115 19.201 1.00 16.95 C ATOM 811 CG1 ILE A 79 29.859 24.176 20.301 1.00 16.83 C ATOM 812 CG2 ILE A 79 29.625 24.537 17.798 1.00 17.48 C ATOM 813 CD1 ILE A 79 29.274 22.790 20.217 1.00 16.34 C ATOM 814 H ILE A 79 32.017 26.140 19.838 1.00 0.00 H ATOM 815 N SER A 80 28.526 27.669 20.820 1.00 18.56 N ATOM 816 CA SER A 80 27.953 28.038 22.106 1.00 19.82 C ATOM 817 C SER A 80 26.451 27.893 21.966 1.00 19.44 C ATOM 818 O SER A 80 25.947 27.531 20.890 1.00 17.97 O ATOM 819 CB SER A 80 28.337 29.455 22.500 1.00 20.61 C ATOM 820 OG SER A 80 27.881 30.405 21.560 1.00 21.61 O ATOM 821 HG SER A 80 28.150 31.312 21.852 1.00 0.00 H ATOM 822 H SER A 80 27.990 27.888 19.956 1.00 0.00 H ATOM 823 N GLY A 81 25.743 28.165 23.053 1.00 19.09 N ATOM 824 CA GLY A 81 24.300 27.958 23.082 1.00 19.23 C ATOM 825 C GLY A 81 24.041 26.489 23.182 1.00 17.98 C ATOM 826 O GLY A 81 24.888 25.760 23.683 1.00 17.98 O ATOM 827 H GLY A 81 26.224 28.532 23.899 1.00 0.00 H ATOM 828 N GLY A 82 22.873 26.058 22.718 1.00 17.06 N ATOM 829 CA GLY A 82 22.562 24.649 22.669 1.00 17.33 C ATOM 830 C GLY A 82 22.338 24.071 24.055 1.00 17.45 C ATOM 831 O GLY A 82 22.514 22.872 24.281 1.00 17.82 O ATOM 832 H GLY A 82 22.170 26.748 22.384 1.00 0.00 H ATOM 833 N GLY A 83 22.048 24.942 24.988 1.00 17.94 N ATOM 834 CA GLY A 83 21.897 24.572 26.362 1.00 17.83 C ATOM 835 C GLY A 83 23.194 24.132 27.000 1.00 18.88 C ATOM 836 O GLY A 83 23.156 23.487 27.969 1.00 21.79 O ATOM 837 H GLY A 83 21.923 25.939 24.721 1.00 0.00 H ATOM 838 N LEU A 84 24.326 24.497 26.425 1.00 20.19 N ATOM 839 CA LEU A 84 25.646 24.126 26.905 1.00 20.30 C ATOM 840 C LEU A 84 26.156 25.086 27.964 1.00 22.46 C ATOM 841 O LEU A 84 25.900 26.240 27.875 1.00 21.92 O ATOM 842 CB LEU A 84 26.645 24.102 25.761 1.00 21.20 C ATOM 843 CG LEU A 84 26.548 23.046 24.685 1.00 21.08 C ATOM 844 CD1 LEU A 84 27.429 23.278 23.489 1.00 21.11 C ATOM 845 CD2 LEU A 84 26.608 21.645 25.227 1.00 21.01 C ATOM 846 H LEU A 84 24.268 25.089 25.572 1.00 0.00 H ATOM 847 N PRO A 85 26.962 24.594 28.898 1.00 24.59 N ATOM 848 CA PRO A 85 27.467 25.420 29.992 1.00 25.80 C ATOM 849 C PRO A 85 28.607 26.398 29.657 1.00 25.64 C ATOM 850 O PRO A 85 28.918 27.221 30.462 1.00 28.25 O ATOM 851 CB PRO A 85 27.999 24.386 30.942 1.00 27.07 C ATOM 852 CG PRO A 85 28.536 23.337 30.066 1.00 26.50 C ATOM 853 CD PRO A 85 27.721 23.345 28.810 1.00 25.20 C ATOM 854 N ALA A 86 29.180 26.305 28.483 1.00 24.62 N ATOM 855 CA ALA A 86 30.294 27.118 28.040 1.00 23.92 C ATOM 856 C ALA A 86 30.513 27.006 26.527 1.00 23.94 C ATOM 857 O ALA A 86 29.881 26.217 25.896 1.00 25.15 O ATOM 858 CB ALA A 86 31.552 26.618 28.721 1.00 23.82 C ATOM 859 H ALA A 86 28.808 25.595 27.820 1.00 0.00 H ATOM 860 N PRO A 87 31.366 27.845 25.936 1.00 22.41 N ATOM 861 CA PRO A 87 31.723 27.605 24.559 1.00 20.60 C ATOM 862 C PRO A 87 32.662 26.427 24.446 1.00 20.20 C ATOM 863 O PRO A 87 33.400 26.097 25.387 1.00 20.17 O ATOM 864 CB PRO A 87 32.394 28.903 24.098 1.00 20.84 C ATOM 865 CG PRO A 87 32.537 29.757 25.307 1.00 22.06 C ATOM 866 CD PRO A 87 32.019 29.041 26.491 1.00 22.50 C ATOM 867 N TYR A 88 32.609 25.772 23.295 1.00 18.72 N ATOM 868 CA TYR A 88 33.444 24.631 23.044 1.00 18.05 C ATOM 869 C TYR A 88 34.185 24.872 21.750 1.00 18.22 C ATOM 870 O TYR A 88 33.616 25.437 20.815 1.00 17.86 O ATOM 871 CB TYR A 88 32.577 23.376 22.920 1.00 18.09 C ATOM 872 CG TYR A 88 32.058 22.817 24.222 1.00 16.68 C ATOM 873 CD1 TYR A 88 31.104 23.493 24.956 1.00 16.25 C ATOM 874 CD2 TYR A 88 32.505 21.592 24.702 1.00 15.73 C ATOM 875 CE1 TYR A 88 30.626 22.992 26.139 1.00 15.58 C ATOM 876 CE2 TYR A 88 32.010 21.067 25.878 1.00 15.26 C ATOM 877 CZ TYR A 88 31.079 21.774 26.605 1.00 15.14 C ATOM 878 OH TYR A 88 30.595 21.274 27.809 1.00 13.73 O ATOM 879 HH TYR A 88 31.347 21.156 28.442 1.00 0.00 H ATOM 880 H TYR A 88 31.949 26.091 22.558 1.00 0.00 H ATOM 881 N GLN A 89 35.446 24.448 21.694 1.00 18.56 N ATOM 882 CA GLN A 89 36.250 24.584 20.491 1.00 20.30 C ATOM 883 C GLN A 89 36.306 23.301 19.643 1.00 19.21 C ATOM 884 O GLN A 89 36.590 22.236 20.164 1.00 16.90 O ATOM 885 CB GLN A 89 37.668 24.947 20.871 1.00 23.44 C ATOM 886 CG GLN A 89 37.799 26.312 21.517 1.00 26.91 C ATOM 887 CD GLN A 89 39.243 26.717 21.511 1.00 31.36 C ATOM 888 OE1 GLN A 89 39.711 27.327 20.542 1.00 34.27 O ATOM 889 NE2 GLN A 89 39.990 26.295 22.540 1.00 31.62 N ATOM 890 HE22 GLN A 89 39.546 25.786 23.331 1.00 0.00 H ATOM 891 HE21 GLN A 89 41.014 26.476 22.548 1.00 0.00 H ATOM 892 H GLN A 89 35.868 24.007 22.536 1.00 0.00 H ATOM 893 N ALA A 90 36.101 23.450 18.332 1.00 17.94 N ATOM 894 CA ALA A 90 36.062 22.319 17.431 1.00 18.10 C ATOM 895 C ALA A 90 37.434 21.704 17.238 1.00 18.47 C ATOM 896 O ALA A 90 38.374 22.407 16.919 1.00 17.96 O ATOM 897 CB ALA A 90 35.504 22.736 16.087 1.00 18.05 C ATOM 898 H ALA A 90 35.965 24.407 17.948 1.00 0.00 H ATOM 899 N LYS A 91 37.514 20.385 17.391 1.00 18.21 N ATOM 900 CA LYS A 91 38.758 19.655 17.253 1.00 18.53 C ATOM 901 C LYS A 91 38.765 18.796 15.999 1.00 18.76 C ATOM 902 O LYS A 91 39.713 18.823 15.246 1.00 18.10 O ATOM 903 CB LYS A 91 38.974 18.764 18.480 1.00 18.98 C ATOM 904 CG LYS A 91 39.033 19.526 19.802 1.00 21.00 C ATOM 905 CD LYS A 91 40.177 20.526 19.782 1.00 23.01 C ATOM 906 CE LYS A 91 40.581 20.988 21.161 1.00 24.36 C ATOM 907 NZ LYS A 91 41.226 22.322 21.116 1.00 25.10 N ATOM 908 HZ1 LYS A 91 42.077 22.274 20.520 1.00 0.00 H ATOM 909 HZ2 LYS A 91 40.560 23.014 20.717 1.00 0.00 H ATOM 910 HZ3 LYS A 91 41.491 22.610 22.079 1.00 0.00 H ATOM 911 H LYS A 91 36.648 19.856 17.619 1.00 0.00 H ATOM 912 N GLN A 92 37.718 18.003 15.797 1.00 19.11 N ATOM 913 CA GLN A 92 37.646 17.107 14.647 1.00 18.56 C ATOM 914 C GLN A 92 36.224 16.715 14.306 1.00 18.56 C ATOM 915 O GLN A 92 35.319 16.775 15.160 1.00 18.38 O ATOM 916 CB GLN A 92 38.505 15.876 14.855 1.00 19.29 C ATOM 917 CG GLN A 92 38.352 15.193 16.207 1.00 20.39 C ATOM 918 CD GLN A 92 37.757 13.794 16.149 1.00 19.94 C ATOM 919 OE1 GLN A 92 37.093 13.418 15.197 1.00 20.48 O ATOM 920 NE2 GLN A 92 38.004 13.020 17.177 1.00 20.33 N ATOM 921 HE22 GLN A 92 38.574 13.376 17.971 1.00 0.00 H ATOM 922 HE21 GLN A 92 37.630 12.050 17.199 1.00 0.00 H ATOM 923 H GLN A 92 36.930 18.021 16.475 1.00 0.00 H ATOM 924 N LEU A 93 36.060 16.351 13.034 1.00 17.73 N ATOM 925 CA LEU A 93 34.825 15.829 12.494 1.00 18.63 C ATOM 926 C LEU A 93 35.095 14.418 11.940 1.00 17.94 C ATOM 927 O LEU A 93 36.091 14.196 11.253 1.00 17.51 O ATOM 928 CB LEU A 93 34.324 16.795 11.416 1.00 19.39 C ATOM 929 CG LEU A 93 33.030 16.458 10.700 1.00 20.52 C ATOM 930 CD1 LEU A 93 32.346 17.742 10.224 1.00 21.40 C ATOM 931 CD2 LEU A 93 33.232 15.490 9.541 1.00 19.84 C ATOM 932 H LEU A 93 36.871 16.449 12.390 1.00 0.00 H ATOM 933 N HIS A 94 34.262 13.447 12.277 1.00 17.06 N ATOM 934 CA HIS A 94 34.421 12.116 11.678 1.00 16.88 C ATOM 935 C HIS A 94 33.071 11.449 11.495 1.00 16.70 C ATOM 936 O HIS A 94 32.052 12.030 11.826 1.00 16.43 O ATOM 937 CB HIS A 94 35.395 11.252 12.487 1.00 16.88 C ATOM 938 CG HIS A 94 34.890 10.955 13.851 1.00 16.72 C ATOM 939 ND1 HIS A 94 35.189 11.751 14.926 1.00 17.24 N ATOM 940 CD2 HIS A 94 34.012 10.033 14.297 1.00 17.14 C ATOM 941 CE1 HIS A 94 34.564 11.310 15.998 1.00 17.65 C ATOM 942 NE2 HIS A 94 33.825 10.280 15.637 1.00 18.63 N ATOM 943 H HIS A 94 33.500 13.625 12.962 1.00 0.00 H ATOM 944 N LEU A 95 33.064 10.256 10.894 1.00 17.24 N ATOM 945 CA LEU A 95 31.808 9.552 10.602 1.00 16.60 C ATOM 946 C LEU A 95 31.837 8.055 10.920 1.00 15.16 C ATOM 947 O LEU A 95 32.869 7.442 11.117 1.00 14.57 O ATOM 948 CB LEU A 95 31.381 9.776 9.135 1.00 17.42 C ATOM 949 CG LEU A 95 31.188 11.224 8.648 1.00 17.78 C ATOM 950 CD1 LEU A 95 32.461 11.754 8.010 1.00 18.31 C ATOM 951 CD2 LEU A 95 30.066 11.344 7.632 1.00 18.96 C ATOM 952 H LEU A 95 33.968 9.816 10.627 1.00 0.00 H ATOM 953 N HIS A 96 30.648 7.499 10.973 1.00 14.48 N ATOM 954 CA HIS A 96 30.434 6.079 11.125 1.00 14.58 C ATOM 955 C HIS A 96 29.415 5.725 10.056 1.00 15.29 C ATOM 956 O HIS A 96 28.478 6.509 9.837 1.00 14.60 O ATOM 957 CB HIS A 96 29.839 5.813 12.517 1.00 14.02 C ATOM 958 CG HIS A 96 30.704 6.297 13.634 1.00 13.82 C ATOM 959 ND1 HIS A 96 31.606 5.480 14.273 1.00 13.64 N ATOM 960 CD2 HIS A 96 30.838 7.521 14.202 1.00 13.72 C ATOM 961 CE1 HIS A 96 32.236 6.164 15.213 1.00 13.41 C ATOM 962 NE2 HIS A 96 31.780 7.401 15.192 1.00 13.55 N ATOM 963 H HIS A 96 29.814 8.116 10.901 1.00 0.00 H ATOM 964 N TRP A 97 29.566 4.572 9.410 1.00 14.48 N ATOM 965 CA TRP A 97 28.655 4.204 8.313 1.00 15.02 C ATOM 966 C TRP A 97 28.590 2.679 8.089 1.00 14.56 C ATOM 967 O TRP A 97 29.360 1.928 8.668 1.00 15.31 O ATOM 968 CB TRP A 97 29.068 4.945 7.027 1.00 14.72 C ATOM 969 CG TRP A 97 30.457 4.547 6.579 1.00 15.12 C ATOM 970 CD1 TRP A 97 30.792 3.468 5.786 1.00 15.59 C ATOM 971 CD2 TRP A 97 31.691 5.169 6.943 1.00 15.19 C ATOM 972 NE1 TRP A 97 32.154 3.400 5.630 1.00 15.32 N ATOM 973 CE2 TRP A 97 32.731 4.433 6.321 1.00 15.63 C ATOM 974 CE3 TRP A 97 32.022 6.285 7.721 1.00 15.85 C ATOM 975 CZ2 TRP A 97 34.079 4.775 6.457 1.00 15.99 C ATOM 976 CZ3 TRP A 97 33.372 6.648 7.840 1.00 16.09 C ATOM 977 CH2 TRP A 97 34.385 5.876 7.227 1.00 16.55 C ATOM 978 HE1 TRP A 97 32.665 2.682 5.078 1.00 0.00 H ATOM 979 H TRP A 97 30.334 3.925 9.682 1.00 0.00 H ATOM 980 N SER A 98 27.626 2.250 7.288 1.00 14.61 N ATOM 981 CA SER A 98 27.550 0.910 6.778 1.00 14.97 C ATOM 982 C SER A 98 27.455 0.994 5.250 1.00 15.80 C ATOM 983 O SER A 98 27.898 1.993 4.644 1.00 16.85 O ATOM 984 CB SER A 98 26.349 0.217 7.387 1.00 15.25 C ATOM 985 OG SER A 98 26.273 -1.119 6.940 1.00 15.97 O ATOM 986 HG SER A 98 27.095 -1.602 7.207 1.00 0.00 H ATOM 987 H SER A 98 26.882 2.922 7.013 1.00 0.00 H ATOM 988 N ASP A 99 26.918 -0.042 4.614 1.00 16.58 N ATOM 989 CA ASP A 99 26.582 0.020 3.180 1.00 17.98 C ATOM 990 C ASP A 99 25.111 -0.363 2.881 1.00 20.22 C ATOM 991 O ASP A 99 24.747 -0.583 1.724 1.00 20.58 O ATOM 992 CB ASP A 99 27.565 -0.865 2.374 1.00 18.02 C ATOM 993 CG ASP A 99 27.661 -2.284 2.914 1.00 18.08 C ATOM 994 OD1 ASP A 99 26.951 -2.602 3.895 1.00 18.37 O ATOM 995 OD2 ASP A 99 28.479 -3.066 2.412 1.00 17.64 O ATOM 996 H ASP A 99 26.730 -0.919 5.141 1.00 0.00 H ATOM 997 N LEU A 100 24.279 -0.433 3.918 1.00 22.30 N ATOM 998 CA LEU A 100 22.835 -0.638 3.791 1.00 24.83 C ATOM 999 C LEU A 100 22.119 0.565 4.434 1.00 27.47 C ATOM 1000 O LEU A 100 22.583 1.062 5.438 1.00 25.95 O ATOM 1001 CB LEU A 100 22.458 -1.928 4.489 1.00 25.56 C ATOM 1002 CG LEU A 100 23.169 -3.154 3.901 1.00 26.48 C ATOM 1003 CD1 LEU A 100 22.881 -4.391 4.725 1.00 25.95 C ATOM 1004 CD2 LEU A 100 22.735 -3.349 2.443 1.00 26.83 C ATOM 1005 H LEU A 100 24.678 -0.336 4.874 1.00 0.00 H ATOM 1006 N PRO A 101 20.982 1.032 3.862 1.00 31.83 N ATOM 1007 CA PRO A 101 20.412 2.318 4.319 1.00 31.60 C ATOM 1008 C PRO A 101 19.871 2.343 5.733 1.00 31.13 C ATOM 1009 O PRO A 101 19.773 3.407 6.331 1.00 33.34 O ATOM 1010 CB PRO A 101 19.281 2.588 3.320 1.00 33.19 C ATOM 1011 CG PRO A 101 19.608 1.718 2.149 1.00 34.38 C ATOM 1012 CD PRO A 101 20.186 0.477 2.757 1.00 33.07 C ATOM 1013 N TYR A 102 19.592 1.181 6.282 1.00 28.90 N ATOM 1014 CA TYR A 102 18.947 1.077 7.587 1.00 30.37 C ATOM 1015 C TYR A 102 19.923 0.802 8.725 1.00 26.83 C ATOM 1016 O TYR A 102 19.506 0.474 9.818 1.00 25.37 O ATOM 1017 CB TYR A 102 17.900 -0.026 7.533 1.00 31.39 C ATOM 1018 CG TYR A 102 18.465 -1.374 7.140 1.00 32.26 C ATOM 1019 CD1 TYR A 102 18.376 -1.835 5.810 1.00 33.98 C ATOM 1020 CD2 TYR A 102 19.067 -2.205 8.092 1.00 33.48 C ATOM 1021 CE1 TYR A 102 18.865 -3.084 5.455 1.00 34.10 C ATOM 1022 CE2 TYR A 102 19.570 -3.442 7.740 1.00 33.73 C ATOM 1023 CZ TYR A 102 19.460 -3.873 6.431 1.00 34.28 C ATOM 1024 OH TYR A 102 19.946 -5.108 6.110 1.00 37.10 O ATOM 1025 HH TYR A 102 19.799 -5.279 5.146 1.00 0.00 H ATOM 1026 H TYR A 102 19.839 0.310 5.771 1.00 0.00 H ATOM 1027 N LYS A 103 21.214 0.892 8.444 1.00 25.72 N ATOM 1028 CA LYS A 103 22.237 0.809 9.466 1.00 26.17 C ATOM 1029 C LYS A 103 23.411 1.676 9.043 1.00 26.30 C ATOM 1030 O LYS A 103 23.511 2.096 7.887 1.00 26.96 O ATOM 1031 CB LYS A 103 22.681 -0.632 9.711 1.00 27.87 C ATOM 1032 CG LYS A 103 23.109 -1.382 8.482 1.00 29.71 C ATOM 1033 CD LYS A 103 23.150 -2.887 8.718 1.00 33.11 C ATOM 1034 CE LYS A 103 24.152 -3.282 9.782 1.00 34.99 C ATOM 1035 NZ LYS A 103 24.653 -4.682 9.573 1.00 38.25 N ATOM 1036 HZ1 LYS A 103 23.852 -5.345 9.611 1.00 0.00 H ATOM 1037 HZ2 LYS A 103 25.115 -4.748 8.644 1.00 0.00 H ATOM 1038 HZ3 LYS A 103 25.337 -4.919 10.320 1.00 0.00 H ATOM 1039 H LYS A 103 21.504 1.027 7.454 1.00 0.00 H ATOM 1040 N GLY A 104 24.288 1.957 9.996 1.00 23.23 N ATOM 1041 CA GLY A 104 25.367 2.918 9.795 1.00 20.66 C ATOM 1042 C GLY A 104 25.484 3.933 10.923 1.00 17.98 C ATOM 1043 O GLY A 104 26.575 4.340 11.248 1.00 18.76 O ATOM 1044 H GLY A 104 24.204 1.478 10.915 1.00 0.00 H ATOM 1045 N SER A 105 24.371 4.334 11.518 1.00 16.15 N ATOM 1046 CA SER A 105 24.402 5.253 12.640 1.00 15.77 C ATOM 1047 C SER A 105 24.706 4.528 13.967 1.00 14.50 C ATOM 1048 O SER A 105 24.536 3.313 14.098 1.00 13.19 O ATOM 1049 CB SER A 105 23.105 6.103 12.713 1.00 16.56 C ATOM 1050 OG SER A 105 21.998 5.345 13.182 1.00 16.60 O ATOM 1051 HG SER A 105 22.195 5.002 14.089 1.00 0.00 H ATOM 1052 H SER A 105 23.455 3.982 11.173 1.00 0.00 H ATOM 1053 N GLU A 106 25.232 5.288 14.910 1.00 13.47 N ATOM 1054 CA GLU A 106 25.613 4.741 16.189 1.00 13.89 C ATOM 1055 C GLU A 106 24.395 4.850 17.087 1.00 13.71 C ATOM 1056 O GLU A 106 23.957 3.836 17.663 1.00 12.70 O ATOM 1057 CB GLU A 106 26.868 5.448 16.759 1.00 13.66 C ATOM 1058 CG GLU A 106 28.137 5.105 15.998 1.00 14.31 C ATOM 1059 CD GLU A 106 29.390 5.161 16.868 1.00 14.49 C ATOM 1060 OE1 GLU A 106 29.743 6.286 17.359 1.00 14.63 O ATOM 1061 OE2 GLU A 106 30.020 4.080 17.055 1.00 13.51 O ATOM 1062 H GLU A 106 25.374 6.302 14.727 1.00 0.00 H ATOM 1063 N HIS A 107 23.852 6.061 17.204 1.00 13.40 N ATOM 1064 CA HIS A 107 22.542 6.243 17.844 1.00 14.47 C ATOM 1065 C HIS A 107 21.387 5.777 16.931 1.00 14.91 C ATOM 1066 O HIS A 107 21.512 5.714 15.690 1.00 13.84 O ATOM 1067 CB HIS A 107 22.296 7.706 18.241 1.00 15.02 C ATOM 1068 CG HIS A 107 23.277 8.231 19.245 1.00 15.57 C ATOM 1069 ND1 HIS A 107 24.497 8.760 18.889 1.00 15.72 N ATOM 1070 CD2 HIS A 107 23.230 8.280 20.598 1.00 15.64 C ATOM 1071 CE1 HIS A 107 25.148 9.131 19.985 1.00 15.63 C ATOM 1072 NE2 HIS A 107 24.419 8.814 21.031 1.00 14.69 N ATOM 1073 H HIS A 107 24.363 6.889 16.837 1.00 0.00 H ATOM 1074 N SER A 108 20.262 5.487 17.577 1.00 15.63 N ATOM 1075 CA SER A 108 19.009 5.222 16.891 1.00 16.37 C ATOM 1076 C SER A 108 17.923 6.124 17.468 1.00 17.18 C ATOM 1077 O SER A 108 17.931 6.442 18.670 1.00 16.30 O ATOM 1078 CB SER A 108 18.618 3.704 16.965 1.00 16.91 C ATOM 1079 OG SER A 108 18.434 3.177 18.289 1.00 16.22 O ATOM 1080 HG SER A 108 18.191 2.219 18.231 1.00 0.00 H ATOM 1081 H SER A 108 20.279 5.448 18.616 1.00 0.00 H ATOM 1082 N LEU A 109 17.021 6.570 16.582 1.00 18.55 N ATOM 1083 CA LEU A 109 15.787 7.290 16.963 1.00 20.12 C ATOM 1084 C LEU A 109 14.592 6.360 16.832 1.00 18.53 C ATOM 1085 O LEU A 109 14.253 5.902 15.747 1.00 18.13 O ATOM 1086 CB LEU A 109 15.537 8.535 16.090 1.00 21.44 C ATOM 1087 CG LEU A 109 16.619 9.623 16.132 1.00 22.72 C ATOM 1088 CD1 LEU A 109 16.111 10.843 15.351 1.00 23.49 C ATOM 1089 CD2 LEU A 109 16.995 10.005 17.572 1.00 22.64 C ATOM 1090 H LEU A 109 17.199 6.400 15.572 1.00 0.00 H ATOM 1091 N ASP A 110 13.997 6.051 17.970 1.00 17.97 N ATOM 1092 CA ASP A 110 12.818 5.216 18.027 1.00 18.65 C ATOM 1093 C ASP A 110 13.085 3.867 17.363 1.00 16.77 C ATOM 1094 O ASP A 110 12.231 3.351 16.689 1.00 14.81 O ATOM 1095 CB ASP A 110 11.599 5.950 17.399 1.00 18.93 C ATOM 1096 CG ASP A 110 11.251 7.224 18.149 1.00 19.98 C ATOM 1097 OD1 ASP A 110 11.312 7.207 19.393 1.00 21.01 O ATOM 1098 OD2 ASP A 110 10.916 8.243 17.521 1.00 20.81 O ATOM 1099 H ASP A 110 14.391 6.422 18.858 1.00 0.00 H ATOM 1100 N GLY A 111 14.294 3.340 17.547 1.00 17.22 N ATOM 1101 CA GLY A 111 14.668 2.051 16.989 1.00 18.60 C ATOM 1102 C GLY A 111 15.079 2.041 15.533 1.00 19.33 C ATOM 1103 O GLY A 111 15.324 0.976 15.009 1.00 19.03 O ATOM 1104 H GLY A 111 14.993 3.868 18.108 1.00 0.00 H ATOM 1105 N GLU A 112 15.156 3.209 14.884 1.00 20.34 N ATOM 1106 CA GLU A 112 15.627 3.317 13.501 1.00 21.74 C ATOM 1107 C GLU A 112 17.065 3.822 13.483 1.00 20.89 C ATOM 1108 O GLU A 112 17.375 4.866 14.078 1.00 19.50 O ATOM 1109 CB GLU A 112 14.784 4.312 12.715 1.00 24.60 C ATOM 1110 CG GLU A 112 13.301 3.995 12.714 1.00 28.59 C ATOM 1111 CD GLU A 112 12.555 4.667 11.562 1.00 30.29 C ATOM 1112 OE1 GLU A 112 12.216 5.877 11.667 1.00 30.85 O ATOM 1113 OE2 GLU A 112 12.307 3.958 10.567 1.00 32.95 O ATOM 1114 H GLU A 112 14.870 4.076 15.382 1.00 0.00 H ATOM 1115 N HIS A 113 17.919 3.068 12.798 1.00 20.04 N ATOM 1116 CA HIS A 113 19.280 3.464 12.524 1.00 19.89 C ATOM 1117 C HIS A 113 19.280 4.136 11.186 1.00 19.21 C ATOM 1118 O HIS A 113 18.509 3.773 10.335 1.00 20.76 O ATOM 1119 CB HIS A 113 20.186 2.237 12.500 1.00 21.01 C ATOM 1120 CG HIS A 113 20.439 1.658 13.856 1.00 23.23 C ATOM 1121 ND1 HIS A 113 21.530 2.016 14.627 1.00 25.10 N ATOM 1122 CD2 HIS A 113 19.722 0.787 14.598 1.00 23.85 C ATOM 1123 CE1 HIS A 113 21.504 1.332 15.757 1.00 24.70 C ATOM 1124 NE2 HIS A 113 20.410 0.590 15.770 1.00 24.05 N ATOM 1125 H HIS A 113 17.591 2.148 12.442 1.00 0.00 H ATOM 1126 N PHE A 114 20.145 5.118 11.014 1.00 18.35 N ATOM 1127 CA PHE A 114 20.293 5.820 9.755 1.00 17.83 C ATOM 1128 C PHE A 114 21.527 5.316 9.028 1.00 16.39 C ATOM 1129 O PHE A 114 22.256 4.464 9.543 1.00 16.66 O ATOM 1130 CB PHE A 114 20.339 7.321 10.020 1.00 18.91 C ATOM 1131 CG PHE A 114 19.000 7.884 10.343 1.00 19.58 C ATOM 1132 CD1 PHE A 114 18.399 7.605 11.562 1.00 20.00 C ATOM 1133 CD2 PHE A 114 18.320 8.663 9.421 1.00 21.20 C ATOM 1134 CE1 PHE A 114 17.146 8.118 11.876 1.00 20.22 C ATOM 1135 CE2 PHE A 114 17.053 9.182 9.724 1.00 21.41 C ATOM 1136 CZ PHE A 114 16.464 8.896 10.945 1.00 20.69 C ATOM 1137 H PHE A 114 20.745 5.400 11.815 1.00 0.00 H ATOM 1138 N ALA A 115 21.753 5.810 7.823 1.00 14.99 N ATOM 1139 CA ALA A 115 22.795 5.239 6.955 1.00 14.81 C ATOM 1140 C ALA A 115 24.213 5.644 7.390 1.00 14.43 C ATOM 1141 O ALA A 115 25.169 4.963 7.078 1.00 13.35 O ATOM 1142 CB ALA A 115 22.537 5.639 5.517 1.00 14.52 C ATOM 1143 H ALA A 115 21.186 6.613 7.484 1.00 0.00 H ATOM 1144 N MET A 116 24.345 6.801 8.032 1.00 14.93 N ATOM 1145 CA MET A 116 25.610 7.206 8.627 1.00 15.00 C ATOM 1146 C MET A 116 25.309 8.090 9.817 1.00 14.31 C ATOM 1147 O MET A 116 24.183 8.550 9.966 1.00 13.82 O ATOM 1148 CB MET A 116 26.490 8.001 7.650 1.00 15.84 C ATOM 1149 CG MET A 116 26.432 7.642 6.175 1.00 16.39 C ATOM 1150 SD MET A 116 27.541 8.720 5.241 1.00 17.32 S ATOM 1151 CE MET A 116 29.182 8.088 5.535 1.00 18.40 C ATOM 1152 H MET A 116 23.523 7.433 8.111 1.00 0.00 H ATOM 1153 N GLU A 117 26.330 8.314 10.646 1.00 14.79 N ATOM 1154 CA GLU A 117 26.306 9.331 11.709 1.00 14.90 C ATOM 1155 C GLU A 117 27.599 10.128 11.724 1.00 15.36 C ATOM 1156 O GLU A 117 28.682 9.561 11.764 1.00 16.48 O ATOM 1157 CB GLU A 117 26.072 8.685 13.062 1.00 14.51 C ATOM 1158 CG GLU A 117 25.788 9.656 14.187 1.00 14.74 C ATOM 1159 CD GLU A 117 25.298 8.980 15.471 1.00 14.66 C ATOM 1160 OE1 GLU A 117 24.616 7.933 15.426 1.00 15.27 O ATOM 1161 OE2 GLU A 117 25.602 9.488 16.555 1.00 14.69 O ATOM 1162 H GLU A 117 27.189 7.739 10.535 1.00 0.00 H ATOM 1163 N MET A 118 27.485 11.452 11.676 1.00 16.28 N ATOM 1164 CA MET A 118 28.631 12.369 11.686 1.00 16.90 C ATOM 1165 C MET A 118 28.748 12.986 13.063 1.00 16.84 C ATOM 1166 O MET A 118 27.751 13.466 13.627 1.00 16.63 O ATOM 1167 CB MET A 118 28.412 13.481 10.682 1.00 17.98 C ATOM 1168 CG MET A 118 29.560 14.459 10.527 1.00 19.77 C ATOM 1169 SD MET A 118 29.186 15.616 9.164 1.00 23.29 S ATOM 1170 CE MET A 118 28.179 16.709 10.066 1.00 21.14 C ATOM 1171 H MET A 118 26.530 11.861 11.629 1.00 0.00 H ATOM 1172 N HIS A 119 29.966 12.974 13.584 1.00 15.41 N ATOM 1173 CA HIS A 119 30.266 13.493 14.894 1.00 14.72 C ATOM 1174 C HIS A 119 31.228 14.638 14.726 1.00 15.83 C ATOM 1175 O HIS A 119 32.240 14.495 14.015 1.00 17.25 O ATOM 1176 CB HIS A 119 30.871 12.404 15.726 1.00 14.09 C ATOM 1177 CG HIS A 119 29.888 11.345 16.105 1.00 13.99 C ATOM 1178 ND1 HIS A 119 30.267 10.077 16.472 1.00 13.90 N ATOM 1179 CD2 HIS A 119 28.534 11.368 16.173 1.00 13.47 C ATOM 1180 CE1 HIS A 119 29.193 9.371 16.774 1.00 13.84 C ATOM 1181 NE2 HIS A 119 28.131 10.133 16.600 1.00 13.28 N ATOM 1182 H HIS A 119 30.742 12.571 13.021 1.00 0.00 H ATOM 1183 N ILE A 120 30.880 15.786 15.308 1.00 15.06 N ATOM 1184 CA ILE A 120 31.783 16.911 15.400 1.00 15.56 C ATOM 1185 C ILE A 120 32.169 17.063 16.877 1.00 15.52 C ATOM 1186 O ILE A 120 31.318 17.286 17.755 1.00 15.41 O ATOM 1187 CB ILE A 120 31.180 18.223 14.832 1.00 15.93 C ATOM 1188 CG1 ILE A 120 30.548 18.016 13.463 1.00 16.62 C ATOM 1189 CG2 ILE A 120 32.274 19.267 14.674 1.00 16.14 C ATOM 1190 CD1 ILE A 120 29.825 19.249 12.896 1.00 17.06 C ATOM 1191 H ILE A 120 29.925 15.875 15.710 1.00 0.00 H ATOM 1192 N VAL A 121 33.468 16.973 17.129 1.00 15.30 N ATOM 1193 CA VAL A 121 33.998 16.798 18.455 1.00 15.76 C ATOM 1194 C VAL A 121 34.549 18.147 18.888 1.00 15.84 C ATOM 1195 O VAL A 121 35.357 18.749 18.187 1.00 14.86 O ATOM 1196 CB VAL A 121 35.087 15.718 18.470 1.00 16.18 C ATOM 1197 CG1 VAL A 121 35.612 15.474 19.876 1.00 17.78 C ATOM 1198 CG2 VAL A 121 34.548 14.415 17.916 1.00 16.52 C ATOM 1199 H VAL A 121 34.134 17.032 16.332 1.00 0.00 H ATOM 1200 N HIS A 122 34.077 18.625 20.037 1.00 15.51 N ATOM 1201 CA HIS A 122 34.500 19.919 20.579 1.00 16.08 C ATOM 1202 C HIS A 122 34.959 19.757 22.021 1.00 16.45 C ATOM 1203 O HIS A 122 34.522 18.841 22.723 1.00 15.44 O ATOM 1204 CB HIS A 122 33.373 20.964 20.587 1.00 16.01 C ATOM 1205 CG HIS A 122 32.685 21.176 19.276 1.00 15.68 C ATOM 1206 ND1 HIS A 122 31.872 20.227 18.697 1.00 15.74 N ATOM 1207 CD2 HIS A 122 32.626 22.259 18.471 1.00 15.34 C ATOM 1208 CE1 HIS A 122 31.390 20.695 17.564 1.00 15.14 C ATOM 1209 NE2 HIS A 122 31.822 21.929 17.409 1.00 14.86 N ATOM 1210 H HIS A 122 33.384 18.061 20.569 1.00 0.00 H ATOM 1211 N GLU A 123 35.806 20.690 22.464 1.00 18.24 N ATOM 1212 CA GLU A 123 36.326 20.705 23.840 1.00 19.60 C ATOM 1213 C GLU A 123 35.975 21.950 24.631 1.00 18.25 C ATOM 1214 O GLU A 123 36.046 23.086 24.131 1.00 15.47 O ATOM 1215 CB GLU A 123 37.830 20.510 23.857 1.00 22.64 C ATOM 1216 CG GLU A 123 38.222 19.056 23.668 1.00 26.92 C ATOM 1217 CD GLU A 123 39.722 18.855 23.541 1.00 31.44 C ATOM 1218 OE1 GLU A 123 40.483 19.765 23.947 1.00 35.43 O ATOM 1219 OE2 GLU A 123 40.138 17.789 23.033 1.00 34.96 O ATOM 1220 H GLU A 123 36.111 21.438 21.808 1.00 0.00 H ATOM 1221 N LYS A 124 35.619 21.698 25.888 1.00 17.41 N ATOM 1222 CA LYS A 124 35.074 22.723 26.759 1.00 18.39 C ATOM 1223 C LYS A 124 36.104 23.814 27.051 1.00 19.01 C ATOM 1224 O LYS A 124 37.265 23.516 27.374 1.00 17.52 O ATOM 1225 CB LYS A 124 34.639 22.097 28.076 1.00 18.84 C ATOM 1226 CG LYS A 124 33.763 22.993 28.921 1.00 19.69 C ATOM 1227 CD LYS A 124 33.319 22.230 30.156 1.00 20.84 C ATOM 1228 CE LYS A 124 32.266 22.980 30.968 1.00 21.38 C ATOM 1229 NZ LYS A 124 32.012 22.295 32.279 1.00 22.09 N ATOM 1230 HZ1 LYS A 124 31.673 21.328 32.103 1.00 0.00 H ATOM 1231 HZ2 LYS A 124 32.895 22.260 32.827 1.00 0.00 H ATOM 1232 HZ3 LYS A 124 31.293 22.824 32.812 1.00 0.00 H ATOM 1233 H LYS A 124 35.735 20.733 26.259 1.00 0.00 H ATOM 1234 N GLU A 125 35.676 25.065 26.929 1.00 19.24 N ATOM 1235 CA GLU A 125 36.417 26.181 27.537 1.00 21.28 C ATOM 1236 C GLU A 125 36.118 26.253 29.041 1.00 21.26 C ATOM 1237 O GLU A 125 35.100 26.811 29.469 1.00 21.60 O ATOM 1238 CB GLU A 125 36.090 27.495 26.845 1.00 21.12 C ATOM 1239 CG GLU A 125 36.620 27.487 25.424 1.00 22.30 C ATOM 1240 CD GLU A 125 36.511 28.822 24.746 1.00 23.25 C ATOM 1241 OE1 GLU A 125 36.694 28.851 23.511 1.00 23.28 O ATOM 1242 OE2 GLU A 125 36.230 29.827 25.446 1.00 25.95 O ATOM 1243 H GLU A 125 34.804 25.259 26.396 1.00 0.00 H ATOM 1244 N LYS A 126 37.016 25.677 29.825 1.00 22.70 N ATOM 1245 CA LYS A 126 36.830 25.587 31.269 1.00 24.09 C ATOM 1246 C LYS A 126 37.263 26.849 31.987 1.00 24.80 C ATOM 1247 O LYS A 126 38.088 27.586 31.484 1.00 24.43 O ATOM 1248 CB LYS A 126 37.571 24.379 31.807 1.00 26.57 C ATOM 1249 CG LYS A 126 36.891 23.078 31.386 1.00 28.65 C ATOM 1250 CD LYS A 126 37.490 21.804 32.020 1.00 31.16 C ATOM 1251 CE LYS A 126 38.917 21.490 31.593 1.00 30.44 C ATOM 1252 NZ LYS A 126 39.111 21.747 30.135 1.00 31.48 N ATOM 1253 HZ1 LYS A 126 38.460 21.147 29.589 1.00 0.00 H ATOM 1254 HZ2 LYS A 126 38.915 22.748 29.932 1.00 0.00 H ATOM 1255 HZ3 LYS A 126 40.092 21.524 29.873 1.00 0.00 H ATOM 1256 H LYS A 126 37.877 25.278 29.400 1.00 0.00 H ATOM 1257 N GLY A 126A 36.650 27.121 33.131 1.00 27.28 N ATOM 1258 CA GLY A 126A 37.093 28.192 34.013 1.00 31.14 C ATOM 1259 C GLY A 126A 38.016 27.607 35.059 1.00 34.93 C ATOM 1260 O GLY A 126A 38.274 26.405 35.035 1.00 36.72 O ATOM 1261 H GLY A 126A 35.826 26.551 33.408 1.00 0.00 H ATOM 1262 N THR A 127 38.549 28.442 35.956 1.00 40.66 N ATOM 1263 CA THR A 127 39.073 27.933 37.224 1.00 46.61 C ATOM 1264 C THR A 127 37.845 27.714 38.136 1.00 55.52 C ATOM 1265 O THR A 127 36.902 28.543 38.125 1.00 58.84 O ATOM 1266 CB THR A 127 40.061 28.893 37.918 1.00 44.51 C ATOM 1267 OG1 THR A 127 39.411 30.139 38.157 1.00 47.86 O ATOM 1268 CG2 THR A 127 41.309 29.124 37.097 1.00 41.31 C ATOM 1269 HG1 THR A 127 38.624 29.993 38.739 1.00 0.00 H ATOM 1270 H THR A 127 38.592 29.461 35.751 1.00 0.00 H ATOM 1271 N SER A 128 37.842 26.613 38.897 1.00 60.49 N ATOM 1272 CA SER A 128 36.729 26.294 39.832 1.00 67.16 C ATOM 1273 C SER A 128 36.943 26.914 41.223 1.00 66.21 C ATOM 1274 O SER A 128 37.300 26.225 42.182 1.00 63.67 O ATOM 1275 CB SER A 128 36.504 24.772 39.926 1.00 67.24 C ATOM 1276 OG SER A 128 35.610 24.429 40.975 1.00 68.83 O ATOM 1277 HG SER A 128 35.981 24.741 41.838 1.00 0.00 H ATOM 1278 H SER A 128 38.646 25.957 38.833 1.00 0.00 H TER 1279 SER A 128 ATOM 1280 N ASP A 136 38.233 16.285 32.012 1.00 50.75 N ATOM 1281 CA ASP A 136 38.072 16.131 33.478 1.00 51.87 C ATOM 1282 C ASP A 136 36.579 16.081 33.922 1.00 45.12 C ATOM 1283 O ASP A 136 36.166 15.099 34.532 1.00 42.51 O ATOM 1284 CB ASP A 136 38.901 17.209 34.239 1.00 54.70 C ATOM 1285 CG ASP A 136 38.642 17.223 35.745 1.00 55.43 C ATOM 1286 OD1 ASP A 136 38.457 16.140 36.326 1.00 63.29 O ATOM 1287 OD2 ASP A 136 38.649 18.316 36.351 1.00 55.89 O ATOM 1288 HN3 ASP A 136 37.781 17.170 31.706 1.00 0.00 H ATOM 1289 HN2 ASP A 136 37.785 15.480 31.529 1.00 0.00 H ATOM 1290 HN1 ASP A 136 39.246 16.312 31.777 1.00 0.00 H ATOM 1291 N PRO A 137 35.769 17.120 33.608 1.00 37.12 N ATOM 1292 CA PRO A 137 34.342 17.010 33.950 1.00 35.00 C ATOM 1293 C PRO A 137 33.547 16.068 33.020 1.00 32.33 C ATOM 1294 O PRO A 137 34.061 15.622 31.987 1.00 31.08 O ATOM 1295 CB PRO A 137 33.844 18.461 33.827 1.00 34.63 C ATOM 1296 CG PRO A 137 34.766 19.083 32.818 1.00 36.82 C ATOM 1297 CD PRO A 137 36.105 18.456 33.075 1.00 36.73 C ATOM 1298 N GLU A 138 32.308 15.776 33.419 1.00 30.01 N ATOM 1299 CA GLU A 138 31.343 14.990 32.642 1.00 31.26 C ATOM 1300 C GLU A 138 31.050 15.537 31.251 1.00 27.07 C ATOM 1301 O GLU A 138 30.562 14.793 30.404 1.00 24.08 O ATOM 1302 CB GLU A 138 29.978 14.992 33.337 1.00 36.45 C ATOM 1303 CG GLU A 138 29.807 13.961 34.422 1.00 44.81 C ATOM 1304 CD GLU A 138 28.402 13.961 35.025 1.00 49.86 C ATOM 1305 OE1 GLU A 138 27.679 14.980 34.893 1.00 48.18 O ATOM 1306 OE2 GLU A 138 28.033 12.927 35.639 1.00 56.32 O ATOM 1307 H GLU A 138 32.004 16.131 34.348 1.00 0.00 H ATOM 1308 N ASP A 139 31.227 16.852 31.078 1.00 23.90 N ATOM 1309 CA ASP A 139 30.874 17.556 29.845 1.00 21.98 C ATOM 1310 C ASP A 139 32.061 18.271 29.211 1.00 20.43 C ATOM 1311 O ASP A 139 31.879 19.270 28.531 1.00 19.96 O ATOM 1312 CB ASP A 139 29.713 18.531 30.095 1.00 22.02 C ATOM 1313 CG ASP A 139 30.031 19.581 31.159 1.00 21.97 C ATOM 1314 OD1 ASP A 139 31.179 19.632 31.648 1.00 21.03 O ATOM 1315 OD2 ASP A 139 29.104 20.332 31.523 1.00 23.28 O ATOM 1316 H ASP A 139 31.636 17.402 31.860 1.00 0.00 H ATOM 1317 N GLU A 140 33.253 17.743 29.452 1.00 19.47 N ATOM 1318 CA GLU A 140 34.510 18.203 28.858 1.00 20.52 C ATOM 1319 C GLU A 140 34.470 18.187 27.325 1.00 19.83 C ATOM 1320 O GLU A 140 35.044 19.064 26.678 1.00 19.06 O ATOM 1321 CB GLU A 140 35.666 17.307 29.359 1.00 21.68 C ATOM 1322 CG GLU A 140 37.026 17.425 28.658 1.00 23.71 C ATOM 1323 CD GLU A 140 37.556 18.846 28.617 1.00 27.43 C ATOM 1324 OE1 GLU A 140 38.230 19.210 27.605 1.00 29.73 O ATOM 1325 OE2 GLU A 140 37.279 19.605 29.589 1.00 31.55 O ATOM 1326 H GLU A 140 33.299 16.941 30.113 1.00 0.00 H ATOM 1327 N ILE A 141 33.801 17.175 26.770 1.00 19.43 N ATOM 1328 CA ILE A 141 33.668 17.013 25.339 1.00 18.28 C ATOM 1329 C ILE A 141 32.210 17.184 24.982 1.00 17.39 C ATOM 1330 O ILE A 141 31.368 16.597 25.625 1.00 18.12 O ATOM 1331 CB ILE A 141 34.221 15.631 24.928 1.00 18.78 C ATOM 1332 CG1 ILE A 141 35.716 15.622 25.220 1.00 19.03 C ATOM 1333 CG2 ILE A 141 33.975 15.370 23.445 1.00 19.05 C ATOM 1334 CD1 ILE A 141 36.410 14.348 24.869 1.00 20.55 C ATOM 1335 H ILE A 141 33.356 16.472 27.394 1.00 0.00 H ATOM 1336 N ALA A 142 31.933 18.053 24.000 1.00 16.63 N ATOM 1337 CA ALA A 142 30.640 18.170 23.325 1.00 16.37 C ATOM 1338 C ALA A 142 30.745 17.592 21.920 1.00 15.73 C ATOM 1339 O ALA A 142 31.520 18.059 21.095 1.00 15.14 O ATOM 1340 CB ALA A 142 30.184 19.630 23.242 1.00 16.87 C ATOM 1341 H ALA A 142 32.694 18.692 23.695 1.00 0.00 H ATOM 1342 N VAL A 143 29.968 16.552 21.660 1.00 15.75 N ATOM 1343 CA VAL A 143 29.904 15.970 20.325 1.00 14.63 C ATOM 1344 C VAL A 143 28.544 16.318 19.790 1.00 13.79 C ATOM 1345 O VAL A 143 27.530 16.068 20.452 1.00 13.04 O ATOM 1346 CB VAL A 143 30.066 14.440 20.314 1.00 14.46 C ATOM 1347 CG1 VAL A 143 29.898 13.910 18.905 1.00 15.07 C ATOM 1348 CG2 VAL A 143 31.414 14.020 20.856 1.00 15.04 C ATOM 1349 H VAL A 143 29.392 16.142 22.423 1.00 0.00 H ATOM 1350 N LEU A 144 28.550 16.952 18.617 1.00 13.54 N ATOM 1351 CA LEU A 144 27.352 17.123 17.796 1.00 13.60 C ATOM 1352 C LEU A 144 27.189 15.944 16.829 1.00 13.47 C ATOM 1353 O LEU A 144 28.076 15.701 16.010 1.00 12.42 O ATOM 1354 CB LEU A 144 27.447 18.402 16.984 1.00 13.73 C ATOM 1355 CG LEU A 144 27.672 19.668 17.805 1.00 14.52 C ATOM 1356 CD1 LEU A 144 27.582 20.918 16.946 1.00 14.50 C ATOM 1357 CD2 LEU A 144 26.701 19.772 18.958 1.00 15.19 C ATOM 1358 H LEU A 144 29.449 17.343 18.270 1.00 0.00 H ATOM 1359 N ALA A 145 26.053 15.247 16.923 1.00 13.54 N ATOM 1360 CA ALA A 145 25.759 14.097 16.082 1.00 14.02 C ATOM 1361 C ALA A 145 24.684 14.395 15.067 1.00 14.89 C ATOM 1362 O ALA A 145 23.570 14.788 15.434 1.00 15.71 O ATOM 1363 CB ALA A 145 25.311 12.919 16.906 1.00 14.19 C ATOM 1364 H ALA A 145 25.348 15.540 17.629 1.00 0.00 H ATOM 1365 N PHE A 146 24.996 14.143 13.802 1.00 15.12 N ATOM 1366 CA PHE A 146 24.022 14.282 12.715 1.00 15.75 C ATOM 1367 C PHE A 146 23.827 12.928 12.054 1.00 15.57 C ATOM 1368 O PHE A 146 24.814 12.206 11.736 1.00 13.92 O ATOM 1369 CB PHE A 146 24.509 15.298 11.682 1.00 15.53 C ATOM 1370 CG PHE A 146 24.745 16.675 12.261 1.00 16.70 C ATOM 1371 CD1 PHE A 146 25.971 16.996 12.867 1.00 16.11 C ATOM 1372 CD2 PHE A 146 23.760 17.643 12.203 1.00 15.99 C ATOM 1373 CE1 PHE A 146 26.194 18.241 13.402 1.00 16.47 C ATOM 1374 CE2 PHE A 146 23.982 18.893 12.748 1.00 16.69 C ATOM 1375 CZ PHE A 146 25.201 19.199 13.353 1.00 17.09 C ATOM 1376 H PHE A 146 25.963 13.837 13.574 1.00 0.00 H ATOM 1377 N LEU A 147 22.556 12.594 11.870 1.00 15.69 N ATOM 1378 CA LEU A 147 22.149 11.354 11.211 1.00 16.15 C ATOM 1379 C LEU A 147 22.081 11.621 9.707 1.00 16.24 C ATOM 1380 O LEU A 147 21.801 12.735 9.278 1.00 16.25 O ATOM 1381 CB LEU A 147 20.811 10.884 11.759 1.00 16.38 C ATOM 1382 CG LEU A 147 20.856 10.658 13.287 1.00 17.28 C ATOM 1383 CD1 LEU A 147 19.437 10.546 13.841 1.00 17.84 C ATOM 1384 CD2 LEU A 147 21.655 9.415 13.652 1.00 17.14 C ATOM 1385 H LEU A 147 21.817 13.243 12.209 1.00 0.00 H ATOM 1386 N VAL A 148 22.393 10.604 8.915 1.00 16.08 N ATOM 1387 CA VAL A 148 22.440 10.733 7.484 1.00 15.68 C ATOM 1388 C VAL A 148 21.458 9.729 6.900 1.00 17.00 C ATOM 1389 O VAL A 148 21.587 8.509 7.102 1.00 16.49 O ATOM 1390 CB VAL A 148 23.850 10.455 6.953 1.00 15.27 C ATOM 1391 CG1 VAL A 148 23.865 10.501 5.434 1.00 15.14 C ATOM 1392 CG2 VAL A 148 24.866 11.429 7.546 1.00 15.62 C ATOM 1393 H VAL A 148 22.611 9.682 9.344 1.00 0.00 H ATOM 1394 N GLU A 149 20.514 10.252 6.140 1.00 17.98 N ATOM 1395 CA GLU A 149 19.480 9.471 5.484 1.00 19.63 C ATOM 1396 C GLU A 149 19.840 9.305 4.014 1.00 18.12 C ATOM 1397 O GLU A 149 20.159 10.282 3.338 1.00 16.27 O ATOM 1398 CB GLU A 149 18.172 10.236 5.614 1.00 23.53 C ATOM 1399 CG GLU A 149 16.952 9.571 5.024 1.00 26.56 C ATOM 1400 CD GLU A 149 15.700 10.104 5.675 1.00 29.76 C ATOM 1401 OE1 GLU A 149 15.568 11.330 5.753 1.00 32.04 O ATOM 1402 OE2 GLU A 149 14.868 9.303 6.158 1.00 37.22 O ATOM 1403 H GLU A 149 20.510 11.283 6.003 1.00 0.00 H ATOM 1404 N ALA A 150 19.820 8.068 3.533 1.00 17.26 N ATOM 1405 CA ALA A 150 20.212 7.782 2.150 1.00 18.06 C ATOM 1406 C ALA A 150 19.065 8.125 1.237 1.00 17.74 C ATOM 1407 O ALA A 150 17.908 7.858 1.585 1.00 18.65 O ATOM 1408 CB ALA A 150 20.577 6.313 1.974 1.00 17.52 C ATOM 1409 H ALA A 150 19.520 7.286 4.150 1.00 0.00 H ATOM 1410 N GLY A 151 19.369 8.679 0.068 1.00 17.32 N ATOM 1411 CA GLY A 151 18.325 8.907 -0.943 1.00 17.69 C ATOM 1412 C GLY A 151 18.840 9.085 -2.352 1.00 17.79 C ATOM 1413 O GLY A 151 19.875 8.532 -2.693 1.00 16.83 O ATOM 1414 H GLY A 151 20.352 8.953 -0.134 1.00 0.00 H ATOM 1415 N THR A 151A 18.113 9.861 -3.165 1.00 18.66 N ATOM 1416 CA THR A 151A 18.555 10.203 -4.537 1.00 19.93 C ATOM 1417 C THR A 151A 18.988 11.666 -4.687 1.00 21.75 C ATOM 1418 O THR A 151A 19.288 12.129 -5.797 1.00 22.36 O ATOM 1419 CB THR A 151A 17.471 9.903 -5.601 1.00 18.65 C ATOM 1420 OG1 THR A 151A 16.304 10.713 -5.363 1.00 16.68 O ATOM 1421 CG2 THR A 151A 17.142 8.419 -5.613 1.00 18.64 C ATOM 1422 HG1 THR A 151A 15.619 10.512 -6.049 1.00 0.00 H ATOM 1423 H THR A 151A 17.206 10.237 -2.822 1.00 0.00 H ATOM 1424 N GLN A 152 19.013 12.403 -3.595 1.00 23.08 N ATOM 1425 CA GLN A 152 19.445 13.784 -3.668 1.00 24.83 C ATOM 1426 C GLN A 152 20.964 13.844 -3.615 1.00 24.64 C ATOM 1427 O GLN A 152 21.576 13.342 -2.678 1.00 26.61 O ATOM 1428 CB GLN A 152 18.859 14.525 -2.497 1.00 27.14 C ATOM 1429 CG GLN A 152 18.776 16.028 -2.658 1.00 29.54 C ATOM 1430 CD GLN A 152 18.079 16.600 -1.461 1.00 31.26 C ATOM 1431 OE1 GLN A 152 16.889 16.403 -1.270 1.00 36.10 O ATOM 1432 NE2 GLN A 152 18.831 17.213 -0.599 1.00 33.52 N ATOM 1433 HE22 GLN A 152 19.840 17.360 -0.801 1.00 0.00 H ATOM 1434 HE21 GLN A 152 18.424 17.557 0.294 1.00 0.00 H ATOM 1435 H GLN A 152 18.723 11.995 -2.683 1.00 0.00 H ATOM 1436 N VAL A 153 21.576 14.457 -4.608 1.00 23.18 N ATOM 1437 CA VAL A 153 23.005 14.664 -4.556 1.00 22.85 C ATOM 1438 C VAL A 153 23.272 15.830 -3.610 1.00 23.08 C ATOM 1439 O VAL A 153 22.751 16.910 -3.807 1.00 24.04 O ATOM 1440 CB VAL A 153 23.586 14.999 -5.928 1.00 22.12 C ATOM 1441 CG1 VAL A 153 25.089 15.199 -5.820 1.00 21.74 C ATOM 1442 CG2 VAL A 153 23.226 13.899 -6.925 1.00 21.92 C ATOM 1443 H VAL A 153 21.031 14.791 -5.428 1.00 0.00 H ATOM 1444 N ASN A 154 24.059 15.591 -2.565 1.00 21.42 N ATOM 1445 CA ASN A 154 24.452 16.644 -1.655 1.00 19.23 C ATOM 1446 C ASN A 154 25.733 17.263 -2.202 1.00 19.72 C ATOM 1447 O ASN A 154 26.801 16.699 -2.072 1.00 17.40 O ATOM 1448 CB ASN A 154 24.672 16.047 -0.298 1.00 18.28 C ATOM 1449 CG ASN A 154 24.827 17.077 0.783 1.00 18.84 C ATOM 1450 OD1 ASN A 154 25.567 18.049 0.625 1.00 19.27 O ATOM 1451 ND2 ASN A 154 24.157 16.847 1.912 1.00 18.34 N ATOM 1452 HD22 ASN A 154 23.545 16.010 1.992 1.00 0.00 H ATOM 1453 HD21 ASN A 154 24.246 17.505 2.713 1.00 0.00 H ATOM 1454 H ASN A 154 24.400 14.623 -2.398 1.00 0.00 H ATOM 1455 N GLU A 155 25.612 18.430 -2.813 1.00 20.62 N ATOM 1456 CA GLU A 155 26.772 19.114 -3.381 1.00 22.86 C ATOM 1457 C GLU A 155 27.739 19.520 -2.275 1.00 19.65 C ATOM 1458 O GLU A 155 28.943 19.458 -2.465 1.00 20.20 O ATOM 1459 CB GLU A 155 26.368 20.347 -4.200 1.00 26.96 C ATOM 1460 CG GLU A 155 25.318 20.143 -5.313 1.00 31.36 C ATOM 1461 CD GLU A 155 25.751 19.217 -6.450 1.00 36.47 C ATOM 1462 OE1 GLU A 155 26.963 18.868 -6.577 1.00 37.66 O ATOM 1463 OE2 GLU A 155 24.842 18.833 -7.233 1.00 41.73 O ATOM 1464 H GLU A 155 24.673 18.870 -2.891 1.00 0.00 H ATOM 1465 N GLY A 156 27.225 19.914 -1.118 1.00 18.30 N ATOM 1466 CA GLY A 156 28.077 20.276 0.030 1.00 18.30 C ATOM 1467 C GLY A 156 29.084 19.220 0.461 1.00 19.11 C ATOM 1468 O GLY A 156 30.190 19.547 0.880 1.00 18.80 O ATOM 1469 H GLY A 156 26.191 19.969 -1.017 1.00 0.00 H ATOM 1470 N PHE A 157 28.685 17.948 0.366 1.00 20.24 N ATOM 1471 CA PHE A 157 29.549 16.808 0.685 1.00 20.35 C ATOM 1472 C PHE A 157 30.591 16.434 -0.337 1.00 21.55 C ATOM 1473 O PHE A 157 31.483 15.627 -0.021 1.00 21.97 O ATOM 1474 CB PHE A 157 28.711 15.531 0.948 1.00 21.03 C ATOM 1475 CG PHE A 157 28.514 15.222 2.402 1.00 20.92 C ATOM 1476 CD1 PHE A 157 27.586 15.930 3.147 1.00 21.63 C ATOM 1477 CD2 PHE A 157 29.246 14.204 3.018 1.00 20.43 C ATOM 1478 CE1 PHE A 157 27.407 15.645 4.489 1.00 21.95 C ATOM 1479 CE2 PHE A 157 29.064 13.921 4.350 1.00 20.62 C ATOM 1480 CZ PHE A 157 28.156 14.653 5.091 1.00 21.08 C ATOM 1481 H PHE A 157 27.713 17.758 0.050 1.00 0.00 H ATOM 1482 N GLN A 158 30.501 16.962 -1.556 1.00 22.42 N ATOM 1483 CA GLN A 158 31.338 16.446 -2.642 1.00 22.70 C ATOM 1484 C GLN A 158 32.866 16.661 -2.450 1.00 21.63 C ATOM 1485 O GLN A 158 33.666 15.796 -2.795 1.00 20.22 O ATOM 1486 CB GLN A 158 30.818 16.935 -4.018 1.00 24.96 C ATOM 1487 CG GLN A 158 29.671 16.086 -4.582 1.00 25.83 C ATOM 1488 CD GLN A 158 30.057 14.604 -4.717 1.00 27.69 C ATOM 1489 OE1 GLN A 158 29.522 13.741 -4.031 1.00 26.19 O ATOM 1490 NE2 GLN A 158 31.060 14.322 -5.557 1.00 32.34 N ATOM 1491 HE22 GLN A 158 31.491 15.079 -6.125 1.00 0.00 H ATOM 1492 HE21 GLN A 158 31.408 13.346 -5.642 1.00 0.00 H ATOM 1493 H GLN A 158 29.836 17.741 -1.737 1.00 0.00 H ATOM 1494 N PRO A 159 33.278 17.801 -1.868 1.00 20.82 N ATOM 1495 CA PRO A 159 34.707 17.868 -1.529 1.00 19.65 C ATOM 1496 C PRO A 159 35.158 16.709 -0.642 1.00 19.39 C ATOM 1497 O PRO A 159 36.157 16.055 -0.950 1.00 19.22 O ATOM 1498 CB PRO A 159 34.838 19.213 -0.816 1.00 18.93 C ATOM 1499 CG PRO A 159 33.703 20.027 -1.338 1.00 18.98 C ATOM 1500 CD PRO A 159 32.621 19.122 -1.800 1.00 19.47 C ATOM 1501 N LEU A 160 34.407 16.408 0.415 1.00 18.44 N ATOM 1502 CA LEU A 160 34.787 15.293 1.271 1.00 18.01 C ATOM 1503 C LEU A 160 34.785 13.962 0.532 1.00 18.75 C ATOM 1504 O LEU A 160 35.747 13.178 0.646 1.00 18.78 O ATOM 1505 CB LEU A 160 33.869 15.207 2.491 1.00 18.55 C ATOM 1506 CG LEU A 160 34.090 14.046 3.469 1.00 17.77 C ATOM 1507 CD1 LEU A 160 35.509 14.029 4.014 1.00 16.87 C ATOM 1508 CD2 LEU A 160 33.045 14.142 4.571 1.00 18.14 C ATOM 1509 H LEU A 160 33.555 16.965 0.628 1.00 0.00 H ATOM 1510 N VAL A 161 33.724 13.706 -0.237 1.00 19.50 N ATOM 1511 CA VAL A 161 33.578 12.435 -0.944 1.00 20.16 C ATOM 1512 C VAL A 161 34.715 12.250 -1.972 1.00 21.23 C ATOM 1513 O VAL A 161 35.329 11.167 -2.044 1.00 20.84 O ATOM 1514 CB VAL A 161 32.175 12.313 -1.584 1.00 20.93 C ATOM 1515 CG1 VAL A 161 32.080 11.115 -2.524 1.00 21.26 C ATOM 1516 CG2 VAL A 161 31.109 12.198 -0.501 1.00 21.08 C ATOM 1517 H VAL A 161 32.983 14.429 -0.335 1.00 0.00 H ATOM 1518 N GLU A 162 35.045 13.317 -2.704 1.00 23.02 N ATOM 1519 CA GLU A 162 36.147 13.275 -3.675 1.00 25.53 C ATOM 1520 C GLU A 162 37.497 13.020 -3.006 1.00 23.05 C ATOM 1521 O GLU A 162 38.317 12.288 -3.546 1.00 24.05 O ATOM 1522 CB GLU A 162 36.129 14.498 -4.618 1.00 29.83 C ATOM 1523 CG GLU A 162 34.946 14.392 -5.599 1.00 35.35 C ATOM 1524 CD GLU A 162 34.724 15.599 -6.518 1.00 41.02 C ATOM 1525 OE1 GLU A 162 34.083 15.445 -7.581 1.00 44.29 O ATOM 1526 OE2 GLU A 162 35.166 16.707 -6.196 1.00 43.63 O ATOM 1527 H GLU A 162 34.509 14.200 -2.584 1.00 0.00 H ATOM 1528 N ALA A 163 37.686 13.514 -1.791 1.00 21.68 N ATOM 1529 CA ALA A 163 38.936 13.274 -1.051 1.00 21.15 C ATOM 1530 C ALA A 163 39.191 11.827 -0.675 1.00 20.31 C ATOM 1531 O ALA A 163 40.349 11.416 -0.561 1.00 20.31 O ATOM 1532 CB ALA A 163 39.002 14.131 0.203 1.00 21.63 C ATOM 1533 H ALA A 163 36.935 14.083 -1.351 1.00 0.00 H ATOM 1534 N LEU A 164 38.130 11.062 -0.463 1.00 20.66 N ATOM 1535 CA LEU A 164 38.249 9.697 0.073 1.00 21.04 C ATOM 1536 C LEU A 164 39.134 8.832 -0.784 1.00 21.71 C ATOM 1537 O LEU A 164 39.871 8.026 -0.250 1.00 21.63 O ATOM 1538 CB LEU A 164 36.890 9.024 0.204 1.00 20.98 C ATOM 1539 CG LEU A 164 35.868 9.749 1.072 1.00 20.40 C ATOM 1540 CD1 LEU A 164 34.607 8.928 1.054 1.00 20.86 C ATOM 1541 CD2 LEU A 164 36.356 9.999 2.499 1.00 20.62 C ATOM 1542 H LEU A 164 37.185 11.438 -0.682 1.00 0.00 H ATOM 1543 N SER A 165 39.067 9.014 -2.109 1.00 23.68 N ATOM 1544 CA SER A 165 39.923 8.295 -3.048 1.00 25.10 C ATOM 1545 C SER A 165 41.414 8.404 -2.723 1.00 23.59 C ATOM 1546 O SER A 165 42.195 7.565 -3.150 1.00 22.04 O ATOM 1547 CB SER A 165 39.756 8.841 -4.477 1.00 28.01 C ATOM 1548 OG SER A 165 38.416 8.849 -4.883 1.00 30.94 O ATOM 1549 HG SER A 165 37.890 9.421 -4.270 1.00 0.00 H ATOM 1550 H SER A 165 38.377 9.695 -2.485 1.00 0.00 H ATOM 1551 N ASN A 166 41.812 9.472 -2.040 1.00 23.14 N ATOM 1552 CA ASN A 166 43.228 9.748 -1.784 1.00 23.56 C ATOM 1553 C ASN A 166 43.757 9.218 -0.467 1.00 23.36 C ATOM 1554 O ASN A 166 44.962 9.254 -0.239 1.00 25.06 O ATOM 1555 CB ASN A 166 43.466 11.256 -1.853 1.00 24.56 C ATOM 1556 CG ASN A 166 43.239 11.821 -3.250 1.00 26.75 C ATOM 1557 OD1 ASN A 166 43.264 11.099 -4.257 1.00 26.26 O ATOM 1558 ND2 ASN A 166 43.035 13.121 -3.317 1.00 28.54 N ATOM 1559 HD22 ASN A 166 43.022 13.691 -2.447 1.00 0.00 H ATOM 1560 HD21 ASN A 166 42.887 13.577 -4.240 1.00 0.00 H ATOM 1561 H ASN A 166 41.096 10.133 -1.676 1.00 0.00 H ATOM 1562 N ILE A 167 42.874 8.720 0.396 1.00 21.53 N ATOM 1563 CA ILE A 167 43.274 8.242 1.712 1.00 20.80 C ATOM 1564 C ILE A 167 42.680 6.855 2.000 1.00 20.34 C ATOM 1565 O ILE A 167 42.044 6.645 3.017 1.00 19.72 O ATOM 1566 CB ILE A 167 42.902 9.266 2.801 1.00 20.53 C ATOM 1567 CG1 ILE A 167 41.400 9.595 2.771 1.00 20.78 C ATOM 1568 CG2 ILE A 167 43.723 10.524 2.607 1.00 20.73 C ATOM 1569 CD1 ILE A 167 40.934 10.318 4.016 1.00 21.76 C ATOM 1570 H ILE A 167 41.872 8.671 0.123 1.00 0.00 H ATOM 1571 N PRO A 168 42.910 5.891 1.100 1.00 20.15 N ATOM 1572 CA PRO A 168 42.340 4.551 1.316 1.00 20.83 C ATOM 1573 C PRO A 168 42.911 3.802 2.499 1.00 21.36 C ATOM 1574 O PRO A 168 42.239 2.935 3.023 1.00 21.73 O ATOM 1575 CB PRO A 168 42.702 3.804 0.043 1.00 20.61 C ATOM 1576 CG PRO A 168 43.963 4.486 -0.391 1.00 21.47 C ATOM 1577 CD PRO A 168 43.704 5.951 -0.130 1.00 19.98 C ATOM 1578 N LYS A 169 44.141 4.100 2.900 1.00 21.96 N ATOM 1579 CA LYS A 169 44.774 3.330 3.949 1.00 22.84 C ATOM 1580 C LYS A 169 44.959 4.161 5.187 1.00 22.31 C ATOM 1581 O LYS A 169 45.148 5.375 5.085 1.00 21.66 O ATOM 1582 CB LYS A 169 46.136 2.820 3.498 1.00 24.25 C ATOM 1583 CG LYS A 169 46.082 1.944 2.274 1.00 26.20 C ATOM 1584 CD LYS A 169 47.468 1.687 1.747 1.00 29.47 C ATOM 1585 CE LYS A 169 47.405 0.987 0.416 1.00 33.29 C ATOM 1586 NZ LYS A 169 48.792 0.862 -0.103 1.00 37.98 N ATOM 1587 HZ1 LYS A 169 49.206 1.810 -0.214 1.00 0.00 H ATOM 1588 HZ2 LYS A 169 49.363 0.309 0.568 1.00 0.00 H ATOM 1589 HZ3 LYS A 169 48.774 0.380 -1.024 1.00 0.00 H ATOM 1590 H LYS A 169 44.652 4.891 2.458 1.00 0.00 H ATOM 1591 N PRO A 170 44.980 3.507 6.352 1.00 21.26 N ATOM 1592 CA PRO A 170 45.281 4.241 7.587 1.00 22.48 C ATOM 1593 C PRO A 170 46.606 5.029 7.540 1.00 25.07 C ATOM 1594 O PRO A 170 47.604 4.599 6.919 1.00 22.41 O ATOM 1595 CB PRO A 170 45.340 3.163 8.662 1.00 21.92 C ATOM 1596 CG PRO A 170 44.795 1.926 8.048 1.00 22.57 C ATOM 1597 CD PRO A 170 44.841 2.057 6.561 1.00 21.78 C ATOM 1598 N GLU A 171 46.551 6.202 8.169 1.00 27.23 N ATOM 1599 CA GLU A 171 47.642 7.147 8.298 1.00 29.24 C ATOM 1600 C GLU A 171 47.896 7.989 7.060 1.00 27.75 C ATOM 1601 O GLU A 171 48.795 8.833 7.079 1.00 28.96 O ATOM 1602 CB GLU A 171 48.890 6.481 8.854 1.00 34.32 C ATOM 1603 CG GLU A 171 48.573 5.942 10.235 1.00 41.74 C ATOM 1604 CD GLU A 171 49.695 5.181 10.858 1.00 47.19 C ATOM 1605 OE1 GLU A 171 50.180 4.213 10.221 1.00 54.55 O ATOM 1606 OE2 GLU A 171 50.063 5.553 11.996 1.00 50.62 O ATOM 1607 H GLU A 171 45.644 6.463 8.606 1.00 0.00 H ATOM 1608 N MET A 172 47.060 7.834 6.034 1.00 24.01 N ATOM 1609 CA MET A 172 47.091 8.731 4.876 1.00 21.94 C ATOM 1610 C MET A 172 46.219 9.973 5.100 1.00 21.43 C ATOM 1611 O MET A 172 45.141 9.899 5.707 1.00 20.64 O ATOM 1612 CB MET A 172 46.676 7.983 3.623 1.00 21.19 C ATOM 1613 CG MET A 172 47.614 6.863 3.265 1.00 20.44 C ATOM 1614 SD MET A 172 47.092 6.023 1.762 1.00 22.43 S ATOM 1615 CE MET A 172 47.397 7.268 0.501 1.00 21.95 C ATOM 1616 H MET A 172 46.369 7.057 6.056 1.00 0.00 H ATOM 1617 N SER A 173 46.722 11.121 4.634 1.00 21.13 N ATOM 1618 CA SER A 173 46.051 12.412 4.723 1.00 21.66 C ATOM 1619 C SER A 173 46.017 13.024 3.361 1.00 21.27 C ATOM 1620 O SER A 173 46.850 12.705 2.507 1.00 20.81 O ATOM 1621 CB SER A 173 46.813 13.373 5.630 1.00 22.69 C ATOM 1622 OG SER A 173 47.132 12.689 6.803 1.00 24.71 O ATOM 1623 HG SER A 173 47.694 11.904 6.584 1.00 0.00 H ATOM 1624 H SER A 173 47.656 11.091 4.177 1.00 0.00 H ATOM 1625 N THR A 174 45.067 13.928 3.188 1.00 20.54 N ATOM 1626 CA THR A 174 44.983 14.745 2.005 1.00 21.92 C ATOM 1627 C THR A 174 44.294 16.044 2.373 1.00 22.54 C ATOM 1628 O THR A 174 43.871 16.237 3.520 1.00 24.08 O ATOM 1629 CB THR A 174 44.241 13.989 0.885 1.00 22.90 C ATOM 1630 OG1 THR A 174 44.286 14.745 -0.314 1.00 21.37 O ATOM 1631 CG2 THR A 174 42.776 13.720 1.274 1.00 23.26 C ATOM 1632 HG1 THR A 174 43.808 14.255 -1.030 1.00 0.00 H ATOM 1633 H THR A 174 44.354 14.054 3.934 1.00 0.00 H ATOM 1634 N THR A 175 44.198 16.935 1.404 1.00 23.48 N ATOM 1635 CA THR A 175 43.554 18.226 1.572 1.00 25.49 C ATOM 1636 C THR A 175 42.301 18.262 0.720 1.00 26.97 C ATOM 1637 O THR A 175 42.356 17.994 -0.485 1.00 26.49 O ATOM 1638 CB THR A 175 44.496 19.344 1.119 1.00 25.44 C ATOM 1639 OG1 THR A 175 45.635 19.340 1.981 1.00 27.67 O ATOM 1640 CG2 THR A 175 43.836 20.685 1.193 1.00 26.90 C ATOM 1641 HG1 THR A 175 46.259 20.057 1.705 1.00 0.00 H ATOM 1642 H THR A 175 44.603 16.701 0.475 1.00 0.00 H ATOM 1643 N MET A 176 41.179 18.602 1.346 1.00 25.77 N ATOM 1644 CA MET A 176 39.926 18.706 0.648 1.00 26.39 C ATOM 1645 C MET A 176 39.895 20.010 -0.144 1.00 27.12 C ATOM 1646 O MET A 176 40.615 20.972 0.174 1.00 27.93 O ATOM 1647 CB MET A 176 38.756 18.689 1.640 1.00 27.73 C ATOM 1648 CG MET A 176 38.581 17.389 2.407 1.00 26.53 C ATOM 1649 SD MET A 176 37.408 17.567 3.765 1.00 26.83 S ATOM 1650 CE MET A 176 35.974 18.353 3.012 1.00 25.54 C ATOM 1651 H MET A 176 41.208 18.798 2.367 1.00 0.00 H ATOM 1652 N ALA A 177 39.042 20.037 -1.165 1.00 26.59 N ATOM 1653 CA ALA A 177 38.742 21.271 -1.878 1.00 27.76 C ATOM 1654 C ALA A 177 38.010 22.193 -0.931 1.00 27.93 C ATOM 1655 O ALA A 177 37.310 21.714 -0.047 1.00 25.26 O ATOM 1656 CB ALA A 177 37.883 20.994 -3.098 1.00 27.47 C ATOM 1657 H ALA A 177 38.578 19.155 -1.461 1.00 0.00 H ATOM 1658 N GLU A 178 38.210 23.494 -1.118 1.00 28.07 N ATOM 1659 CA GLU A 178 37.488 24.563 -0.423 1.00 30.74 C ATOM 1660 C GLU A 178 36.044 24.182 0.028 1.00 28.87 C ATOM 1661 O GLU A 178 35.237 23.719 -0.773 1.00 27.50 O ATOM 1662 CB GLU A 178 37.451 25.809 -1.337 1.00 36.24 C ATOM 1663 CG GLU A 178 37.425 27.140 -0.613 1.00 43.00 C ATOM 1664 CD GLU A 178 38.799 27.749 -0.421 1.00 49.30 C ATOM 1665 OE1 GLU A 178 39.652 27.105 0.224 1.00 54.97 O ATOM 1666 OE2 GLU A 178 39.020 28.879 -0.914 1.00 58.30 O ATOM 1667 H GLU A 178 38.934 23.774 -1.810 1.00 0.00 H ATOM 1668 N SER A 179 35.721 24.348 1.304 1.00 26.25 N ATOM 1669 CA SER A 179 34.387 23.970 1.795 1.00 26.45 C ATOM 1670 C SER A 179 34.180 24.441 3.220 1.00 23.89 C ATOM 1671 O SER A 179 35.143 24.664 3.955 1.00 25.80 O ATOM 1672 CB SER A 179 34.184 22.434 1.732 1.00 27.24 C ATOM 1673 OG SER A 179 35.204 21.776 2.480 1.00 28.22 O ATOM 1674 HG SER A 179 36.089 22.004 2.100 1.00 0.00 H ATOM 1675 H SER A 179 36.418 24.749 1.964 1.00 0.00 H ATOM 1676 N SER A 180 32.927 24.574 3.608 1.00 21.52 N ATOM 1677 CA SER A 180 32.598 24.983 4.957 1.00 22.15 C ATOM 1678 C SER A 180 31.946 23.843 5.685 1.00 21.53 C ATOM 1679 O SER A 180 31.486 22.867 5.067 1.00 20.25 O ATOM 1680 CB SER A 180 31.656 26.175 4.952 1.00 22.36 C ATOM 1681 OG SER A 180 30.374 25.796 4.513 1.00 22.34 O ATOM 1682 HG SER A 180 29.778 26.586 4.518 1.00 0.00 H ATOM 1683 H SER A 180 32.160 24.381 2.932 1.00 0.00 H ATOM 1684 N LEU A 181 31.924 23.973 7.008 1.00 21.98 N ATOM 1685 CA LEU A 181 31.270 22.983 7.855 1.00 21.25 C ATOM 1686 C LEU A 181 29.771 22.976 7.591 1.00 20.45 C ATOM 1687 O LEU A 181 29.190 21.909 7.556 1.00 18.37 O ATOM 1688 CB LEU A 181 31.578 23.213 9.335 1.00 20.36 C ATOM 1689 CG LEU A 181 33.048 23.045 9.709 1.00 19.49 C ATOM 1690 CD1 LEU A 181 33.206 23.192 11.212 1.00 19.44 C ATOM 1691 CD2 LEU A 181 33.643 21.719 9.247 1.00 19.71 C ATOM 1692 H LEU A 181 32.382 24.797 7.447 1.00 0.00 H ATOM 1693 N LEU A 182 29.170 24.150 7.367 1.00 20.59 N ATOM 1694 CA LEU A 182 27.734 24.248 7.045 1.00 21.55 C ATOM 1695 C LEU A 182 27.345 23.538 5.758 1.00 21.95 C ATOM 1696 O LEU A 182 26.198 23.080 5.627 1.00 21.95 O ATOM 1697 CB LEU A 182 27.247 25.716 7.015 1.00 23.30 C ATOM 1698 CG LEU A 182 26.574 26.332 8.266 1.00 25.40 C ATOM 1699 CD1 LEU A 182 26.838 25.598 9.558 1.00 25.90 C ATOM 1700 CD2 LEU A 182 26.878 27.809 8.442 1.00 26.39 C ATOM 1701 H LEU A 182 29.734 25.022 7.422 1.00 0.00 H ATOM 1702 N ASP A 183 28.295 23.411 4.839 1.00 21.87 N ATOM 1703 CA ASP A 183 28.094 22.648 3.612 1.00 23.80 C ATOM 1704 C ASP A 183 27.764 21.216 3.917 1.00 23.77 C ATOM 1705 O ASP A 183 27.144 20.571 3.102 1.00 26.72 O ATOM 1706 CB ASP A 183 29.348 22.658 2.706 1.00 24.41 C ATOM 1707 CG ASP A 183 29.628 24.009 2.088 1.00 24.75 C ATOM 1708 OD1 ASP A 183 28.746 24.885 2.144 1.00 26.07 O ATOM 1709 OD2 ASP A 183 30.745 24.209 1.558 1.00 25.45 O ATOM 1710 H ASP A 183 29.214 23.871 4.999 1.00 0.00 H ATOM 1711 N LEU A 184 28.204 20.719 5.068 1.00 24.06 N ATOM 1712 CA LEU A 184 27.981 19.329 5.469 1.00 25.08 C ATOM 1713 C LEU A 184 26.715 19.110 6.307 1.00 24.75 C ATOM 1714 O LEU A 184 26.306 17.970 6.522 1.00 25.36 O ATOM 1715 CB LEU A 184 29.189 18.820 6.249 1.00 25.03 C ATOM 1716 CG LEU A 184 30.542 18.860 5.535 1.00 24.92 C ATOM 1717 CD1 LEU A 184 31.605 18.381 6.507 1.00 24.31 C ATOM 1718 CD2 LEU A 184 30.540 17.957 4.313 1.00 25.02 C ATOM 1719 H LEU A 184 28.729 21.344 5.712 1.00 0.00 H ATOM 1720 N LEU A 185 26.091 20.188 6.757 1.00 24.47 N ATOM 1721 CA LEU A 185 25.013 20.106 7.727 1.00 25.11 C ATOM 1722 C LEU A 185 23.675 20.437 7.086 1.00 24.46 C ATOM 1723 O LEU A 185 23.628 21.116 6.046 1.00 22.77 O ATOM 1724 CB LEU A 185 25.266 21.088 8.886 1.00 25.37 C ATOM 1725 CG LEU A 185 26.613 21.029 9.622 1.00 26.40 C ATOM 1726 CD1 LEU A 185 26.563 21.827 10.910 1.00 27.74 C ATOM 1727 CD2 LEU A 185 27.022 19.618 9.944 1.00 26.26 C ATOM 1728 H LEU A 185 26.382 21.122 6.405 1.00 0.00 H ATOM 1729 N PRO A 186 22.581 20.035 7.752 1.00 23.39 N ATOM 1730 CA PRO A 186 21.273 20.547 7.359 1.00 25.07 C ATOM 1731 C PRO A 186 21.192 22.100 7.453 1.00 27.53 C ATOM 1732 O PRO A 186 22.067 22.739 8.063 1.00 28.35 O ATOM 1733 CB PRO A 186 20.321 19.884 8.378 1.00 24.34 C ATOM 1734 CG PRO A 186 21.062 18.703 8.899 1.00 23.03 C ATOM 1735 CD PRO A 186 22.482 19.162 8.942 1.00 23.75 C ATOM 1736 N LYS A 187 20.159 22.698 6.872 1.00 28.74 N ATOM 1737 CA LYS A 187 19.972 24.139 6.978 1.00 31.92 C ATOM 1738 C LYS A 187 19.898 24.493 8.451 1.00 31.00 C ATOM 1739 O LYS A 187 19.255 23.793 9.245 1.00 27.87 O ATOM 1740 CB LYS A 187 18.679 24.588 6.298 1.00 37.79 C ATOM 1741 CG LYS A 187 18.563 24.234 4.814 1.00 44.37 C ATOM 1742 CD LYS A 187 18.513 25.450 3.895 1.00 50.24 C ATOM 1743 CE LYS A 187 17.937 25.077 2.528 1.00 54.83 C ATOM 1744 NZ LYS A 187 17.316 26.267 1.880 1.00 58.22 N ATOM 1745 HZ1 LYS A 187 16.549 26.628 2.483 1.00 0.00 H ATOM 1746 HZ2 LYS A 187 18.036 27.006 1.753 1.00 0.00 H ATOM 1747 HZ3 LYS A 187 16.931 25.994 0.953 1.00 0.00 H ATOM 1748 H LYS A 187 19.474 22.130 6.334 1.00 0.00 H ATOM 1749 N GLU A 187A 20.533 25.592 8.817 1.00 32.01 N ATOM 1750 CA GLU A 187A 20.724 25.928 10.232 1.00 32.99 C ATOM 1751 C GLU A 187A 19.382 26.047 10.982 1.00 33.14 C ATOM 1752 O GLU A 187A 19.239 25.543 12.093 1.00 31.50 O ATOM 1753 CB GLU A 187A 21.560 27.217 10.367 1.00 33.88 C ATOM 1754 CG GLU A 187A 22.477 27.249 11.569 1.00 35.07 C ATOM 1755 CD GLU A 187A 23.259 28.550 11.687 1.00 35.26 C ATOM 1756 OE1 GLU A 187A 23.141 29.188 12.737 1.00 34.52 O ATOM 1757 OE2 GLU A 187A 23.962 28.944 10.735 1.00 36.41 O ATOM 1758 H GLU A 187A 20.905 26.232 8.087 1.00 0.00 H ATOM 1759 N GLU A 187B 18.393 26.674 10.351 1.00 34.42 N ATOM 1760 CA GLU A 187B 17.034 26.765 10.908 1.00 37.13 C ATOM 1761 C GLU A 187B 16.441 25.382 11.285 1.00 32.91 C ATOM 1762 O GLU A 187B 15.595 25.277 12.156 1.00 31.06 O ATOM 1763 CB GLU A 187B 16.101 27.485 9.914 1.00 42.85 C ATOM 1764 CG GLU A 187B 15.748 26.619 8.708 1.00 50.06 C ATOM 1765 CD GLU A 187B 15.533 27.387 7.421 1.00 56.84 C ATOM 1766 OE1 GLU A 187B 16.159 27.013 6.400 1.00 65.12 O ATOM 1767 OE2 GLU A 187B 14.741 28.349 7.422 1.00 64.00 O ATOM 1768 H GLU A 187B 18.587 27.116 9.430 1.00 0.00 H ATOM 1769 N LYS A 188 16.886 24.319 10.632 1.00 30.49 N ATOM 1770 CA LYS A 188 16.390 22.997 10.969 1.00 30.35 C ATOM 1771 C LYS A 188 17.103 22.342 12.158 1.00 27.98 C ATOM 1772 O LYS A 188 16.694 21.274 12.587 1.00 28.01 O ATOM 1773 CB LYS A 188 16.432 22.096 9.745 1.00 31.77 C ATOM 1774 CG LYS A 188 15.503 22.572 8.653 1.00 36.63 C ATOM 1775 CD LYS A 188 15.737 21.792 7.365 1.00 42.98 C ATOM 1776 CE LYS A 188 14.797 22.237 6.245 1.00 46.70 C ATOM 1777 NZ LYS A 188 13.360 22.143 6.665 1.00 47.13 N ATOM 1778 HZ1 LYS A 188 13.136 21.158 6.912 1.00 0.00 H ATOM 1779 HZ2 LYS A 188 13.201 22.754 7.492 1.00 0.00 H ATOM 1780 HZ3 LYS A 188 12.750 22.452 5.881 1.00 0.00 H ATOM 1781 H LYS A 188 17.592 24.432 9.877 1.00 0.00 H ATOM 1782 N LEU A 189 18.128 22.980 12.708 1.00 24.66 N ATOM 1783 CA LEU A 189 18.872 22.444 13.844 1.00 23.51 C ATOM 1784 C LEU A 189 18.370 22.915 15.226 1.00 23.73 C ATOM 1785 O LEU A 189 19.072 22.765 16.229 1.00 21.50 O ATOM 1786 CB LEU A 189 20.343 22.765 13.641 1.00 23.78 C ATOM 1787 CG LEU A 189 20.886 22.273 12.283 1.00 23.89 C ATOM 1788 CD1 LEU A 189 22.361 22.611 12.106 1.00 24.14 C ATOM 1789 CD2 LEU A 189 20.659 20.766 12.127 1.00 24.45 C ATOM 1790 H LEU A 189 18.413 23.899 12.314 1.00 0.00 H ATOM 1791 N ARG A 189A 17.136 23.432 15.283 1.00 24.32 N ATOM 1792 CA ARG A 189A 16.511 23.855 16.561 1.00 28.26 C ATOM 1793 C ARG A 189A 16.028 22.669 17.407 1.00 25.45 C ATOM 1794 O ARG A 189A 15.925 22.786 18.632 1.00 22.51 O ATOM 1795 CB ARG A 189A 15.354 24.849 16.316 1.00 31.03 C ATOM 1796 CG ARG A 189A 15.838 26.051 15.520 1.00 37.06 C ATOM 1797 CD ARG A 189A 14.777 27.091 15.151 1.00 42.04 C ATOM 1798 NE ARG A 189A 14.930 28.290 15.978 1.00 46.67 N ATOM 1799 CZ ARG A 189A 15.976 29.128 15.951 1.00 49.09 C ATOM 1800 NH1 ARG A 189A 17.025 28.933 15.122 1.00 47.15 N ATOM 1801 NH2 ARG A 189A 15.974 30.173 16.780 1.00 47.08 N ATOM 1802 HE ARG A 189A 14.161 28.510 16.643 1.00 0.00 H ATOM 1803 HH12 ARG A 189A 17.822 29.602 15.125 1.00 0.00 H ATOM 1804 HH11 ARG A 189A 17.036 28.114 14.481 1.00 0.00 H ATOM 1805 HH22 ARG A 189A 16.773 30.839 16.780 1.00 0.00 H ATOM 1806 HH21 ARG A 189A 15.173 30.322 17.427 1.00 0.00 H ATOM 1807 H ARG A 189A 16.597 23.541 14.401 1.00 0.00 H ATOM 1808 N HIS A 190 15.719 21.548 16.741 1.00 24.29 N ATOM 1809 CA HIS A 190 15.252 20.329 17.405 1.00 23.15 C ATOM 1810 C HIS A 190 16.392 19.357 17.598 1.00 20.21 C ATOM 1811 O HIS A 190 16.976 18.870 16.618 1.00 18.60 O ATOM 1812 CB HIS A 190 14.105 19.686 16.631 1.00 24.79 C ATOM 1813 CG HIS A 190 12.803 20.410 16.803 1.00 29.33 C ATOM 1814 ND1 HIS A 190 12.345 21.346 15.894 1.00 31.25 N ATOM 1815 CD2 HIS A 190 11.896 20.396 17.814 1.00 30.69 C ATOM 1816 CE1 HIS A 190 11.193 21.836 16.311 1.00 30.94 C ATOM 1817 NE2 HIS A 190 10.901 21.278 17.473 1.00 32.31 N ATOM 1818 H HIS A 190 15.815 21.543 15.705 1.00 0.00 H ATOM 1819 N TYR A 191 16.722 19.087 18.859 1.00 17.95 N ATOM 1820 CA TYR A 191 17.769 18.113 19.167 1.00 17.22 C ATOM 1821 C TYR A 191 17.525 17.436 20.500 1.00 17.01 C ATOM 1822 O TYR A 191 16.767 17.938 21.357 1.00 18.34 O ATOM 1823 CB TYR A 191 19.143 18.764 19.133 1.00 16.66 C ATOM 1824 CG TYR A 191 19.257 19.933 20.079 1.00 16.37 C ATOM 1825 CD1 TYR A 191 19.597 19.750 21.429 1.00 16.66 C ATOM 1826 CD2 TYR A 191 19.012 21.237 19.633 1.00 16.63 C ATOM 1827 CE1 TYR A 191 19.707 20.834 22.289 1.00 15.74 C ATOM 1828 CE2 TYR A 191 19.115 22.323 20.489 1.00 16.29 C ATOM 1829 CZ TYR A 191 19.461 22.108 21.811 1.00 16.41 C ATOM 1830 OH TYR A 191 19.516 23.186 22.647 1.00 17.26 O ATOM 1831 HH TYR A 191 20.187 23.831 22.308 1.00 0.00 H ATOM 1832 H TYR A 191 16.230 19.574 19.635 1.00 0.00 H ATOM 1833 N PHE A 192 18.160 16.287 20.656 1.00 16.30 N ATOM 1834 CA PHE A 192 18.116 15.522 21.888 1.00 16.36 C ATOM 1835 C PHE A 192 19.468 15.719 22.577 1.00 16.33 C ATOM 1836 O PHE A 192 20.465 16.013 21.908 1.00 15.95 O ATOM 1837 CB PHE A 192 17.855 14.047 21.572 1.00 16.80 C ATOM 1838 CG PHE A 192 16.613 13.829 20.776 1.00 17.46 C ATOM 1839 CD1 PHE A 192 15.372 13.765 21.414 1.00 17.44 C ATOM 1840 CD2 PHE A 192 16.667 13.756 19.379 1.00 17.47 C ATOM 1841 CE1 PHE A 192 14.220 13.600 20.680 1.00 18.06 C ATOM 1842 CE2 PHE A 192 15.510 13.592 18.633 1.00 17.52 C ATOM 1843 CZ PHE A 192 14.288 13.517 19.285 1.00 17.98 C ATOM 1844 H PHE A 192 18.716 15.915 19.860 1.00 0.00 H ATOM 1845 N ARG A 193 19.472 15.556 23.905 1.00 15.45 N ATOM 1846 CA ARG A 193 20.604 15.863 24.761 1.00 14.18 C ATOM 1847 C ARG A 193 20.657 14.847 25.868 1.00 14.38 C ATOM 1848 O ARG A 193 19.637 14.595 26.514 1.00 15.78 O ATOM 1849 CB ARG A 193 20.448 17.274 25.358 1.00 13.36 C ATOM 1850 CG ARG A 193 21.402 17.652 26.509 1.00 12.81 C ATOM 1851 CD ARG A 193 22.891 17.676 26.159 1.00 13.02 C ATOM 1852 NE ARG A 193 23.112 18.454 24.928 1.00 12.99 N ATOM 1853 CZ ARG A 193 22.983 19.780 24.799 1.00 12.55 C ATOM 1854 NH1 ARG A 193 22.728 20.571 25.832 1.00 13.08 N ATOM 1855 NH2 ARG A 193 23.152 20.349 23.602 1.00 12.36 N ATOM 1856 HE ARG A 193 23.395 17.923 24.079 1.00 0.00 H ATOM 1857 HH12 ARG A 193 22.635 21.597 25.691 1.00 0.00 H ATOM 1858 HH11 ARG A 193 22.621 20.165 26.784 1.00 0.00 H ATOM 1859 HH22 ARG A 193 23.053 21.379 23.497 1.00 0.00 H ATOM 1860 HH21 ARG A 193 23.383 19.762 22.775 1.00 0.00 H ATOM 1861 H ARG A 193 18.609 15.186 24.353 1.00 0.00 H ATOM 1862 N TYR A 194 21.837 14.276 26.088 1.00 14.42 N ATOM 1863 CA TYR A 194 22.115 13.443 27.252 1.00 15.31 C ATOM 1864 C TYR A 194 23.614 13.433 27.542 1.00 15.81 C ATOM 1865 O TYR A 194 24.419 13.925 26.722 1.00 16.54 O ATOM 1866 CB TYR A 194 21.570 11.975 27.075 1.00 15.25 C ATOM 1867 CG TYR A 194 22.404 11.089 26.178 1.00 15.43 C ATOM 1868 CD1 TYR A 194 22.306 11.180 24.783 1.00 15.36 C ATOM 1869 CD2 TYR A 194 23.267 10.136 26.705 1.00 15.69 C ATOM 1870 CE1 TYR A 194 23.072 10.375 23.961 1.00 15.19 C ATOM 1871 CE2 TYR A 194 24.046 9.323 25.881 1.00 14.48 C ATOM 1872 CZ TYR A 194 23.965 9.466 24.513 1.00 14.96 C ATOM 1873 OH TYR A 194 24.726 8.676 23.674 1.00 14.65 O ATOM 1874 HH TYR A 194 24.537 8.919 22.733 1.00 0.00 H ATOM 1875 H TYR A 194 22.598 14.431 25.397 1.00 0.00 H ATOM 1876 N LEU A 195 23.968 12.851 28.695 1.00 15.80 N ATOM 1877 CA LEU A 195 25.363 12.653 29.116 1.00 16.11 C ATOM 1878 C LEU A 195 25.863 11.239 28.921 1.00 15.88 C ATOM 1879 O LEU A 195 25.195 10.273 29.313 1.00 15.78 O ATOM 1880 CB LEU A 195 25.518 13.009 30.596 1.00 16.57 C ATOM 1881 CG LEU A 195 25.354 14.485 30.947 1.00 17.32 C ATOM 1882 CD1 LEU A 195 25.143 14.693 32.452 1.00 17.47 C ATOM 1883 CD2 LEU A 195 26.551 15.277 30.435 1.00 18.14 C ATOM 1884 H LEU A 195 23.213 12.520 29.329 1.00 0.00 H ATOM 1885 N GLY A 196 27.053 11.100 28.344 1.00 16.31 N ATOM 1886 CA GLY A 196 27.561 9.760 28.008 1.00 15.61 C ATOM 1887 C GLY A 196 29.057 9.708 27.807 1.00 15.89 C ATOM 1888 O GLY A 196 29.822 10.433 28.470 1.00 14.92 O ATOM 1889 H GLY A 196 27.626 11.941 28.129 1.00 0.00 H ATOM 1890 N SER A 197 29.468 8.836 26.885 1.00 15.44 N ATOM 1891 CA SER A 197 30.861 8.556 26.646 1.00 14.69 C ATOM 1892 C SER A 197 31.244 8.749 25.193 1.00 15.27 C ATOM 1893 O SER A 197 30.399 8.897 24.309 1.00 16.00 O ATOM 1894 CB SER A 197 31.193 7.124 27.059 1.00 14.61 C ATOM 1895 OG SER A 197 30.718 6.182 26.126 1.00 14.18 O ATOM 1896 HG SER A 197 31.134 6.354 25.244 1.00 0.00 H ATOM 1897 H SER A 197 28.754 8.338 26.316 1.00 0.00 H ATOM 1898 N LEU A 198 32.550 8.730 24.979 1.00 15.51 N ATOM 1899 CA LEU A 198 33.133 8.494 23.684 1.00 16.00 C ATOM 1900 C LEU A 198 32.810 7.049 23.272 1.00 15.47 C ATOM 1901 O LEU A 198 32.693 6.145 24.132 1.00 15.08 O ATOM 1902 CB LEU A 198 34.653 8.740 23.753 1.00 18.00 C ATOM 1903 CG LEU A 198 35.091 10.189 24.056 1.00 20.13 C ATOM 1904 CD1 LEU A 198 36.552 10.293 24.458 1.00 21.99 C ATOM 1905 CD2 LEU A 198 34.846 11.079 22.845 1.00 20.79 C ATOM 1906 H LEU A 198 33.186 8.893 25.786 1.00 0.00 H ATOM 1907 N THR A 199 32.654 6.834 21.968 1.00 14.93 N ATOM 1908 CA THR A 199 32.256 5.534 21.439 1.00 15.27 C ATOM 1909 C THR A 199 33.387 4.670 20.895 1.00 15.71 C ATOM 1910 O THR A 199 33.137 3.653 20.238 1.00 16.21 O ATOM 1911 CB THR A 199 31.153 5.679 20.372 1.00 15.17 C ATOM 1912 OG1 THR A 199 31.673 6.256 19.161 1.00 14.99 O ATOM 1913 CG2 THR A 199 30.000 6.533 20.929 1.00 15.27 C ATOM 1914 HG1 THR A 199 30.944 6.337 18.496 1.00 0.00 H ATOM 1915 H THR A 199 32.821 7.618 21.305 1.00 0.00 H ATOM 1916 N THR A 200 34.627 5.072 21.137 1.00 17.00 N ATOM 1917 CA THR A 200 35.765 4.173 20.949 1.00 17.82 C ATOM 1918 C THR A 200 36.632 4.187 22.208 1.00 17.93 C ATOM 1919 O THR A 200 36.593 5.135 22.982 1.00 17.62 O ATOM 1920 CB THR A 200 36.612 4.546 19.744 1.00 17.95 C ATOM 1921 OG1 THR A 200 37.133 5.855 19.946 1.00 19.35 O ATOM 1922 CG2 THR A 200 35.766 4.511 18.437 1.00 18.32 C ATOM 1923 HG1 THR A 200 37.688 5.865 20.766 1.00 0.00 H ATOM 1924 H THR A 200 34.793 6.044 21.466 1.00 0.00 H ATOM 1925 N PRO A 201 37.396 3.112 22.427 1.00 19.23 N ATOM 1926 CA PRO A 201 38.275 3.050 23.618 1.00 20.38 C ATOM 1927 C PRO A 201 39.173 4.265 23.706 1.00 19.64 C ATOM 1928 O PRO A 201 39.619 4.720 22.683 1.00 18.84 O ATOM 1929 CB PRO A 201 39.071 1.767 23.386 1.00 19.98 C ATOM 1930 CG PRO A 201 38.101 0.908 22.633 1.00 20.07 C ATOM 1931 CD PRO A 201 37.440 1.849 21.671 1.00 19.24 C ATOM 1932 N THR A 202 39.380 4.850 24.885 1.00 20.69 N ATOM 1933 CA THR A 202 38.995 4.290 26.175 1.00 21.35 C ATOM 1934 C THR A 202 37.547 4.581 26.646 1.00 21.68 C ATOM 1935 O THR A 202 37.238 4.362 27.825 1.00 22.36 O ATOM 1936 CB THR A 202 39.993 4.784 27.259 1.00 20.94 C ATOM 1937 OG1 THR A 202 40.023 6.211 27.261 1.00 20.03 O ATOM 1938 CG2 THR A 202 41.389 4.254 26.995 1.00 20.47 C ATOM 1939 HG1 THR A 202 39.118 6.559 27.461 1.00 0.00 H ATOM 1940 H THR A 202 39.852 5.777 24.885 1.00 0.00 H ATOM 1941 N CYS A 203 36.677 5.085 25.770 1.00 19.82 N ATOM 1942 CA CYS A 203 35.252 5.277 26.113 1.00 19.63 C ATOM 1943 C CYS A 203 35.025 6.126 27.371 1.00 18.59 C ATOM 1944 O CYS A 203 34.153 5.846 28.195 1.00 18.47 O ATOM 1945 CB CYS A 203 34.533 3.931 26.283 1.00 20.21 C ATOM 1946 SG CYS A 203 34.755 2.732 24.941 1.00 21.23 S ATOM 1947 H CYS A 203 37.010 5.350 24.821 1.00 0.00 H ATOM 1948 N ASP A 204 35.800 7.179 27.512 1.00 18.69 N ATOM 1949 CA ASP A 204 35.701 8.037 28.704 1.00 18.50 C ATOM 1950 C ASP A 204 34.345 8.679 28.789 1.00 17.71 C ATOM 1951 O ASP A 204 33.849 9.184 27.787 1.00 16.55 O ATOM 1952 CB ASP A 204 36.740 9.167 28.643 1.00 19.67 C ATOM 1953 CG ASP A 204 38.150 8.662 28.661 1.00 20.85 C ATOM 1954 OD1 ASP A 204 38.351 7.438 28.828 1.00 22.39 O ATOM 1955 OD2 ASP A 204 39.056 9.506 28.510 1.00 21.36 O ATOM 1956 H ASP A 204 36.493 7.409 26.771 1.00 0.00 H ATOM 1957 N GLU A 205 33.789 8.699 30.004 1.00 17.58 N ATOM 1958 CA GLU A 205 32.475 9.222 30.302 1.00 17.81 C ATOM 1959 C GLU A 205 32.515 10.731 30.566 1.00 18.20 C ATOM 1960 O GLU A 205 32.322 11.209 31.703 1.00 16.95 O ATOM 1961 CB GLU A 205 31.889 8.464 31.490 1.00 18.65 C ATOM 1962 CG GLU A 205 31.824 6.975 31.153 1.00 20.15 C ATOM 1963 CD GLU A 205 31.001 6.168 32.118 1.00 20.58 C ATOM 1964 OE1 GLU A 205 30.824 6.583 33.292 1.00 21.16 O ATOM 1965 OE2 GLU A 205 30.509 5.119 31.674 1.00 21.76 O ATOM 1966 H GLU A 205 34.343 8.309 30.793 1.00 0.00 H ATOM 1967 N LYS A 206 32.767 11.479 29.498 1.00 17.62 N ATOM 1968 CA LYS A 206 32.978 12.920 29.612 1.00 19.70 C ATOM 1969 C LYS A 206 32.392 13.706 28.441 1.00 17.93 C ATOM 1970 O LYS A 206 32.816 14.827 28.143 1.00 17.12 O ATOM 1971 CB LYS A 206 34.469 13.224 29.794 1.00 22.65 C ATOM 1972 CG LYS A 206 35.365 12.754 28.682 1.00 27.54 C ATOM 1973 CD LYS A 206 36.830 12.950 29.071 1.00 31.20 C ATOM 1974 CE LYS A 206 37.726 13.074 27.842 1.00 35.48 C ATOM 1975 NZ LYS A 206 39.188 12.952 28.164 1.00 37.30 N ATOM 1976 HZ1 LYS A 206 39.459 13.704 28.829 1.00 0.00 H ATOM 1977 HZ2 LYS A 206 39.370 12.023 28.595 1.00 0.00 H ATOM 1978 HZ3 LYS A 206 39.743 13.045 27.290 1.00 0.00 H ATOM 1979 H LYS A 206 32.815 11.030 28.561 1.00 0.00 H ATOM 1980 N VAL A 207 31.360 13.131 27.847 1.00 16.52 N ATOM 1981 CA VAL A 207 30.749 13.684 26.688 1.00 16.18 C ATOM 1982 C VAL A 207 29.329 14.170 26.979 1.00 15.67 C ATOM 1983 O VAL A 207 28.497 13.426 27.490 1.00 13.93 O ATOM 1984 CB VAL A 207 30.722 12.646 25.550 1.00 16.08 C ATOM 1985 CG1 VAL A 207 30.039 13.250 24.318 1.00 16.30 C ATOM 1986 CG2 VAL A 207 32.147 12.164 25.246 1.00 16.10 C ATOM 1987 H VAL A 207 30.983 12.245 28.240 1.00 0.00 H ATOM 1988 N VAL A 208 29.052 15.403 26.554 1.00 15.99 N ATOM 1989 CA VAL A 208 27.706 15.902 26.502 1.00 15.82 C ATOM 1990 C VAL A 208 27.281 15.739 25.055 1.00 15.63 C ATOM 1991 O VAL A 208 27.842 16.341 24.144 1.00 16.59 O ATOM 1992 CB VAL A 208 27.545 17.345 27.087 1.00 16.05 C ATOM 1993 CG1 VAL A 208 28.497 18.373 26.478 1.00 15.88 C ATOM 1994 CG2 VAL A 208 26.114 17.823 26.950 1.00 15.77 C ATOM 1995 H VAL A 208 29.832 16.021 26.252 1.00 0.00 H ATOM 1996 N TRP A 209 26.287 14.885 24.864 1.00 15.85 N ATOM 1997 CA TRP A 209 25.807 14.490 23.538 1.00 15.08 C ATOM 1998 C TRP A 209 24.669 15.379 23.077 1.00 15.15 C ATOM 1999 O TRP A 209 23.772 15.723 23.853 1.00 15.23 O ATOM 2000 CB TRP A 209 25.329 13.024 23.550 1.00 14.10 C ATOM 2001 CG TRP A 209 26.430 12.102 23.393 1.00 14.26 C ATOM 2002 CD1 TRP A 209 27.055 11.404 24.371 1.00 14.14 C ATOM 2003 CD2 TRP A 209 27.109 11.803 22.185 1.00 13.77 C ATOM 2004 NE1 TRP A 209 28.062 10.676 23.848 1.00 14.11 N ATOM 2005 CE2 TRP A 209 28.120 10.893 22.500 1.00 14.54 C ATOM 2006 CE3 TRP A 209 26.954 12.210 20.863 1.00 14.03 C ATOM 2007 CZ2 TRP A 209 28.995 10.369 21.533 1.00 15.06 C ATOM 2008 CZ3 TRP A 209 27.798 11.685 19.895 1.00 14.05 C ATOM 2009 CH2 TRP A 209 28.807 10.769 20.233 1.00 14.93 C ATOM 2010 HE1 TRP A 209 28.694 10.049 24.385 1.00 0.00 H ATOM 2011 H TRP A 209 25.823 14.474 25.699 1.00 0.00 H ATOM 2012 N THR A 210 24.709 15.711 21.788 1.00 15.45 N ATOM 2013 CA THR A 210 23.595 16.329 21.089 1.00 15.97 C ATOM 2014 C THR A 210 23.329 15.512 19.834 1.00 15.99 C ATOM 2015 O THR A 210 24.237 15.264 19.047 1.00 16.33 O ATOM 2016 CB THR A 210 23.920 17.783 20.688 1.00 15.99 C ATOM 2017 OG1 THR A 210 24.271 18.511 21.859 1.00 16.24 O ATOM 2018 CG2 THR A 210 22.729 18.455 19.994 1.00 15.62 C ATOM 2019 HG1 THR A 210 25.063 18.093 22.281 1.00 0.00 H ATOM 2020 H THR A 210 25.581 15.518 21.255 1.00 0.00 H ATOM 2021 N VAL A 211 22.092 15.083 19.656 1.00 15.93 N ATOM 2022 CA VAL A 211 21.709 14.358 18.463 1.00 14.76 C ATOM 2023 C VAL A 211 20.603 15.156 17.829 1.00 14.89 C ATOM 2024 O VAL A 211 19.531 15.294 18.412 1.00 14.58 O ATOM 2025 CB VAL A 211 21.198 12.945 18.794 1.00 14.80 C ATOM 2026 CG1 VAL A 211 20.778 12.222 17.508 1.00 14.69 C ATOM 2027 CG2 VAL A 211 22.257 12.144 19.556 1.00 14.44 C ATOM 2028 H VAL A 211 21.378 15.270 20.389 1.00 0.00 H ATOM 2029 N PHE A 212 20.850 15.680 16.641 1.00 15.56 N ATOM 2030 CA PHE A 212 19.872 16.542 15.978 1.00 16.79 C ATOM 2031 C PHE A 212 18.838 15.665 15.335 1.00 18.42 C ATOM 2032 O PHE A 212 19.170 14.596 14.830 1.00 20.04 O ATOM 2033 CB PHE A 212 20.539 17.436 14.935 1.00 17.13 C ATOM 2034 CG PHE A 212 21.403 18.478 15.538 1.00 16.80 C ATOM 2035 CD1 PHE A 212 22.710 18.188 15.880 1.00 16.80 C ATOM 2036 CD2 PHE A 212 20.884 19.721 15.854 1.00 17.77 C ATOM 2037 CE1 PHE A 212 23.492 19.129 16.489 1.00 17.49 C ATOM 2038 CE2 PHE A 212 21.677 20.675 16.473 1.00 18.15 C ATOM 2039 CZ PHE A 212 22.980 20.376 16.791 1.00 17.86 C ATOM 2040 H PHE A 212 21.755 15.476 16.170 1.00 0.00 H ATOM 2041 N ARG A 213 17.590 16.118 15.364 1.00 20.34 N ATOM 2042 CA ARG A 213 16.477 15.361 14.797 1.00 21.80 C ATOM 2043 C ARG A 213 16.506 15.321 13.262 1.00 22.00 C ATOM 2044 O ARG A 213 16.148 14.322 12.647 1.00 19.81 O ATOM 2045 CB ARG A 213 15.159 15.985 15.239 1.00 24.61 C ATOM 2046 CG ARG A 213 13.981 15.095 14.914 1.00 29.46 C ATOM 2047 CD ARG A 213 12.688 15.699 15.384 1.00 35.43 C ATOM 2048 NE ARG A 213 12.359 16.939 14.669 1.00 39.35 N ATOM 2049 CZ ARG A 213 11.315 17.709 14.970 1.00 43.23 C ATOM 2050 NH1 ARG A 213 10.491 17.376 15.969 1.00 43.91 N ATOM 2051 NH2 ARG A 213 11.086 18.813 14.270 1.00 44.74 N ATOM 2052 HE ARG A 213 12.975 17.232 13.884 1.00 0.00 H ATOM 2053 HH12 ARG A 213 9.678 17.983 16.197 1.00 0.00 H ATOM 2054 HH11 ARG A 213 10.663 16.510 16.518 1.00 0.00 H ATOM 2055 HH22 ARG A 213 10.272 19.417 14.502 1.00 0.00 H ATOM 2056 HH21 ARG A 213 11.721 19.075 13.489 1.00 0.00 H ATOM 2057 H ARG A 213 17.399 17.041 15.804 1.00 0.00 H ATOM 2058 N GLU A 214 16.909 16.437 12.658 1.00 22.37 N ATOM 2059 CA GLU A 214 16.937 16.571 11.217 1.00 22.25 C ATOM 2060 C GLU A 214 18.155 15.866 10.585 1.00 20.16 C ATOM 2061 O GLU A 214 19.283 16.264 10.828 1.00 17.51 O ATOM 2062 CB GLU A 214 16.973 18.051 10.855 1.00 24.75 C ATOM 2063 CG GLU A 214 16.792 18.352 9.383 1.00 26.87 C ATOM 2064 CD GLU A 214 15.359 18.195 8.919 1.00 29.66 C ATOM 2065 OE1 GLU A 214 14.421 18.440 9.704 1.00 33.41 O ATOM 2066 OE2 GLU A 214 15.173 17.827 7.746 1.00 33.71 O ATOM 2067 H GLU A 214 17.215 17.241 13.242 1.00 0.00 H ATOM 2068 N PRO A 215 17.911 14.867 9.718 1.00 20.35 N ATOM 2069 CA PRO A 215 19.010 14.187 9.044 1.00 20.61 C ATOM 2070 C PRO A 215 19.644 14.971 7.889 1.00 20.08 C ATOM 2071 O PRO A 215 19.006 15.807 7.265 1.00 20.70 O ATOM 2072 CB PRO A 215 18.371 12.889 8.505 1.00 21.20 C ATOM 2073 CG PRO A 215 16.908 12.974 8.777 1.00 21.02 C ATOM 2074 CD PRO A 215 16.596 14.346 9.283 1.00 21.29 C ATOM 2075 N ILE A 216 20.903 14.700 7.635 1.00 18.64 N ATOM 2076 CA ILE A 216 21.524 15.087 6.388 1.00 19.26 C ATOM 2077 C ILE A 216 21.031 14.134 5.293 1.00 18.69 C ATOM 2078 O ILE A 216 21.008 12.927 5.484 1.00 17.75 O ATOM 2079 CB ILE A 216 23.054 14.971 6.501 1.00 19.27 C ATOM 2080 CG1 ILE A 216 23.584 15.958 7.539 1.00 18.95 C ATOM 2081 CG2 ILE A 216 23.725 15.135 5.141 1.00 19.87 C ATOM 2082 CD1 ILE A 216 24.889 15.500 8.150 1.00 18.74 C ATOM 2083 H ILE A 216 21.467 14.195 8.348 1.00 0.00 H ATOM 2084 N GLN A 217 20.655 14.684 4.147 1.00 18.80 N ATOM 2085 CA GLN A 217 20.286 13.873 2.978 1.00 19.62 C ATOM 2086 C GLN A 217 21.540 13.678 2.134 1.00 18.38 C ATOM 2087 O GLN A 217 22.199 14.634 1.756 1.00 17.21 O ATOM 2088 CB GLN A 217 19.186 14.573 2.171 1.00 21.45 C ATOM 2089 CG GLN A 217 17.916 14.875 2.978 1.00 23.47 C ATOM 2090 CD GLN A 217 17.162 13.616 3.397 1.00 26.96 C ATOM 2091 OE1 GLN A 217 16.842 12.775 2.575 1.00 30.65 O ATOM 2092 NE2 GLN A 217 16.846 13.496 4.685 1.00 29.61 N ATOM 2093 HE22 GLN A 217 17.134 14.231 5.362 1.00 0.00 H ATOM 2094 HE21 GLN A 217 16.311 12.667 5.014 1.00 0.00 H ATOM 2095 H GLN A 217 20.620 15.721 4.073 1.00 0.00 H ATOM 2096 N LEU A 218 21.891 12.421 1.897 1.00 18.68 N ATOM 2097 CA LEU A 218 23.008 12.051 1.034 1.00 19.22 C ATOM 2098 C LEU A 218 22.551 11.035 0.045 1.00 17.67 C ATOM 2099 O LEU A 218 21.846 10.138 0.410 1.00 18.42 O ATOM 2100 CB LEU A 218 24.161 11.421 1.808 1.00 20.02 C ATOM 2101 CG LEU A 218 25.388 12.206 2.212 1.00 22.08 C ATOM 2102 CD1 LEU A 218 26.539 11.253 2.482 1.00 21.93 C ATOM 2103 CD2 LEU A 218 25.817 13.189 1.148 1.00 24.24 C ATOM 2104 H LEU A 218 21.343 11.661 2.349 1.00 0.00 H ATOM 2105 N HIS A 219 23.017 11.154 -1.196 1.00 17.98 N ATOM 2106 CA HIS A 219 22.753 10.148 -2.227 1.00 18.34 C ATOM 2107 C HIS A 219 23.350 8.813 -1.805 1.00 17.68 C ATOM 2108 O HIS A 219 24.442 8.749 -1.212 1.00 17.36 O ATOM 2109 CB HIS A 219 23.325 10.610 -3.572 1.00 19.46 C ATOM 2110 CG HIS A 219 22.814 9.862 -4.757 1.00 20.90 C ATOM 2111 ND1 HIS A 219 23.224 8.587 -5.057 1.00 21.37 N ATOM 2112 CD2 HIS A 219 21.982 10.229 -5.758 1.00 21.19 C ATOM 2113 CE1 HIS A 219 22.625 8.171 -6.157 1.00 21.99 C ATOM 2114 NE2 HIS A 219 21.874 9.157 -6.610 1.00 22.03 N ATOM 2115 H HIS A 219 23.587 11.988 -1.442 1.00 0.00 H ATOM 2116 N ARG A 220 22.621 7.744 -2.071 1.00 18.10 N ATOM 2117 CA ARG A 220 23.125 6.388 -1.824 1.00 19.45 C ATOM 2118 C ARG A 220 24.582 6.200 -2.209 1.00 18.23 C ATOM 2119 O ARG A 220 25.361 5.649 -1.461 1.00 17.98 O ATOM 2120 CB ARG A 220 22.289 5.349 -2.579 1.00 20.35 C ATOM 2121 CG ARG A 220 21.006 5.019 -1.889 1.00 22.92 C ATOM 2122 CD ARG A 220 20.234 3.897 -2.584 1.00 26.41 C ATOM 2123 NE ARG A 220 18.999 3.675 -1.842 1.00 30.15 N ATOM 2124 CZ ARG A 220 17.943 4.491 -1.850 1.00 35.25 C ATOM 2125 NH1 ARG A 220 17.906 5.597 -2.601 1.00 38.74 N ATOM 2126 NH2 ARG A 220 16.888 4.194 -1.103 1.00 38.41 N ATOM 2127 HE ARG A 220 18.936 2.814 -1.262 1.00 0.00 H ATOM 2128 HH12 ARG A 220 17.066 6.210 -2.583 1.00 0.00 H ATOM 2129 HH11 ARG A 220 18.717 5.844 -3.203 1.00 0.00 H ATOM 2130 HH22 ARG A 220 16.059 4.822 -1.101 1.00 0.00 H ATOM 2131 HH21 ARG A 220 16.890 3.333 -0.520 1.00 0.00 H ATOM 2132 H ARG A 220 21.666 7.866 -2.465 1.00 0.00 H ATOM 2133 N GLU A 221 24.915 6.564 -3.434 1.00 17.83 N ATOM 2134 CA GLU A 221 26.258 6.399 -3.929 1.00 18.23 C ATOM 2135 C GLU A 221 27.341 7.291 -3.270 1.00 17.71 C ATOM 2136 O GLU A 221 28.513 6.905 -3.224 1.00 18.21 O ATOM 2137 CB GLU A 221 26.243 6.469 -5.468 1.00 19.51 C ATOM 2138 CG GLU A 221 25.626 5.217 -6.083 1.00 20.54 C ATOM 2139 CD GLU A 221 25.556 5.245 -7.607 1.00 21.97 C ATOM 2140 OE1 GLU A 221 25.079 6.265 -8.148 1.00 23.61 O ATOM 2141 OE2 GLU A 221 25.950 4.237 -8.262 1.00 20.12 O ATOM 2142 H GLU A 221 24.192 6.979 -4.055 1.00 0.00 H ATOM 2143 N GLN A 222 26.974 8.462 -2.752 1.00 17.62 N ATOM 2144 CA GLN A 222 27.904 9.253 -1.920 1.00 17.64 C ATOM 2145 C GLN A 222 28.197 8.510 -0.599 1.00 16.13 C ATOM 2146 O GLN A 222 29.329 8.549 -0.112 1.00 15.27 O ATOM 2147 CB GLN A 222 27.366 10.663 -1.615 1.00 17.82 C ATOM 2148 CG GLN A 222 27.127 11.543 -2.837 1.00 18.77 C ATOM 2149 CD GLN A 222 26.504 12.898 -2.486 1.00 18.81 C ATOM 2150 OE1 GLN A 222 25.348 12.986 -2.094 1.00 19.21 O ATOM 2151 NE2 GLN A 222 27.285 13.952 -2.615 1.00 19.19 N ATOM 2152 HE22 GLN A 222 28.262 13.837 -2.951 1.00 0.00 H ATOM 2153 HE21 GLN A 222 26.924 14.899 -2.380 1.00 0.00 H ATOM 2154 H GLN A 222 26.017 8.825 -2.936 1.00 0.00 H ATOM 2155 N ILE A 223 27.182 7.851 -0.041 1.00 15.86 N ATOM 2156 CA ILE A 223 27.358 6.998 1.136 1.00 16.47 C ATOM 2157 C ILE A 223 28.267 5.785 0.800 1.00 15.82 C ATOM 2158 O ILE A 223 29.232 5.482 1.521 1.00 13.79 O ATOM 2159 CB ILE A 223 25.999 6.526 1.715 1.00 16.83 C ATOM 2160 CG1 ILE A 223 25.191 7.700 2.266 1.00 16.87 C ATOM 2161 CG2 ILE A 223 26.209 5.534 2.844 1.00 17.25 C ATOM 2162 CD1 ILE A 223 23.711 7.434 2.308 1.00 16.45 C ATOM 2163 H ILE A 223 26.233 7.946 -0.455 1.00 0.00 H ATOM 2164 N LEU A 224 27.956 5.121 -0.310 1.00 14.89 N ATOM 2165 CA LEU A 224 28.715 3.937 -0.725 1.00 15.75 C ATOM 2166 C LEU A 224 30.211 4.220 -0.990 1.00 16.13 C ATOM 2167 O LEU A 224 31.056 3.341 -0.776 1.00 15.32 O ATOM 2168 CB LEU A 224 28.067 3.268 -1.956 1.00 16.77 C ATOM 2169 CG LEU A 224 26.721 2.577 -1.631 1.00 16.94 C ATOM 2170 CD1 LEU A 224 25.977 2.166 -2.888 1.00 17.54 C ATOM 2171 CD2 LEU A 224 26.904 1.380 -0.710 1.00 17.51 C ATOM 2172 H LEU A 224 27.160 5.448 -0.894 1.00 0.00 H ATOM 2173 N ALA A 225 30.507 5.455 -1.413 1.00 15.66 N ATOM 2174 CA ALA A 225 31.850 5.943 -1.640 1.00 15.88 C ATOM 2175 C ALA A 225 32.747 5.764 -0.413 1.00 16.51 C ATOM 2176 O ALA A 225 33.967 5.528 -0.556 1.00 16.45 O ATOM 2177 CB ALA A 225 31.824 7.407 -2.027 1.00 16.13 C ATOM 2178 H ALA A 225 29.718 6.108 -1.591 1.00 0.00 H ATOM 2179 N PHE A 226 32.149 5.831 0.781 1.00 16.24 N ATOM 2180 CA PHE A 226 32.910 5.596 2.010 1.00 15.85 C ATOM 2181 C PHE A 226 33.416 4.142 2.065 1.00 16.17 C ATOM 2182 O PHE A 226 34.611 3.912 2.194 1.00 17.31 O ATOM 2183 CB PHE A 226 32.097 6.003 3.245 1.00 15.57 C ATOM 2184 CG PHE A 226 31.966 7.514 3.396 1.00 15.20 C ATOM 2185 CD1 PHE A 226 31.064 8.233 2.625 1.00 15.04 C ATOM 2186 CD2 PHE A 226 32.803 8.217 4.253 1.00 14.97 C ATOM 2187 CE1 PHE A 226 30.976 9.615 2.722 1.00 15.25 C ATOM 2188 CE2 PHE A 226 32.714 9.588 4.365 1.00 15.23 C ATOM 2189 CZ PHE A 226 31.808 10.296 3.600 1.00 15.26 C ATOM 2190 H PHE A 226 31.134 6.052 0.837 1.00 0.00 H ATOM 2191 N SER A 227 32.532 3.160 1.941 1.00 15.67 N ATOM 2192 CA SER A 227 32.965 1.756 1.981 1.00 14.93 C ATOM 2193 C SER A 227 33.692 1.333 0.727 1.00 14.79 C ATOM 2194 O SER A 227 34.448 0.343 0.771 1.00 16.04 O ATOM 2195 CB SER A 227 31.801 0.797 2.224 1.00 14.56 C ATOM 2196 OG SER A 227 30.820 0.935 1.216 1.00 14.66 O ATOM 2197 HG SER A 227 30.476 1.863 1.217 1.00 0.00 H ATOM 2198 H SER A 227 31.525 3.386 1.814 1.00 0.00 H ATOM 2199 N GLN A 227A 33.485 2.044 -0.377 1.00 13.90 N ATOM 2200 CA GLN A 227A 34.165 1.692 -1.621 1.00 14.57 C ATOM 2201 C GLN A 227A 35.632 2.164 -1.702 1.00 14.43 C ATOM 2202 O GLN A 227A 36.454 1.536 -2.359 1.00 13.87 O ATOM 2203 CB GLN A 227A 33.381 2.221 -2.817 1.00 14.83 C ATOM 2204 CG GLN A 227A 32.130 1.437 -3.127 1.00 14.99 C ATOM 2205 CD GLN A 227A 31.178 2.187 -4.048 1.00 15.20 C ATOM 2206 OE1 GLN A 227A 31.338 3.379 -4.282 1.00 15.55 O ATOM 2207 NE2 GLN A 227A 30.169 1.496 -4.539 1.00 14.93 N ATOM 2208 HE22 GLN A 227A 30.072 0.485 -4.314 1.00 0.00 H ATOM 2209 HE21 GLN A 227A 29.469 1.961 -5.152 1.00 0.00 H ATOM 2210 H GLN A 227A 32.835 2.856 -0.355 1.00 0.00 H ATOM 2211 N LYS A 228 35.934 3.287 -1.071 1.00 15.58 N ATOM 2212 CA LYS A 228 37.258 3.923 -1.184 1.00 16.60 C ATOM 2213 C LYS A 228 38.138 3.741 -0.002 1.00 15.89 C ATOM 2214 O LYS A 228 39.336 3.923 -0.134 1.00 16.28 O ATOM 2215 CB LYS A 228 37.137 5.429 -1.456 1.00 18.20 C ATOM 2216 CG LYS A 228 36.480 5.767 -2.778 1.00 20.92 C ATOM 2217 CD LYS A 228 37.181 4.988 -3.896 1.00 25.07 C ATOM 2218 CE LYS A 228 37.080 5.621 -5.283 1.00 27.88 C ATOM 2219 NZ LYS A 228 35.801 5.260 -5.911 1.00 28.65 N ATOM 2220 HZ1 LYS A 228 35.741 4.226 -6.002 1.00 0.00 H ATOM 2221 HZ2 LYS A 228 35.017 5.604 -5.320 1.00 0.00 H ATOM 2222 HZ3 LYS A 228 35.744 5.696 -6.853 1.00 0.00 H ATOM 2223 H LYS A 228 35.211 3.737 -0.474 1.00 0.00 H ATOM 2224 N LEU A 229 37.588 3.371 1.143 1.00 15.57 N ATOM 2225 CA LEU A 229 38.385 3.309 2.366 1.00 16.70 C ATOM 2226 C LEU A 229 38.606 1.882 2.891 1.00 16.43 C ATOM 2227 O LEU A 229 37.714 1.020 2.769 1.00 15.62 O ATOM 2228 CB LEU A 229 37.700 4.134 3.468 1.00 16.76 C ATOM 2229 CG LEU A 229 37.432 5.597 3.135 1.00 17.12 C ATOM 2230 CD1 LEU A 229 36.565 6.261 4.211 1.00 17.08 C ATOM 2231 CD2 LEU A 229 38.749 6.331 2.972 1.00 17.65 C ATOM 2232 H LEU A 229 36.579 3.122 1.173 1.00 0.00 H ATOM 2233 N TYR A 230 39.764 1.679 3.533 1.00 16.47 N ATOM 2234 CA TYR A 230 40.088 0.441 4.233 1.00 16.84 C ATOM 2235 C TYR A 230 40.484 0.634 5.708 1.00 16.63 C ATOM 2236 O TYR A 230 41.075 1.642 6.097 1.00 14.86 O ATOM 2237 CB TYR A 230 41.200 -0.292 3.499 1.00 16.85 C ATOM 2238 CG TYR A 230 40.812 -0.671 2.095 1.00 16.94 C ATOM 2239 CD1 TYR A 230 40.302 -1.936 1.821 1.00 17.12 C ATOM 2240 CD2 TYR A 230 40.944 0.230 1.049 1.00 16.59 C ATOM 2241 CE1 TYR A 230 39.948 -2.306 0.523 1.00 17.84 C ATOM 2242 CE2 TYR A 230 40.579 -0.114 -0.240 1.00 17.32 C ATOM 2243 CZ TYR A 230 40.074 -1.388 -0.514 1.00 17.51 C ATOM 2244 OH TYR A 230 39.684 -1.771 -1.809 1.00 15.33 O ATOM 2245 HH TYR A 230 38.961 -1.173 -2.125 1.00 0.00 H ATOM 2246 H TYR A 230 40.469 2.444 3.532 1.00 0.00 H ATOM 2247 N TYR A 231 40.180 -0.385 6.507 1.00 16.93 N ATOM 2248 CA TYR A 231 40.651 -0.454 7.885 1.00 17.72 C ATOM 2249 C TYR A 231 42.149 -0.651 7.979 1.00 19.72 C ATOM 2250 O TYR A 231 42.733 -0.289 8.974 1.00 21.21 O ATOM 2251 CB TYR A 231 40.005 -1.611 8.621 1.00 16.61 C ATOM 2252 CG TYR A 231 38.597 -1.372 9.061 1.00 16.40 C ATOM 2253 CD1 TYR A 231 38.319 -0.498 10.104 1.00 16.36 C ATOM 2254 CD2 TYR A 231 37.533 -2.038 8.468 1.00 16.70 C ATOM 2255 CE1 TYR A 231 37.034 -0.293 10.557 1.00 16.70 C ATOM 2256 CE2 TYR A 231 36.216 -1.831 8.903 1.00 16.59 C ATOM 2257 CZ TYR A 231 35.970 -0.957 9.955 1.00 16.81 C ATOM 2258 OH TYR A 231 34.677 -0.740 10.438 1.00 17.61 O ATOM 2259 HH TYR A 231 34.110 -0.382 9.710 1.00 0.00 H ATOM 2260 H TYR A 231 39.588 -1.156 6.137 1.00 0.00 H ATOM 2261 N ASP A 232 42.768 -1.228 6.958 1.00 22.08 N ATOM 2262 CA ASP A 232 44.139 -1.735 7.057 1.00 24.04 C ATOM 2263 C ASP A 232 44.977 -1.361 5.823 1.00 24.53 C ATOM 2264 O ASP A 232 44.424 -1.154 4.725 1.00 22.75 O ATOM 2265 CB ASP A 232 44.088 -3.254 7.264 1.00 25.00 C ATOM 2266 CG ASP A 232 43.329 -3.974 6.132 1.00 28.37 C ATOM 2267 OD1 ASP A 232 42.225 -3.538 5.692 1.00 27.97 O ATOM 2268 OD2 ASP A 232 43.838 -5.008 5.671 1.00 30.50 O ATOM 2269 H ASP A 232 42.262 -1.324 6.054 1.00 0.00 H ATOM 2270 N LYS A 233 46.290 -1.313 5.993 1.00 26.05 N ATOM 2271 CA LYS A 233 47.175 -1.003 4.910 1.00 29.38 C ATOM 2272 C LYS A 233 47.150 -2.093 3.864 1.00 28.60 C ATOM 2273 O LYS A 233 47.319 -1.796 2.719 1.00 27.80 O ATOM 2274 CB LYS A 233 48.570 -0.688 5.405 1.00 34.95 C ATOM 2275 CG LYS A 233 49.428 -1.868 5.733 1.00 41.48 C ATOM 2276 CD LYS A 233 50.914 -1.479 5.690 1.00 48.46 C ATOM 2277 CE LYS A 233 51.474 -1.601 4.282 1.00 54.31 C ATOM 2278 NZ LYS A 233 52.750 -0.886 3.990 1.00 58.26 N ATOM 2279 HZ1 LYS A 233 52.619 0.133 4.150 1.00 0.00 H ATOM 2280 HZ2 LYS A 233 53.498 -1.243 4.618 1.00 0.00 H ATOM 2281 HZ3 LYS A 233 53.020 -1.051 2.999 1.00 0.00 H ATOM 2282 H LYS A 233 46.688 -1.505 6.935 1.00 0.00 H ATOM 2283 N GLU A 236 46.879 -3.343 4.276 1.00 21.58 N ATOM 2284 CA GLU A 236 46.761 -4.479 3.356 1.00 22.06 C ATOM 2285 C GLU A 236 45.501 -4.393 2.466 1.00 21.74 C ATOM 2286 O GLU A 236 45.378 -5.093 1.513 1.00 19.34 O ATOM 2287 CB GLU A 236 46.724 -5.800 4.101 1.00 23.07 C ATOM 2288 CG GLU A 236 48.010 -6.242 4.764 1.00 24.13 C ATOM 2289 CD GLU A 236 48.256 -5.630 6.148 1.00 25.80 C ATOM 2290 OE1 GLU A 236 47.357 -5.062 6.749 1.00 25.77 O ATOM 2291 OE2 GLU A 236 49.358 -5.740 6.626 1.00 26.79 O ATOM 2292 H GLU A 236 46.747 -3.513 5.294 1.00 0.00 H ATOM 2293 N GLN A 237 44.592 -3.504 2.840 1.00 21.23 N ATOM 2294 CA GLN A 237 43.330 -3.273 2.123 1.00 20.77 C ATOM 2295 C GLN A 237 42.485 -4.560 1.940 1.00 20.57 C ATOM 2296 O GLN A 237 41.904 -4.782 0.871 1.00 19.99 O ATOM 2297 CB GLN A 237 43.582 -2.588 0.756 1.00 21.09 C ATOM 2298 CG GLN A 237 44.350 -1.286 0.848 1.00 20.16 C ATOM 2299 CD GLN A 237 44.372 -0.493 -0.459 1.00 20.60 C ATOM 2300 OE1 GLN A 237 44.208 0.715 -0.463 1.00 19.47 O ATOM 2301 NE2 GLN A 237 44.578 -1.171 -1.556 1.00 21.05 N ATOM 2302 HE22 GLN A 237 44.714 -2.201 -1.513 1.00 0.00 H ATOM 2303 HE21 GLN A 237 44.606 -0.681 -2.473 1.00 0.00 H ATOM 2304 H GLN A 237 44.783 -2.937 3.691 1.00 0.00 H ATOM 2305 N THR A 238 42.418 -5.383 2.987 1.00 19.38 N ATOM 2306 CA THR A 238 41.642 -6.598 2.991 1.00 20.53 C ATOM 2307 C THR A 238 40.221 -6.442 3.551 1.00 21.02 C ATOM 2308 O THR A 238 39.360 -7.298 3.294 1.00 21.18 O ATOM 2309 CB THR A 238 42.334 -7.704 3.814 1.00 21.78 C ATOM 2310 OG1 THR A 238 42.598 -7.225 5.143 1.00 22.90 O ATOM 2311 CG2 THR A 238 43.626 -8.124 3.151 1.00 22.00 C ATOM 2312 HG1 THR A 238 43.189 -6.432 5.095 1.00 0.00 H ATOM 2313 H THR A 238 42.953 -5.136 3.844 1.00 0.00 H ATOM 2314 N VAL A 239 39.994 -5.395 4.342 1.00 20.29 N ATOM 2315 CA VAL A 239 38.679 -5.137 4.930 1.00 19.79 C ATOM 2316 C VAL A 239 38.290 -3.705 4.596 1.00 18.02 C ATOM 2317 O VAL A 239 38.835 -2.753 5.157 1.00 16.84 O ATOM 2318 CB VAL A 239 38.646 -5.324 6.472 1.00 20.11 C ATOM 2319 CG1 VAL A 239 37.196 -5.251 6.987 1.00 20.42 C ATOM 2320 CG2 VAL A 239 39.308 -6.641 6.866 1.00 20.54 C ATOM 2321 H VAL A 239 40.775 -4.740 4.548 1.00 0.00 H ATOM 2322 N SER A 240 37.319 -3.581 3.695 1.00 17.87 N ATOM 2323 CA SER A 240 36.710 -2.302 3.370 1.00 17.15 C ATOM 2324 C SER A 240 36.147 -1.634 4.640 1.00 18.26 C ATOM 2325 O SER A 240 35.571 -2.321 5.513 1.00 16.83 O ATOM 2326 CB SER A 240 35.654 -2.511 2.281 1.00 16.62 C ATOM 2327 OG SER A 240 36.294 -2.661 1.018 1.00 16.15 O ATOM 2328 HG SER A 240 36.819 -1.846 0.816 1.00 0.00 H ATOM 2329 H SER A 240 36.982 -4.433 3.204 1.00 0.00 H ATOM 2330 N MET A 241 36.386 -0.322 4.789 1.00 18.55 N ATOM 2331 CA MET A 241 35.931 0.401 5.989 1.00 19.26 C ATOM 2332 C MET A 241 34.432 0.629 5.951 1.00 19.01 C ATOM 2333 O MET A 241 33.938 1.422 5.169 1.00 17.53 O ATOM 2334 CB MET A 241 36.635 1.747 6.179 1.00 19.34 C ATOM 2335 CG MET A 241 36.533 2.246 7.611 1.00 19.54 C ATOM 2336 SD MET A 241 37.223 3.900 7.893 1.00 18.87 S ATOM 2337 CE MET A 241 38.941 3.486 8.187 1.00 20.12 C ATOM 2338 H MET A 241 36.900 0.192 4.046 1.00 0.00 H ATOM 2339 N LYS A 242 33.735 -0.076 6.826 1.00 19.18 N ATOM 2340 CA LYS A 242 32.296 0.073 7.011 1.00 20.52 C ATOM 2341 C LYS A 242 31.943 -0.638 8.312 1.00 19.40 C ATOM 2342 O LYS A 242 32.749 -1.411 8.840 1.00 18.32 O ATOM 2343 CB LYS A 242 31.515 -0.568 5.852 1.00 21.23 C ATOM 2344 CG LYS A 242 31.576 -2.083 5.848 1.00 22.70 C ATOM 2345 CD LYS A 242 30.727 -2.706 4.752 1.00 25.91 C ATOM 2346 CE LYS A 242 30.898 -4.227 4.791 1.00 28.80 C ATOM 2347 NZ LYS A 242 29.765 -4.947 4.160 1.00 33.05 N ATOM 2348 HZ1 LYS A 242 28.884 -4.712 4.661 1.00 0.00 H ATOM 2349 HZ2 LYS A 242 29.686 -4.660 3.163 1.00 0.00 H ATOM 2350 HZ3 LYS A 242 29.933 -5.972 4.215 1.00 0.00 H ATOM 2351 H LYS A 242 34.239 -0.772 7.412 1.00 0.00 H ATOM 2352 N ASP A 243 30.714 -0.443 8.771 1.00 18.31 N ATOM 2353 CA ASP A 243 30.261 -0.984 10.059 1.00 17.57 C ATOM 2354 C ASP A 243 31.230 -0.617 11.183 1.00 15.74 C ATOM 2355 O ASP A 243 31.488 -1.399 12.091 1.00 14.70 O ATOM 2356 CB ASP A 243 29.991 -2.495 9.968 1.00 18.27 C ATOM 2357 CG ASP A 243 28.892 -2.832 8.973 1.00 19.02 C ATOM 2358 OD1 ASP A 243 27.920 -2.062 8.855 1.00 19.16 O ATOM 2359 OD2 ASP A 243 29.016 -3.864 8.288 1.00 21.53 O ATOM 2360 H ASP A 243 30.047 0.113 8.198 1.00 0.00 H ATOM 2361 N ASN A 244 31.729 0.620 11.114 1.00 15.93 N ATOM 2362 CA ASN A 244 32.602 1.165 12.133 1.00 15.79 C ATOM 2363 C ASN A 244 31.658 1.800 13.171 1.00 15.71 C ATOM 2364 O ASN A 244 31.642 3.014 13.385 1.00 14.75 O ATOM 2365 CB ASN A 244 33.680 2.116 11.554 1.00 15.79 C ATOM 2366 CG ASN A 244 33.117 3.217 10.665 1.00 16.07 C ATOM 2367 OD1 ASN A 244 32.006 3.112 10.136 1.00 16.79 O ATOM 2368 ND2 ASN A 244 33.899 4.273 10.477 1.00 14.89 N ATOM 2369 HD22 ASN A 244 34.828 4.321 10.942 1.00 0.00 H ATOM 2370 HD21 ASN A 244 33.583 5.052 9.865 1.00 0.00 H ATOM 2371 H ASN A 244 31.481 1.214 10.297 1.00 0.00 H ATOM 2372 N VAL A 245 30.859 0.930 13.806 1.00 15.08 N ATOM 2373 CA VAL A 245 29.756 1.327 14.647 1.00 14.79 C ATOM 2374 C VAL A 245 29.808 0.543 15.968 1.00 14.51 C ATOM 2375 O VAL A 245 29.859 -0.685 15.984 1.00 13.49 O ATOM 2376 CB VAL A 245 28.408 1.046 13.944 1.00 15.10 C ATOM 2377 CG1 VAL A 245 27.250 1.167 14.919 1.00 15.34 C ATOM 2378 CG2 VAL A 245 28.204 1.984 12.757 1.00 15.12 C ATOM 2379 H VAL A 245 31.045 -0.086 13.686 1.00 0.00 H ATOM 2380 N ARG A 246 29.784 1.271 17.074 1.00 14.35 N ATOM 2381 CA ARG A 246 29.682 0.634 18.374 1.00 14.17 C ATOM 2382 C ARG A 246 28.256 0.216 18.640 1.00 14.09 C ATOM 2383 O ARG A 246 27.315 0.986 18.380 1.00 13.27 O ATOM 2384 CB ARG A 246 30.133 1.564 19.496 1.00 14.30 C ATOM 2385 CG ARG A 246 30.282 0.813 20.813 1.00 14.10 C ATOM 2386 CD ARG A 246 30.533 1.753 21.945 1.00 14.63 C ATOM 2387 NE ARG A 246 30.890 1.013 23.159 1.00 15.12 N ATOM 2388 CZ ARG A 246 30.999 1.536 24.375 1.00 14.81 C ATOM 2389 NH1 ARG A 246 30.799 2.833 24.560 1.00 14.39 N ATOM 2390 NH2 ARG A 246 31.318 0.736 25.411 1.00 14.55 N ATOM 2391 HE ARG A 246 31.073 -0.006 23.060 1.00 0.00 H ATOM 2392 HH12 ARG A 246 30.885 3.242 25.513 1.00 0.00 H ATOM 2393 HH11 ARG A 246 30.556 3.442 23.753 1.00 0.00 H ATOM 2394 HH22 ARG A 246 31.406 1.134 26.368 1.00 0.00 H ATOM 2395 HH21 ARG A 246 31.476 -0.280 25.254 1.00 0.00 H ATOM 2396 H ARG A 246 29.839 2.308 17.010 1.00 0.00 H ATOM 2397 N PRO A 247 28.075 -1.001 19.151 1.00 15.32 N ATOM 2398 CA PRO A 247 26.715 -1.430 19.472 1.00 15.49 C ATOM 2399 C PRO A 247 26.060 -0.580 20.559 1.00 15.72 C ATOM 2400 O PRO A 247 26.758 0.076 21.347 1.00 16.16 O ATOM 2401 CB PRO A 247 26.865 -2.897 19.919 1.00 14.93 C ATOM 2402 CG PRO A 247 28.302 -3.174 19.966 1.00 15.89 C ATOM 2403 CD PRO A 247 29.024 -2.127 19.168 1.00 15.51 C ATOM 2404 N LEU A 248 24.731 -0.633 20.575 1.00 16.01 N ATOM 2405 CA LEU A 248 23.916 0.157 21.484 1.00 17.10 C ATOM 2406 C LEU A 248 24.186 -0.188 22.935 1.00 18.05 C ATOM 2407 O LEU A 248 24.370 -1.373 23.277 1.00 17.05 O ATOM 2408 CB LEU A 248 22.422 -0.029 21.195 1.00 17.52 C ATOM 2409 CG LEU A 248 21.828 0.614 19.952 1.00 18.01 C ATOM 2410 CD1 LEU A 248 20.350 0.337 19.873 1.00 17.88 C ATOM 2411 CD2 LEU A 248 22.065 2.126 19.937 1.00 19.53 C ATOM 2412 H LEU A 248 24.252 -1.269 19.906 1.00 0.00 H ATOM 2413 N GLN A 249 24.240 0.860 23.760 1.00 17.87 N ATOM 2414 CA GLN A 249 24.484 0.756 25.185 1.00 18.59 C ATOM 2415 C GLN A 249 23.204 1.079 25.954 1.00 21.02 C ATOM 2416 O GLN A 249 22.282 1.731 25.413 1.00 21.29 O ATOM 2417 CB GLN A 249 25.563 1.743 25.583 1.00 18.97 C ATOM 2418 CG GLN A 249 26.867 1.574 24.825 1.00 18.53 C ATOM 2419 CD GLN A 249 27.520 0.249 25.149 1.00 17.52 C ATOM 2420 OE1 GLN A 249 27.759 -0.035 26.303 1.00 18.25 O ATOM 2421 NE2 GLN A 249 27.798 -0.564 24.137 1.00 16.88 N ATOM 2422 HE22 GLN A 249 27.574 -0.277 23.163 1.00 0.00 H ATOM 2423 HE21 GLN A 249 28.239 -1.488 24.318 1.00 0.00 H ATOM 2424 H GLN A 249 24.099 1.808 23.356 1.00 0.00 H ATOM 2425 N GLN A 250 23.151 0.628 27.217 1.00 21.99 N ATOM 2426 CA GLN A 250 21.974 0.819 28.061 1.00 22.60 C ATOM 2427 C GLN A 250 21.987 2.194 28.695 1.00 22.25 C ATOM 2428 O GLN A 250 23.019 2.650 29.210 1.00 21.39 O ATOM 2429 CB GLN A 250 21.896 -0.282 29.134 1.00 24.88 C ATOM 2430 CG GLN A 250 21.636 -1.683 28.566 1.00 26.59 C ATOM 2431 CD GLN A 250 20.406 -1.728 27.633 1.00 30.38 C ATOM 2432 OE1 GLN A 250 20.502 -2.117 26.463 1.00 35.60 O ATOM 2433 NE2 GLN A 250 19.260 -1.293 28.138 1.00 31.05 N ATOM 2434 HE22 GLN A 250 19.215 -0.973 29.127 1.00 0.00 H ATOM 2435 HE21 GLN A 250 18.406 -1.272 27.546 1.00 0.00 H ATOM 2436 H GLN A 250 23.974 0.126 27.607 1.00 0.00 H ATOM 2437 N LEU A 251 20.831 2.846 28.643 1.00 22.53 N ATOM 2438 CA LEU A 251 20.627 4.175 29.189 1.00 23.90 C ATOM 2439 C LEU A 251 20.766 4.116 30.681 1.00 23.60 C ATOM 2440 O LEU A 251 21.265 5.047 31.295 1.00 20.29 O ATOM 2441 CB LEU A 251 19.228 4.694 28.837 1.00 26.76 C ATOM 2442 CG LEU A 251 18.878 6.115 29.279 1.00 28.83 C ATOM 2443 CD1 LEU A 251 19.781 7.128 28.574 1.00 29.81 C ATOM 2444 CD2 LEU A 251 17.396 6.411 29.019 1.00 29.57 C ATOM 2445 H LEU A 251 20.025 2.376 28.184 1.00 0.00 H ATOM 2446 N GLY A 252 20.335 3.000 31.265 1.00 23.86 N ATOM 2447 CA GLY A 252 20.350 2.856 32.704 1.00 24.23 C ATOM 2448 C GLY A 252 19.444 3.905 33.300 1.00 23.56 C ATOM 2449 O GLY A 252 18.371 4.158 32.744 1.00 23.90 O ATOM 2450 H GLY A 252 19.982 2.219 30.677 1.00 0.00 H ATOM 2451 N GLN A 253 19.911 4.574 34.349 1.00 25.19 N ATOM 2452 CA GLN A 253 19.100 5.558 35.064 1.00 28.35 C ATOM 2453 C GLN A 253 19.239 6.998 34.556 1.00 28.09 C ATOM 2454 O GLN A 253 18.644 7.928 35.137 1.00 30.72 O ATOM 2455 CB GLN A 253 19.369 5.493 36.589 1.00 31.33 C ATOM 2456 CG GLN A 253 18.853 4.228 37.287 1.00 33.36 C ATOM 2457 CD GLN A 253 17.401 3.879 36.966 1.00 38.47 C ATOM 2458 OE1 GLN A 253 16.493 4.712 37.080 1.00 43.89 O ATOM 2459 NE2 GLN A 253 17.176 2.638 36.543 1.00 41.95 N ATOM 2460 HE22 GLN A 253 17.965 1.966 36.460 1.00 0.00 H ATOM 2461 HE21 GLN A 253 16.211 2.340 36.295 1.00 0.00 H ATOM 2462 H GLN A 253 20.883 4.392 34.671 1.00 0.00 H ATOM 2463 N ARG A 254 19.987 7.187 33.471 1.00 24.01 N ATOM 2464 CA ARG A 254 20.107 8.493 32.821 1.00 21.27 C ATOM 2465 C ARG A 254 18.815 8.951 32.175 1.00 20.32 C ATOM 2466 O ARG A 254 17.962 8.152 31.858 1.00 20.51 O ATOM 2467 CB ARG A 254 21.215 8.467 31.762 1.00 19.25 C ATOM 2468 CG ARG A 254 22.599 8.263 32.356 1.00 17.86 C ATOM 2469 CD ARG A 254 23.640 8.183 31.253 1.00 17.62 C ATOM 2470 NE ARG A 254 23.609 6.904 30.558 1.00 16.40 N ATOM 2471 CZ ARG A 254 24.246 6.625 29.427 1.00 16.19 C ATOM 2472 NH1 ARG A 254 24.942 7.560 28.778 1.00 15.80 N ATOM 2473 NH2 ARG A 254 24.170 5.391 28.923 1.00 15.88 N ATOM 2474 HE ARG A 254 23.040 6.145 30.983 1.00 0.00 H ATOM 2475 HH12 ARG A 254 25.434 7.322 27.893 1.00 0.00 H ATOM 2476 HH11 ARG A 254 24.992 8.527 29.157 1.00 0.00 H ATOM 2477 HH22 ARG A 254 24.664 5.159 28.038 1.00 0.00 H ATOM 2478 HH21 ARG A 254 23.616 4.661 29.416 1.00 0.00 H ATOM 2479 H ARG A 254 20.504 6.378 33.071 1.00 0.00 H ATOM 2480 N THR A 255 18.711 10.256 31.977 1.00 20.50 N ATOM 2481 CA THR A 255 17.573 10.885 31.341 1.00 21.35 C ATOM 2482 C THR A 255 18.024 11.576 30.046 1.00 19.79 C ATOM 2483 O THR A 255 19.089 12.163 30.009 1.00 17.52 O ATOM 2484 CB THR A 255 16.908 11.839 32.329 1.00 23.26 C ATOM 2485 OG1 THR A 255 16.424 11.055 33.440 1.00 28.36 O ATOM 2486 CG2 THR A 255 15.747 12.544 31.714 1.00 24.94 C ATOM 2487 HG1 THR A 255 17.185 10.589 33.870 1.00 0.00 H ATOM 2488 H THR A 255 19.492 10.864 32.297 1.00 0.00 H ATOM 2489 N VAL A 256 17.218 11.429 28.984 1.00 18.92 N ATOM 2490 CA VAL A 256 17.429 12.114 27.725 1.00 18.83 C ATOM 2491 C VAL A 256 16.434 13.264 27.711 1.00 19.07 C ATOM 2492 O VAL A 256 15.281 13.081 28.051 1.00 21.17 O ATOM 2493 CB VAL A 256 17.182 11.193 26.505 1.00 18.88 C ATOM 2494 CG1 VAL A 256 17.442 11.937 25.196 1.00 18.68 C ATOM 2495 CG2 VAL A 256 18.029 9.937 26.594 1.00 18.98 C ATOM 2496 H VAL A 256 16.401 10.791 29.069 1.00 0.00 H ATOM 2497 N ILE A 257 16.891 14.451 27.336 1.00 18.82 N ATOM 2498 CA ILE A 257 16.012 15.621 27.175 1.00 18.51 C ATOM 2499 C ILE A 257 16.079 16.119 25.729 1.00 19.21 C ATOM 2500 O ILE A 257 16.880 15.635 24.923 1.00 19.33 O ATOM 2501 CB ILE A 257 16.349 16.738 28.188 1.00 18.03 C ATOM 2502 CG1 ILE A 257 17.804 17.158 28.106 1.00 18.05 C ATOM 2503 CG2 ILE A 257 16.021 16.256 29.592 1.00 18.52 C ATOM 2504 CD1 ILE A 257 18.220 18.183 29.125 1.00 18.76 C ATOM 2505 H ILE A 257 17.908 14.559 27.149 1.00 0.00 H ATOM 2506 N LYS A 258 15.198 17.038 25.392 1.00 20.77 N ATOM 2507 CA LYS A 258 15.138 17.617 24.038 1.00 22.72 C ATOM 2508 C LYS A 258 14.729 19.066 24.068 1.00 22.15 C ATOM 2509 O LYS A 258 14.167 19.527 25.047 1.00 20.72 O ATOM 2510 CB LYS A 258 14.150 16.843 23.145 1.00 24.29 C ATOM 2511 CG LYS A 258 12.677 16.894 23.586 1.00 25.59 C ATOM 2512 CD LYS A 258 11.852 15.852 22.837 1.00 26.61 C ATOM 2513 CE LYS A 258 10.347 16.033 23.073 1.00 28.30 C ATOM 2514 NZ LYS A 258 9.525 15.065 22.280 1.00 28.06 N ATOM 2515 HZ1 LYS A 258 9.711 15.203 21.266 1.00 0.00 H ATOM 2516 HZ2 LYS A 258 9.779 14.093 22.551 1.00 0.00 H ATOM 2517 HZ3 LYS A 258 8.516 15.228 22.474 1.00 0.00 H ATOM 2518 H LYS A 258 14.519 17.367 26.108 1.00 0.00 H ATOM 2519 N SER A 259 15.005 19.770 22.972 1.00 22.17 N ATOM 2520 CA SER A 259 14.688 21.192 22.846 1.00 22.03 C ATOM 2521 C SER A 259 13.201 21.359 22.539 1.00 23.08 C ATOM 2522 O SER A 259 12.656 20.444 21.954 1.00 23.62 O ATOM 2523 CB SER A 259 15.550 21.819 21.744 1.00 21.81 C ATOM 2524 OG SER A 259 15.405 21.102 20.523 1.00 21.27 O ATOM 2525 OXT SER A 259 12.491 22.349 22.838 1.00 25.44 O ATOM 2526 HG SER A 259 15.969 21.522 19.826 1.00 0.00 H ATOM 2527 H SER A 259 15.465 19.289 22.173 1.00 0.00 H TER 2528 SER A 259 HETATM 2529 ZN ZN A 1 32.212 9.090 16.497 1.00 15.55 ZN HETATM 2530 O HOH 2 37.774 -0.264 -2.393 1.00 9.88 O HETATM 2531 O HOH 3 40.647 10.196 17.212 1.00 50.81 O HETATM 2532 O HOH 4 41.071 1.276 15.218 1.00 57.57 O HETATM 2533 O HOH 5 18.315 29.464 13.250 1.00 51.21 O HETATM 2534 O HOH 6 27.711 17.263 34.358 1.00 41.96 O HETATM 2535 O HOH 7 38.886 21.744 27.183 1.00 34.61 O HETATM 2536 O HOH 8 31.245 11.039 34.058 1.00 34.83 O HETATM 2537 O HOH 9 18.427 11.385 1.344 1.00 32.19 O HETATM 2538 O HOH 10 17.333 -0.131 27.123 1.00 36.94 O HETATM 2539 O HOH 11 16.667 5.932 32.431 1.00 36.67 O HETATM 2540 O HOH 12 20.698 29.212 22.732 1.00 22.67 O HETATM 2541 O HOH 13 26.665 18.034 22.359 1.00 13.98 O HETATM 2542 O HOH 14 36.206 9.245 -3.787 1.00 33.60 O HETATM 2543 O HOH 15 14.666 21.523 14.067 1.00 50.71 O HETATM 2544 O HOH 16 51.139 -9.330 15.279 1.00 56.83 O HETATM 2545 O HOH 17 44.425 -6.743 16.782 1.00 32.06 O HETATM 2546 O HOH 18 44.555 21.941 5.281 1.00 37.58 O HETATM 2547 O HOH 19 26.258 -4.459 7.608 1.00 27.83 O HETATM 2548 O HOH 20 35.314 4.936 14.351 1.00 16.62 O HETATM 2549 O HOH 21 16.680 2.696 0.953 1.00 58.38 O HETATM 2550 O HOH 22 11.607 9.057 15.199 1.00 25.27 O HETATM 2551 O HOH 23 32.515 3.733 17.515 1.00 17.42 O HETATM 2552 O HOH 24 36.314 28.068 10.011 1.00 40.15 O HETATM 2553 O HOH 25 13.394 13.396 29.777 1.00 44.47 O HETATM 2554 O HOH 26 38.809 -0.046 14.051 1.00 25.94 O HETATM 2555 O HOH 27 24.332 -3.762 22.247 1.00 29.19 O HETATM 2556 O HOH 28 41.924 -0.482 11.846 1.00 25.99 O HETATM 2557 O HOH 29 36.195 23.684 -3.204 1.00 51.82 O HETATM 2558 O HOH 30 29.819 4.943 35.061 1.00 31.35 O HETATM 2559 O HOH 31 33.623 26.133 8.086 1.00 23.58 O HETATM 2560 O HOH 32 10.628 19.183 20.877 1.00 45.72 O HETATM 2561 O HOH 33 34.885 5.500 -8.356 1.00 22.59 O HETATM 2562 O HOH 34 19.277 12.023 -8.421 1.00 16.29 O HETATM 2563 O HOH 35 33.190 5.094 -5.653 1.00 39.07 O HETATM 2564 O HOH 36 37.098 23.960 43.504 1.00 60.71 O HETATM 2565 O HOH 37 36.808 18.139 -4.721 1.00 31.48 O HETATM 2566 O HOH 38 8.928 7.780 20.363 1.00 20.45 O HETATM 2567 O HOH 39 29.472 28.118 3.640 1.00 37.87 O HETATM 2568 O HOH 40 42.266 4.956 -3.559 1.00 35.76 O HETATM 2569 O HOH 41 14.883 -1.589 15.508 1.00 15.67 O HETATM 2570 O HOH 42 48.449 -10.792 21.534 1.00 36.70 O HETATM 2571 O HOH 43 20.610 14.607 12.603 1.00 11.14 O HETATM 2572 O HOH 44 40.046 -4.358 -2.282 1.00 16.27 O HETATM 2573 O HOH 45 24.772 1.314 17.492 1.00 10.25 O HETATM 2574 O HOH 46 29.773 5.450 -5.055 1.00 15.50 O HETATM 2575 O HOH 47 13.071 7.369 13.871 1.00 27.73 O HETATM 2576 O HOH 48 37.008 -0.155 0.250 1.00 15.62 O HETATM 2577 O HOH 49 35.467 -0.428 31.677 1.00 25.55 O HETATM 2578 O HOH 50 18.782 2.201 27.047 1.00 46.74 O HETATM 2579 O HOH 51 23.859 24.250 6.767 1.00 23.58 O HETATM 2580 O HOH 52 31.330 22.035 0.104 1.00 33.96 O HETATM 2581 O HOH 53 16.005 14.331 0.184 1.00 48.71 O HETATM 2582 O HOH 54 17.203 0.972 11.099 1.00 21.64 O HETATM 2583 O HOH 55 37.909 21.750 2.571 1.00 35.70 O HETATM 2584 O HOH 56 23.842 1.099 12.503 1.00 27.57 O HETATM 2585 O HOH 57 7.847 1.964 29.230 1.00 59.20 O HETATM 2586 O HOH 58 40.345 25.678 38.517 1.00 54.32 O HETATM 2587 O HOH 59 42.422 21.093 8.569 1.00 22.93 O HETATM 2588 O HOH 60 33.401 20.728 4.204 1.00 37.35 O HETATM 2589 O HOH 61 19.920 2.193 24.176 1.00 14.48 O HETATM 2590 O HOH 62 19.483 26.478 14.624 1.00 24.01 O HETATM 2591 O HOH 63 13.292 18.725 19.953 1.00 25.70 O HETATM 2592 O HOH 64 49.483 -6.532 25.985 1.00 25.77 O HETATM 2593 O HOH 65 18.377 10.624 35.308 1.00 30.33 O HETATM 2594 O HOH 66 29.608 -1.416 27.813 1.00 24.04 O HETATM 2595 O HOH 67 15.381 2.284 24.163 1.00 17.32 O HETATM 2596 O HOH 68 38.074 17.539 -2.180 1.00 27.48 O HETATM 2597 O HOH 69 17.360 19.003 13.926 1.00 16.83 O HETATM 2598 O HOH 70 31.082 -3.926 13.025 1.00 14.46 O HETATM 2599 O HOH 71 27.485 5.617 37.409 1.00 44.50 O HETATM 2600 O HOH 72 14.238 12.383 12.896 1.00 24.80 O HETATM 2601 O HOH 73 29.384 12.328 30.505 1.00 19.29 O HETATM 2602 O HOH 74 29.265 2.852 2.396 1.00 11.91 O HETATM 2603 O HOH 75 34.097 -4.618 5.276 1.00 30.39 O HETATM 2604 O HOH 76 42.013 -8.085 12.938 1.00 35.73 O HETATM 2605 O HOH 77 22.841 -0.945 -0.212 1.00 48.34 O HETATM 2606 O HOH 78 26.796 -1.369 11.260 1.00 28.59 O HETATM 2607 O HOH 79 21.723 28.022 14.777 1.00 23.04 O HETATM 2608 O HOH 80 17.108 3.992 25.601 1.00 43.97 O HETATM 2609 O HOH 81 43.018 -12.447 7.544 1.00 32.28 O HETATM 2610 O HOH 82 6.312 6.899 24.376 1.00 34.25 O HETATM 2611 O HOH 83 31.572 -1.730 23.763 1.00 29.85 O HETATM 2612 O HOH 84 21.423 16.246 -0.590 1.00 44.63 O HETATM 2613 O HOH 85 23.740 1.897 32.006 1.00 25.78 O HETATM 2614 O HOH 86 17.449 0.585 18.255 1.00 19.78 O HETATM 2615 O HOH 87 39.698 -11.795 13.684 1.00 26.07 O HETATM 2616 O HOH 88 40.548 28.950 2.099 1.00 46.02 O HETATM 2617 O HOH 89 15.385 10.543 1.784 1.00 44.60 O HETATM 2618 O HOH 90 25.294 30.142 14.238 1.00 26.46 O HETATM 2619 O HOH 91 33.695 26.737 31.883 1.00 45.13 O HETATM 2620 O HOH 92 21.817 12.148 30.620 1.00 13.66 O HETATM 2621 O HOH 93 19.491 11.801 -0.907 1.00 25.12 O HETATM 2622 O HOH 94 20.108 25.266 16.934 1.00 19.42 O HETATM 2623 O HOH 95 38.939 -7.495 27.607 1.00 50.08 O HETATM 2624 O HOH 96 24.849 2.805 5.321 1.00 18.73 O HETATM 2625 O HOH 97 16.459 25.092 20.135 1.00 26.87 O HETATM 2626 O HOH 98 38.549 24.306 24.470 1.00 35.83 O HETATM 2627 O HOH 99 20.684 9.634 -9.110 1.00 24.45 O HETATM 2628 O HOH 100 22.605 19.908 28.563 1.00 22.57 O HETATM 2629 O HOH 101 13.923 24.159 24.450 1.00 26.04 O HETATM 2630 O HOH 102 45.939 9.612 9.799 1.00 57.91 O HETATM 2631 O HOH 103 20.971 15.418 32.765 1.00 38.23 O HETATM 2632 O HOH 104 25.078 -1.182 28.195 1.00 35.22 O HETATM 2633 O HOH 105 25.818 2.424 29.506 1.00 21.94 O HETATM 2634 O HOH 106 18.790 0.935 30.115 1.00 34.15 O HETATM 2635 O HOH 107 37.576 -10.311 20.419 1.00 23.71 O HETATM 2636 O HOH 108 29.666 21.424 34.074 1.00 46.64 O HETATM 2637 O HOH 109 8.583 12.225 18.202 1.00 26.24 O HETATM 2638 O HOH 110 42.680 -9.591 6.736 1.00 29.08 O HETATM 2639 O HOH 111 46.822 -0.978 8.760 1.00 47.60 O HETATM 2640 O HOH 112 31.373 -7.198 20.417 1.00 32.65 O HETATM 2641 O HOH 113 42.911 -3.294 23.590 1.00 29.20 O HETATM 2642 O HOH 114 43.082 -11.191 21.774 1.00 44.55 O HETATM 2643 O HOH 115 31.110 -3.535 15.705 1.00 14.60 O HETATM 2644 O HOH 116 24.632 20.745 -0.286 1.00 42.33 O HETATM 2645 O HOH 117 37.667 27.994 18.664 1.00 48.30 O HETATM 2646 O HOH 118 41.562 15.640 18.464 1.00 45.71 O HETATM 2647 O HOH 119 27.559 -0.053 29.244 1.00 39.47 O HETATM 2648 O HOH 120 15.288 6.673 25.272 1.00 30.16 O HETATM 2649 O HOH 121 10.752 14.593 19.719 1.00 47.76 O HETATM 2650 O HOH 122 15.907 17.435 -3.775 1.00 31.28 O HETATM 2651 O HOH 123 11.450 23.384 30.727 1.00 62.81 O HETATM 2652 O HOH 124 19.013 6.059 5.487 1.00 20.51 O HETATM 2653 O HOH 125 13.613 19.344 5.851 1.00 36.83 O HETATM 2654 O HOH 126 23.598 4.852 34.424 1.00 38.69 O HETATM 2655 O HOH 127 26.270 30.538 11.431 1.00 41.31 O HETATM 2656 O HOH 128 18.799 18.125 5.550 1.00 42.56 O HETATM 2657 O HOH 129 49.813 11.445 6.371 1.00 42.44 O HETATM 2658 O HOH 130 25.600 13.719 36.986 1.00 38.98 O HETATM 2659 O HOH 131 48.054 -3.165 8.829 1.00 38.10 O HETATM 2660 O HOH 132 27.474 27.933 25.369 1.00 36.91 O HETATM 2661 O HOH 133 13.981 19.063 12.503 1.00 54.69 O HETATM 2662 O HOH 134 15.995 28.729 25.381 1.00 40.77 O HETATM 2663 O HOH 135 40.572 -2.049 24.813 1.00 23.38 O HETATM 2664 O HOH 136 38.261 7.887 25.664 1.00 38.71 O HETATM 2665 O HOH 137 19.889 6.474 -4.754 1.00 33.94 O HETATM 2666 O HOH 138 34.408 7.476 -4.620 1.00 50.82 O HETATM 2667 O HOH 139 35.044 12.517 33.751 1.00 47.43 O HETATM 2668 O HOH 140 18.494 28.198 7.860 1.00 49.87 O HETATM 2669 O HOH 141 32.850 18.732 1.777 1.00 28.97 O HETATM 2670 O HOH 142 46.192 -7.642 0.318 1.00 28.95 O HETATM 2671 O HOH 143 30.331 2.098 36.265 1.00 40.22 O HETATM 2672 O HOH 144 15.362 6.986 -2.143 1.00 33.38 O HETATM 2673 O HOH 145 40.952 7.223 24.169 1.00 36.65 O HETATM 2674 O HOH 146 43.764 27.315 20.786 1.00 49.22 O HETATM 2675 O HOH 147 44.542 22.186 8.697 1.00 53.54 O HETATM 2676 O HOH 148 42.417 10.699 -7.054 1.00 40.16 O HETATM 2677 O HOH 149 29.346 29.743 11.835 1.00 33.85 O HETATM 2678 O HOH 150 37.289 -14.703 11.870 1.00 35.71 O HETATM 2679 O HOH 151 24.436 18.937 4.212 1.00 34.13 O HETATM 2680 O HOH 152 36.834 -5.549 1.388 1.00 44.30 O HETATM 2681 O HOH 153 30.049 24.083 33.593 1.00 38.34 O HETATM 2682 O HOH 154 34.583 22.618 33.717 1.00 39.14 O HETATM 2683 O HOH 155 21.770 18.133 -6.323 1.00 41.70 O HETATM 2684 O HOH 156 19.417 14.927 31.036 1.00 31.29 O HETATM 2685 O HOH 157 25.376 9.219 -8.165 1.00 35.44 O HETATM 2686 O HOH 158 39.606 24.940 40.822 1.00 44.46 O HETATM 2687 O HOH 159 11.819 22.979 20.013 1.00 44.52 O HETATM 2688 O HOH 160 34.629 25.305 34.335 1.00 41.51 O HETATM 2689 O HOH 161 20.245 18.442 -4.296 1.00 64.64 O HETATM 2690 O HOH 162 23.448 -2.660 18.801 1.00 19.71 O HETATM 2691 O HOH 163 20.785 27.648 24.958 1.00 22.11 O HETATM 2692 O HOH 164 39.880 24.998 29.306 1.00 22.89 O HETATM 2693 O HOH 165 35.589 -6.019 3.492 1.00 35.64 O HETATM 2694 O HOH 166 25.569 -0.464 36.368 1.00 59.79 O HETATM 2695 O HOH 167 20.744 17.669 3.874 1.00 22.69 O HETATM 2696 O HOH 168 23.353 23.100 3.809 1.00 45.03 O HETATM 2697 O HOH 169 6.612 15.580 22.831 1.00 55.13 O HETATM 2698 O HOH 170 23.838 15.560 35.362 1.00 54.48 O HETATM 2699 O HOH 171 16.869 29.831 21.614 1.00 30.26 O HETATM 2700 O HOH 172 34.332 31.952 3.193 1.00 34.04 O HETATM 2701 O HOH 173 38.233 7.664 22.710 1.00 32.65 O HETATM 2702 O HOH 174 35.226 7.472 32.376 1.00 26.78 O HETATM 2703 O HOH 175 5.787 2.354 27.294 1.00 36.60 O HETATM 2704 O HOH 176 42.641 -3.242 15.328 1.00 56.84 O HETATM 2705 O HOH 177 15.530 27.220 18.757 1.00 63.91 O HETATM 2706 O HOH 178 36.622 -8.614 3.284 1.00 47.50 O HETATM 2707 O HOH 179 24.579 6.554 36.114 1.00 41.06 O HETATM 2708 O HOH 180 49.543 2.389 6.117 1.00 48.75 O HETATM 2709 O HOH 181 11.932 16.598 18.550 1.00 40.48 O HETATM 2710 O HOH 182 42.286 26.952 4.708 1.00 37.94 O HETATM 2711 O HOH 183 17.831 -2.180 24.960 1.00 43.55 O HETATM 2712 O HOH 184 13.482 4.403 36.582 1.00 37.97 O HETATM 2713 O HOH 185 41.782 9.284 29.908 1.00 59.99 O HETATM 2714 O HOH 186 29.153 -3.322 24.071 1.00 18.67 O HETATM 2715 O HOH 187 40.573 -5.002 10.006 1.00 26.74 O HETATM 2716 O HOH 188 23.073 20.137 -2.465 1.00 29.04 O HETATM 2717 O HOH 189 43.006 -7.427 30.110 1.00 45.94 O HETATM 2718 O HOH 190 22.432 27.309 7.072 1.00 50.71 O HETATM 2719 O HOH 191 43.519 -1.287 21.935 1.00 30.51 O HETATM 2720 O HOH 192 14.742 9.583 28.611 1.00 41.55 O HETATM 2721 O HOH 193 28.162 32.817 16.579 1.00 53.97 O HETATM 2722 O HOH 194 40.273 30.194 10.303 1.00 43.41 O HETATM 2723 O HOH 195 14.103 8.908 25.952 1.00 33.56 O HETATM 2724 O HOH 196 39.581 24.326 -3.816 1.00 32.69 O HETATM 2725 O HOH 197 8.348 19.820 15.433 1.00 39.21 O HETATM 2726 O HOH 198 31.152 16.777 36.175 1.00 38.81 O HETATM 2727 O HOH 199 14.721 16.642 19.065 1.00 40.65 O HETATM 2728 O HOH 200 40.494 25.310 33.024 1.00 51.20 O HETATM 2729 O HOH 201 22.712 3.278 2.395 1.00 37.03 O HETATM 2730 O HOH 202 7.973 22.461 17.003 1.00 45.13 O HETATM 2731 O HOH 203 26.013 19.927 30.643 1.00 34.27 O HETATM 2732 O HOH 204 35.867 30.285 15.871 1.00 28.77 O HETATM 2733 O HOH 205 42.619 8.164 27.535 1.00 46.98 O HETATM 2734 O HOH 206 42.801 9.700 15.182 1.00 39.03 O HETATM 2735 O HOH 207 49.813 10.909 3.493 1.00 12.23 O HETATM 2736 O HOH 208 7.756 12.225 28.199 1.00 57.75 O HETATM 2737 O HOH 209 50.108 -0.537 -2.894 1.00 50.09 O HETATM 2738 O HOH 210 29.531 -6.988 9.574 1.00 38.61 O HETATM 2739 O HOH 211 41.103 0.397 25.928 1.00 33.15 O HETATM 2740 O HOH 212 43.000 -0.910 28.664 1.00 39.69 O HETATM 2741 O HOH 213 37.969 9.636 15.731 1.00 46.12 O HETATM 2742 O HOH 214 27.139 35.000 18.252 1.00 32.90 O HETATM 2743 O HOH 215 24.968 2.784 2.666 1.00 20.18 O HETATM 2744 O HOH 216 21.519 -6.372 9.385 1.00 60.97 O HETATM 2745 O HOH 217 29.491 -3.819 26.588 1.00 32.29 O HETATM 2746 O HOH 218 48.362 0.253 18.075 1.00 24.56 O HETATM 2747 O HOH 219 42.624 23.887 9.149 1.00 55.80 O HETATM 2748 O HOH 220 19.905 0.753 35.092 1.00 34.23 O HETATM 2749 O HOH 221 40.384 16.562 -3.185 1.00 36.90 O HETATM 2750 O HOH 222 16.032 5.612 8.395 1.00 33.72 O HETATM 2751 O HOH 223 45.441 0.483 21.766 1.00 29.24 O HETATM 2752 O HOH 224 42.817 14.145 -6.849 1.00 49.27 O HETATM 2753 O HOH 225 47.669 17.279 -0.388 1.00 39.77 O HETATM 2754 O HOH 226 29.385 9.713 -5.572 1.00 36.47 O HETATM 2755 O HOH 227 7.164 16.577 19.718 1.00 44.52 O HETATM 2756 O HOH 228 19.927 -0.683 32.123 1.00 50.37 O HETATM 2757 O HOH 229 11.063 13.805 17.163 1.00 48.62 O HETATM 2758 O HOH 230 43.148 4.558 18.382 1.00 39.22 O HETATM 2759 O HOH 231 27.248 22.688 33.923 1.00 38.76 O HETATM 2760 O HOH 232 24.734 -3.569 26.437 1.00 39.06 O HETATM 2761 O HOH 233 23.931 -0.869 16.484 1.00 30.72 O HETATM 2762 O HOH 234 23.251 -1.441 13.878 1.00 29.87 O HETATM 2763 O HOH 235 36.609 7.483 15.257 1.00 33.98 O HETATM 2764 O HOH 236 41.781 -6.266 11.474 1.00 40.84 O HETATM 2765 O HOH 237 29.062 -5.686 12.001 1.00 34.40 O HETATM 2766 O HOH 238 21.542 15.506 30.457 1.00 27.14 O HETATM 2767 O HOH 239 17.058 0.204 -0.330 1.00 37.63 O HETATM 2768 O HOH 240 26.477 10.656 -6.464 1.00 44.47 O HETATM 2769 O HOH 241 42.527 -3.094 29.831 1.00 50.67 O HETATM 2770 O HOH 242 8.911 24.087 15.227 1.00 47.17 O HETATM 2771 O HOH 243 31.350 7.619 -6.142 1.00 35.17 O HETATM 2772 O HOH 244 42.726 2.420 24.442 1.00 49.35 O HETATM 2773 O HOH 245 7.466 21.171 19.847 1.00 50.38 O HETATM 2774 O HOH 246 32.070 33.807 5.257 1.00 49.39 O HETATM 2775 O HOH 247 29.077 -4.862 17.034 1.00 40.31 O HETATM 2776 O HOH 248 11.154 25.508 15.221 1.00 38.13 O HETATM 2777 O HOH 249 27.458 -3.028 13.136 1.00 35.22 O HETATM 2778 O HOH 250 12.697 11.807 15.547 1.00 29.44 O HETATM 2779 O HOH 251 48.738 21.658 8.592 1.00 58.27 O HETATM 2780 O HOH 252 43.467 14.837 16.765 1.00 41.73 O HETATM 2781 O HOH 253 19.010 22.224 -2.288 1.00 38.83 O HETATM 2782 S1 MOL A 254 33.103 9.666 19.236 1.00 0.06 S HETATM 2783 N2 MOL A 254 32.818 8.515 18.234 1.00 -0.26 N HETATM 2784 H6 MOL A 254 33.208 8.545 17.314 1.00 0.16 H HETATM 2785 H7 MOL A 254 32.244 7.744 18.509 1.00 0.16 H HETATM 2786 O5 MOL A 254 32.586 10.972 18.791 1.00 -0.15 O HETATM 2787 O6 MOL A 254 32.416 9.375 20.502 1.00 -0.15 O HETATM 2788 C14 MOL A 254 34.696 9.808 19.540 1.00 0.10 C HETATM 2789 C13 MOL A 254 35.359 11.041 19.439 1.00 -0.04 C HETATM 2790 C12 MOL A 254 36.717 11.158 19.730 1.00 -0.05 C HETATM 2791 C11 MOL A 254 37.441 10.042 20.139 1.00 0.00 C HETATM 2792 C10 MOL A 254 38.912 10.163 20.452 1.00 -0.00 C HETATM 2793 N1 MOL A 254 39.673 9.789 19.252 1.00 0.23 N HETATM 2794 H1 MOL A 254 40.660 9.864 19.443 1.00 0.20 H HETATM 2795 H2 MOL A 254 39.430 10.407 18.494 1.00 0.20 H HETATM 2796 H3 MOL A 254 39.452 8.839 18.996 1.00 0.20 H HETATM 2797 H4 MOL A 254 39.148 11.200 20.734 1.00 0.10 H HETATM 2798 H5 MOL A 254 39.172 9.489 21.282 1.00 0.10 H HETATM 2799 C16 MOL A 254 36.797 8.830 20.238 1.00 -0.05 C HETATM 2800 C15 MOL A 254 35.445 8.704 19.935 1.00 -0.04 C HETATM 2801 H10 MOL A 254 34.969 7.733 20.008 1.00 0.06 H HETATM 2802 H11 MOL A 254 37.354 7.957 20.558 1.00 0.06 H HETATM 2803 H8 MOL A 254 37.210 12.119 19.638 1.00 0.06 H HETATM 2804 H9 MOL A 254 34.804 11.919 19.129 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 59 58 174 CONECT 174 59 173 CONECT 263 262 1946 CONECT 942 940 941 2529 CONECT 962 960 961 2529 CONECT 1178 1177 1180 2529 CONECT 1280 1281 1288 1289 1290 CONECT 1288 1280 CONECT 1289 1280 CONECT 1290 1280 CONECT 1946 263 1945 CONECT 2529 942 962 1178 CONECT 2782 2783 2786 2787 2788 CONECT 2783 2782 2784 2785 CONECT 2784 2783 CONECT 2785 2783 CONECT 2786 2782 CONECT 2787 2782 CONECT 2788 2782 2789 2800 CONECT 2789 2788 2790 2804 CONECT 2790 2789 2791 2803 CONECT 2791 2790 2792 2799 CONECT 2792 2791 2793 2797 2798 CONECT 2793 2792 2794 2795 2796 CONECT 2794 2793 CONECT 2795 2793 CONECT 2796 2793 CONECT 2797 2792 CONECT 2798 2792 CONECT 2799 2791 2800 2802 CONECT 2800 2788 2799 2801 CONECT 2801 2800 CONECT 2802 2799 CONECT 2803 2790 CONECT 2804 2789 MASTER 0 0 0 0 0 0 0 0 2802 2 39 21 END
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Protein Sequence Similarity
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PDBbind
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RCSB PDB
PDBbind
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5jn9
RCSB PDB
PDBbind
266aa, >5JN9_1|Chains... at 100%
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PDBbind
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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
5jnc
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Carbonic anhydrase 4
Ligand Name
6LH
EC.Number
E.C.4.2.1.1
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=3.3uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Eur. Biophys. J. Vol. 47: pp. 271-290
Ligand Properties
Formula
C
7
H
1
1
N
2
O
2
S
Molecular Weight
187.239
Exact Mass
187.054
No. of atoms
23
No. of bonds
23
Polar Surface Area
96.18
LOGP Value
-0.66 (
Computed with XLOGP3
)
0.86 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 1
Canonical SMILES
[NH3+]Cc1ccc(cc1)S(=O)(=O)N
InChI String
InChI=1S/C7H10N2O2S/c8-5-6-1-3-7(4-2-6)12(9,10)11/h1-4H,5,8H2,(H2,9,10,11)/p+1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P22748
Entrez Gene ID
NCBI Entrez Gene ID:
762
ASD
Information of known allosteric effects of PDB entries
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