Browse entries in the PDBbind-CN Database
HEADER 6QFE_COMPLEX COMPND 6QFE_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 227 ILE ILE ASN GLY SER ASP CYS ASP MET HIS THR GLN PRO SEQRES 2 A 227 TRP GLN ALA ALA LEU LEU LEU ARG PRO ASN GLN LEU TYR SEQRES 3 A 227 CYS GLY ALA VAL LEU VAL HIS PRO GLN TRP LEU LEU THR SEQRES 4 A 227 ALA ALA HIS CYS ARG LYS LYS VAL PHE ARG VAL ARG LEU SEQRES 5 A 227 GLY HIS TYR SER LEU SER PRO VAL TYR GLU SER GLY GLN SEQRES 6 A 227 GLN MET PHE GLN GLY VAL LYS SER ILE PRO HIS PRO GLY SEQRES 7 A 227 TYR SER HIS PRO GLY HIS SER ASN ASP LEU MET LEU ILE SEQRES 8 A 227 LYS LEU ASN ARG ARG ILE ARG PRO THR LYS ASP VAL ARG SEQRES 9 A 227 PRO ILE ASN VAL SER SER HIS CYS PRO SER ALA GLY THR SEQRES 10 A 227 LYS CYS LEU VAL SER GLY TRP GLY THR THR LYS SER PRO SEQRES 11 A 227 GLN VAL HIS PHE PRO LYS VAL LEU GLN CYS LEU ASN ILE SEQRES 12 A 227 SER VAL LEU SER GLN LYS ARG CYS GLU ASP ALA TYR PRO SEQRES 13 A 227 ARG GLN ILE ASP ASP THR MET PHE CYS ALA GLY ASP LYS SEQRES 14 A 227 ALA GLY ARG ASP SER CYS GLN GLY ASP SER GLY GLY PRO SEQRES 15 A 227 VAL VAL CYS ASN GLY SER LEU GLN GLY LEU VAL SER TRP SEQRES 16 A 227 GLY ASP TYR PRO CYS ALA ARG PRO ASN ARG PRO GLY VAL SEQRES 17 A 227 TYR THR ASN LEU CYS LYS PHE THR LYS TRP ILE GLN GLU SEQRES 18 A 227 THR ILE GLN ALA ASN SER HET NA A 1 1 HET J A 8 53 SSBOND 1 CYS A 42 CYS A 58 SSBOND 2 CYS A 22 CYS A 157 SSBOND 3 CYS A 168 CYS A 182 SSBOND 4 CYS A 136 CYS A 201 SSBOND 5 CYS A 191 CYS A 220 SSBOND 6 CYS A 129 CYS A 232 ATOM 1 N ILE A 16 -7.214 -14.007 56.873 1.00 16.36 N ATOM 2 CA ILE A 16 -6.057 -14.038 55.982 1.00 14.06 C ATOM 3 C ILE A 16 -5.871 -12.644 55.414 1.00 19.24 C ATOM 4 O ILE A 16 -6.744 -12.148 54.696 1.00 19.09 O ATOM 5 CB ILE A 16 -6.251 -15.081 54.837 1.00 17.20 C ATOM 6 CG1 ILE A 16 -6.456 -16.549 55.363 1.00 18.03 C ATOM 7 CG2 ILE A 16 -5.111 -15.002 53.800 1.00 19.37 C ATOM 8 CD1 ILE A 16 -5.249 -17.195 56.063 1.00 18.16 C ATOM 9 HN3 ILE A 16 -8.057 -13.721 56.335 1.00 0.00 H ATOM 10 HN2 ILE A 16 -7.042 -13.325 57.639 1.00 0.00 H ATOM 11 HN1 ILE A 16 -7.364 -14.953 57.277 1.00 0.00 H ATOM 12 N ILE A 17 -4.717 -12.047 55.686 1.00 16.19 N ATOM 13 CA ILE A 17 -4.367 -10.706 55.199 1.00 16.43 C ATOM 14 C ILE A 17 -3.729 -10.807 53.807 1.00 21.52 C ATOM 15 O ILE A 17 -2.719 -11.489 53.612 1.00 20.26 O ATOM 16 CB ILE A 17 -3.401 -9.951 56.164 1.00 20.09 C ATOM 17 CG1 ILE A 17 -3.807 -10.107 57.666 1.00 19.97 C ATOM 18 CG2 ILE A 17 -3.262 -8.452 55.749 1.00 20.70 C ATOM 19 CD1 ILE A 17 -5.168 -9.524 58.049 1.00 22.49 C ATOM 20 H ILE A 17 -4.025 -12.555 56.274 1.00 0.00 H ATOM 21 N ASN A 18 -4.327 -10.077 52.857 1.00 20.21 N ATOM 22 CA ASN A 18 -3.853 -9.941 51.478 1.00 20.29 C ATOM 23 C ASN A 18 -3.706 -11.298 50.736 1.00 24.37 C ATOM 24 O ASN A 18 -2.778 -11.527 49.942 1.00 24.51 O ATOM 25 CB ASN A 18 -2.589 -9.083 51.399 1.00 24.43 C ATOM 26 CG ASN A 18 -2.377 -8.571 50.000 1.00 60.03 C ATOM 27 OD1 ASN A 18 -3.319 -8.076 49.361 1.00 54.40 O ATOM 28 ND2 ASN A 18 -1.150 -8.743 49.501 1.00 59.73 N ATOM 29 HD22 ASN A 18 -0.404 -9.165 50.090 1.00 0.00 H ATOM 30 HD21 ASN A 18 -0.941 -8.455 48.524 1.00 0.00 H ATOM 31 H ASN A 18 -5.195 -9.567 53.119 1.00 0.00 H ATOM 32 N GLY A 19 -4.675 -12.165 50.994 1.00 21.01 N ATOM 33 CA GLY A 19 -4.820 -13.416 50.274 1.00 21.02 C ATOM 34 C GLY A 19 -5.838 -13.151 49.172 1.00 25.10 C ATOM 35 O GLY A 19 -6.113 -11.980 48.844 1.00 23.50 O ATOM 36 H GLY A 19 -5.360 -11.939 51.744 1.00 0.00 H ATOM 37 N SER A 20 -6.399 -14.218 48.596 1.00 20.49 N ATOM 38 CA SER A 20 -7.430 -14.101 47.562 1.00 20.11 C ATOM 39 C SER A 20 -8.533 -15.115 47.794 1.00 25.03 C ATOM 40 O SER A 20 -8.333 -16.069 48.543 1.00 24.42 O ATOM 41 CB SER A 20 -6.831 -14.268 46.166 1.00 22.73 C ATOM 42 OG SER A 20 -6.136 -15.495 46.032 1.00 29.52 O ATOM 43 HG SER A 20 -6.760 -16.246 46.194 1.00 0.00 H ATOM 44 H SER A 20 -6.092 -15.166 48.893 1.00 0.00 H ATOM 45 N ASP A 21 -9.708 -14.927 47.140 1.00 22.64 N ATOM 46 CA ASP A 21 -10.792 -15.889 47.264 1.00 22.77 C ATOM 47 C ASP A 21 -10.235 -17.218 46.753 1.00 27.49 C ATOM 48 O ASP A 21 -9.636 -17.247 45.677 1.00 28.41 O ATOM 49 CB ASP A 21 -11.981 -15.493 46.353 1.00 25.42 C ATOM 50 CG ASP A 21 -12.776 -14.265 46.776 1.00 31.44 C ATOM 51 OD1 ASP A 21 -12.381 -13.605 47.776 1.00 28.77 O ATOM 52 OD2 ASP A 21 -13.849 -14.023 46.172 1.00 32.50 O ATOM 53 H ASP A 21 -9.835 -14.085 46.543 1.00 0.00 H ATOM 54 N CYS A 22 -10.377 -18.304 47.531 1.00 24.38 N ATOM 55 CA CYS A 22 -9.918 -19.618 47.089 1.00 24.03 C ATOM 56 C CYS A 22 -10.741 -20.005 45.873 1.00 32.84 C ATOM 57 O CYS A 22 -11.865 -19.523 45.699 1.00 32.70 O ATOM 58 CB CYS A 22 -10.089 -20.655 48.198 1.00 23.55 C ATOM 59 SG CYS A 22 -9.147 -20.296 49.702 1.00 26.71 S ATOM 60 H CYS A 22 -10.822 -18.207 48.466 1.00 0.00 H ATOM 61 N ASP A 23 -10.236 -20.889 45.045 1.00 33.36 N ATOM 62 CA ASP A 23 -11.126 -21.300 43.950 1.00 36.19 C ATOM 63 C ASP A 23 -12.177 -22.258 44.580 1.00 43.23 C ATOM 64 O ASP A 23 -11.853 -22.945 45.553 1.00 41.50 O ATOM 65 CB ASP A 23 -10.324 -21.940 42.811 1.00 38.14 C ATOM 66 CG ASP A 23 -9.342 -20.986 42.150 1.00 48.94 C ATOM 67 OD1 ASP A 23 -9.693 -19.795 41.977 1.00 48.70 O ATOM 68 OD2 ASP A 23 -8.227 -21.429 41.804 1.00 54.07 O ATOM 69 H ASP A 23 -9.275 -21.271 45.156 1.00 0.00 H ATOM 70 N MET A 24 -13.451 -22.214 44.137 1.00 42.78 N ATOM 71 CA MET A 24 -14.451 -23.117 44.723 1.00 43.32 C ATOM 72 C MET A 24 -14.034 -24.582 44.465 1.00 42.38 C ATOM 73 O MET A 24 -13.386 -24.859 43.452 1.00 40.73 O ATOM 74 CB MET A 24 -15.856 -22.846 44.174 1.00 46.97 C ATOM 75 CG MET A 24 -16.924 -23.038 45.234 1.00 52.26 C ATOM 76 SD MET A 24 -18.519 -22.354 44.763 1.00 58.35 S ATOM 77 CE MET A 24 -19.580 -23.622 45.412 1.00 54.76 C ATOM 78 H MET A 24 -13.723 -21.547 43.387 1.00 0.00 H ATOM 79 N HIS A 25 -14.338 -25.493 45.412 1.00 37.81 N ATOM 80 CA HIS A 25 -14.002 -26.926 45.343 1.00 37.30 C ATOM 81 C HIS A 25 -12.472 -27.240 45.382 1.00 39.72 C ATOM 82 O HIS A 25 -12.109 -28.380 45.106 1.00 41.14 O ATOM 83 CB HIS A 25 -14.680 -27.651 44.121 1.00 38.15 C ATOM 84 CG HIS A 25 -16.040 -27.140 43.767 1.00 41.52 C ATOM 85 ND1 HIS A 25 -16.256 -26.329 42.666 1.00 43.30 N ATOM 86 CD2 HIS A 25 -17.213 -27.335 44.403 1.00 42.66 C ATOM 87 CE1 HIS A 25 -17.557 -26.074 42.668 1.00 42.56 C ATOM 88 NE2 HIS A 25 -18.165 -26.637 43.707 1.00 42.83 N ATOM 89 H HIS A 25 -14.848 -25.159 46.254 1.00 0.00 H ATOM 90 N THR A 26 -11.585 -26.291 45.762 1.00 33.33 N ATOM 91 CA THR A 26 -10.135 -26.565 45.756 1.00 32.36 C ATOM 92 C THR A 26 -9.497 -26.890 47.104 1.00 34.33 C ATOM 93 O THR A 26 -8.363 -27.405 47.132 1.00 34.51 O ATOM 94 CB THR A 26 -9.348 -25.431 45.111 1.00 40.57 C ATOM 95 OG1 THR A 26 -9.599 -24.221 45.825 1.00 37.34 O ATOM 96 CG2 THR A 26 -9.626 -25.304 43.632 1.00 42.10 C ATOM 97 HG1 THR A 26 -10.567 -24.015 45.793 1.00 0.00 H ATOM 98 H THR A 26 -11.930 -25.357 46.062 1.00 0.00 H ATOM 99 N GLN A 27 -10.202 -26.605 48.217 1.00 27.86 N ATOM 100 CA GLN A 27 -9.669 -26.882 49.563 1.00 25.18 C ATOM 101 C GLN A 27 -10.680 -27.806 50.257 1.00 27.11 C ATOM 102 O GLN A 27 -11.320 -27.385 51.238 1.00 25.79 O ATOM 103 CB GLN A 27 -9.453 -25.550 50.335 1.00 25.86 C ATOM 104 CG GLN A 27 -8.764 -24.414 49.528 1.00 24.60 C ATOM 105 CD GLN A 27 -7.358 -24.724 49.065 1.00 38.27 C ATOM 106 OE1 GLN A 27 -6.562 -25.338 49.770 1.00 38.47 O ATOM 107 NE2 GLN A 27 -7.013 -24.303 47.863 1.00 29.90 N ATOM 108 HE22 GLN A 27 -7.698 -23.784 47.277 1.00 0.00 H ATOM 109 HE21 GLN A 27 -6.056 -24.490 47.501 1.00 0.00 H ATOM 110 H GLN A 27 -11.146 -26.179 48.124 1.00 0.00 H ATOM 111 N PRO A 28 -10.863 -29.066 49.757 1.00 23.01 N ATOM 112 CA PRO A 28 -11.909 -29.943 50.320 1.00 22.62 C ATOM 113 C PRO A 28 -11.678 -30.489 51.721 1.00 24.10 C ATOM 114 O PRO A 28 -12.573 -31.123 52.277 1.00 23.82 O ATOM 115 CB PRO A 28 -12.004 -31.079 49.290 1.00 24.54 C ATOM 116 CG PRO A 28 -10.649 -31.166 48.726 1.00 28.09 C ATOM 117 CD PRO A 28 -10.192 -29.733 48.616 1.00 24.31 C ATOM 118 N TRP A 29 -10.495 -30.248 52.274 1.00 22.17 N ATOM 119 CA TRP A 29 -10.126 -30.648 53.623 1.00 21.66 C ATOM 120 C TRP A 29 -10.406 -29.523 54.619 1.00 23.08 C ATOM 121 O TRP A 29 -10.293 -29.758 55.812 1.00 20.82 O ATOM 122 CB TRP A 29 -8.648 -30.996 53.680 1.00 20.96 C ATOM 123 CG TRP A 29 -7.789 -30.062 52.880 1.00 22.83 C ATOM 124 CD1 TRP A 29 -7.326 -28.836 53.261 1.00 25.88 C ATOM 125 CD2 TRP A 29 -7.323 -30.271 51.543 1.00 23.25 C ATOM 126 NE1 TRP A 29 -6.634 -28.252 52.227 1.00 25.82 N ATOM 127 CE2 TRP A 29 -6.606 -29.112 51.165 1.00 27.05 C ATOM 128 CE3 TRP A 29 -7.471 -31.311 50.612 1.00 25.11 C ATOM 129 CZ2 TRP A 29 -5.984 -28.991 49.914 1.00 26.85 C ATOM 130 CZ3 TRP A 29 -6.867 -31.180 49.367 1.00 27.30 C ATOM 131 CH2 TRP A 29 -6.152 -30.022 49.023 1.00 27.64 C ATOM 132 HE1 TRP A 29 -6.201 -27.307 52.249 1.00 0.00 H ATOM 133 H TRP A 29 -9.787 -29.741 51.706 1.00 0.00 H ATOM 134 N GLN A 30 -10.730 -28.299 54.131 1.00 19.93 N ATOM 135 CA GLN A 30 -10.987 -27.166 55.021 1.00 19.66 C ATOM 136 C GLN A 30 -12.261 -27.365 55.820 1.00 23.79 C ATOM 137 O GLN A 30 -13.307 -27.646 55.236 1.00 23.86 O ATOM 138 CB GLN A 30 -11.084 -25.843 54.216 1.00 21.13 C ATOM 139 CG GLN A 30 -11.403 -24.601 55.095 1.00 19.97 C ATOM 140 CD GLN A 30 -10.257 -24.130 55.950 1.00 27.47 C ATOM 141 OE1 GLN A 30 -10.336 -24.012 57.188 1.00 27.06 O ATOM 142 NE2 GLN A 30 -9.199 -23.770 55.307 1.00 19.09 N ATOM 143 HE22 GLN A 30 -9.157 -23.878 54.274 1.00 0.00 H ATOM 144 HE21 GLN A 30 -8.388 -23.371 55.822 1.00 0.00 H ATOM 145 H GLN A 30 -10.797 -28.163 53.102 1.00 0.00 H ATOM 146 N ALA A 31 -12.188 -27.182 57.139 1.00 18.52 N ATOM 147 CA ALA A 31 -13.382 -27.290 57.974 1.00 18.16 C ATOM 148 C ALA A 31 -13.567 -25.979 58.745 1.00 20.89 C ATOM 149 O ALA A 31 -12.633 -25.174 58.865 1.00 19.08 O ATOM 150 CB ALA A 31 -13.232 -28.451 58.959 1.00 19.29 C ATOM 151 H ALA A 31 -11.272 -26.960 57.578 1.00 0.00 H ATOM 152 N ALA A 32 -14.783 -25.781 59.275 1.00 20.15 N ATOM 153 CA ALA A 32 -15.112 -24.642 60.120 1.00 19.32 C ATOM 154 C ALA A 32 -15.694 -25.197 61.417 1.00 22.88 C ATOM 155 O ALA A 32 -16.516 -26.119 61.376 1.00 22.42 O ATOM 156 CB ALA A 32 -16.142 -23.731 59.424 1.00 19.64 C ATOM 157 H ALA A 32 -15.529 -26.477 59.072 1.00 0.00 H ATOM 158 N LEU A 33 -15.196 -24.712 62.565 1.00 18.63 N ATOM 159 CA LEU A 33 -15.743 -25.081 63.875 1.00 18.01 C ATOM 160 C LEU A 33 -16.662 -23.940 64.220 1.00 21.58 C ATOM 161 O LEU A 33 -16.231 -22.789 64.272 1.00 21.59 O ATOM 162 CB LEU A 33 -14.667 -25.276 64.959 1.00 17.83 C ATOM 163 CG LEU A 33 -13.520 -26.262 64.646 1.00 21.68 C ATOM 164 CD1 LEU A 33 -12.485 -26.261 65.754 1.00 23.15 C ATOM 165 CD2 LEU A 33 -14.034 -27.650 64.325 1.00 23.21 C ATOM 166 H LEU A 33 -14.394 -24.051 62.524 1.00 0.00 H ATOM 167 N LEU A 34 -17.937 -24.265 64.407 1.00 20.15 N ATOM 168 CA LEU A 34 -18.975 -23.281 64.647 1.00 19.47 C ATOM 169 C LEU A 34 -19.516 -23.342 66.026 1.00 22.95 C ATOM 170 O LEU A 34 -19.667 -24.427 66.600 1.00 21.97 O ATOM 171 CB LEU A 34 -20.134 -23.466 63.633 1.00 19.31 C ATOM 172 CG LEU A 34 -19.812 -23.504 62.132 1.00 23.39 C ATOM 173 CD1 LEU A 34 -21.032 -23.960 61.346 1.00 24.11 C ATOM 174 CD2 LEU A 34 -19.270 -22.145 61.603 1.00 24.53 C ATOM 175 H LEU A 34 -18.202 -25.270 64.380 1.00 0.00 H ATOM 176 N LEU A 35 -19.879 -22.159 66.543 1.00 22.08 N ATOM 177 CA LEU A 35 -20.576 -22.013 67.816 1.00 23.41 C ATOM 178 C LEU A 35 -22.045 -21.678 67.484 1.00 28.86 C ATOM 179 O LEU A 35 -22.338 -21.215 66.382 1.00 28.07 O ATOM 180 CB LEU A 35 -19.923 -20.947 68.708 1.00 23.62 C ATOM 181 CG LEU A 35 -18.473 -21.245 69.192 1.00 29.13 C ATOM 182 CD1 LEU A 35 -17.907 -20.066 69.976 1.00 30.58 C ATOM 183 CD2 LEU A 35 -18.395 -22.507 70.057 1.00 29.13 C ATOM 184 H LEU A 35 -19.651 -21.298 66.006 1.00 0.00 H ATOM 185 N ARG A 36 -22.962 -21.966 68.406 1.00 29.89 N ATOM 186 CA ARG A 36 -24.408 -21.789 68.217 1.00 31.28 C ATOM 187 C ARG A 36 -24.839 -20.371 67.773 1.00 35.86 C ATOM 188 O ARG A 36 -24.453 -19.402 68.420 1.00 34.99 O ATOM 189 CB ARG A 36 -25.153 -22.216 69.495 1.00 33.83 C ATOM 190 CG ARG A 36 -26.599 -22.612 69.273 1.00 48.21 C ATOM 191 CD ARG A 36 -27.294 -22.872 70.595 1.00 61.19 C ATOM 192 NE ARG A 36 -28.749 -22.859 70.445 1.00 76.55 N ATOM 193 CZ ARG A 36 -29.484 -23.935 70.179 1.00 95.22 C ATOM 194 NH1 ARG A 36 -28.910 -25.124 70.041 1.00 81.93 N ATOM 195 NH2 ARG A 36 -30.801 -23.829 70.052 1.00 84.67 N ATOM 196 HE ARG A 36 -29.241 -21.949 70.553 1.00 0.00 H ATOM 197 HH12 ARG A 36 -29.491 -25.961 69.833 1.00 0.00 H ATOM 198 HH11 ARG A 36 -27.879 -25.219 70.141 1.00 0.00 H ATOM 199 HH22 ARG A 36 -31.373 -24.672 69.844 1.00 0.00 H ATOM 200 HH21 ARG A 36 -31.261 -22.903 70.161 1.00 0.00 H ATOM 201 H ARG A 36 -22.633 -22.340 69.319 1.00 0.00 H ATOM 202 N PRO A 37 -25.632 -20.210 66.683 1.00 34.02 N ATOM 203 CA PRO A 37 -26.147 -21.238 65.752 1.00 34.17 C ATOM 204 C PRO A 37 -25.168 -21.628 64.638 1.00 34.06 C ATOM 205 O PRO A 37 -25.138 -22.798 64.249 1.00 32.68 O ATOM 206 CB PRO A 37 -27.433 -20.602 65.210 1.00 36.55 C ATOM 207 CG PRO A 37 -27.214 -19.095 65.319 1.00 41.23 C ATOM 208 CD PRO A 37 -26.077 -18.856 66.296 1.00 36.64 C ATOM 209 N ASN A 38 -24.398 -20.648 64.091 1.00 29.89 N ATOM 210 CA ASN A 38 -23.409 -20.882 63.022 1.00 28.78 C ATOM 211 C ASN A 38 -22.293 -19.813 63.028 1.00 31.12 C ATOM 212 O ASN A 38 -21.928 -19.292 61.977 1.00 30.55 O ATOM 213 CB ASN A 38 -24.086 -21.029 61.625 1.00 29.18 C ATOM 214 CG ASN A 38 -25.125 -19.980 61.310 1.00 47.21 C ATOM 215 OD1 ASN A 38 -24.831 -18.811 61.042 1.00 43.66 O ATOM 216 ND2 ASN A 38 -26.365 -20.381 61.344 1.00 35.82 N ATOM 217 HD22 ASN A 38 -26.585 -21.371 61.573 1.00 0.00 H ATOM 218 HD21 ASN A 38 -27.134 -19.710 61.143 1.00 0.00 H ATOM 219 H ASN A 38 -24.514 -19.678 64.447 1.00 0.00 H ATOM 220 N GLN A 39 -21.750 -19.507 64.232 1.00 26.84 N ATOM 221 CA GLN A 39 -20.718 -18.486 64.451 1.00 26.16 C ATOM 222 C GLN A 39 -19.344 -19.099 64.249 1.00 26.00 C ATOM 223 O GLN A 39 -19.011 -20.066 64.928 1.00 24.32 O ATOM 224 CB GLN A 39 -20.843 -17.888 65.864 1.00 28.48 C ATOM 225 CG GLN A 39 -19.910 -16.700 66.141 1.00 57.21 C ATOM 226 CD GLN A 39 -20.036 -16.082 67.528 1.00 82.64 C ATOM 227 OE1 GLN A 39 -20.796 -16.536 68.400 1.00 77.41 O ATOM 228 NE2 GLN A 39 -19.277 -15.013 67.759 1.00 73.59 N ATOM 229 HE22 GLN A 39 -18.648 -14.651 67.014 1.00 0.00 H ATOM 230 HE21 GLN A 39 -19.313 -14.540 68.685 1.00 0.00 H ATOM 231 H GLN A 39 -22.090 -20.034 65.062 1.00 0.00 H ATOM 232 N LEU A 40 -18.579 -18.577 63.288 1.00 22.38 N ATOM 233 CA LEU A 40 -17.253 -19.093 63.028 1.00 23.15 C ATOM 234 C LEU A 40 -16.392 -18.915 64.280 1.00 25.86 C ATOM 235 O LEU A 40 -16.357 -17.832 64.871 1.00 25.66 O ATOM 236 CB LEU A 40 -16.594 -18.423 61.825 1.00 24.28 C ATOM 237 CG LEU A 40 -15.101 -18.804 61.650 1.00 29.87 C ATOM 238 CD1 LEU A 40 -14.942 -20.134 60.942 1.00 29.40 C ATOM 239 CD2 LEU A 40 -14.277 -17.663 61.039 1.00 34.13 C ATOM 240 H LEU A 40 -18.942 -17.787 62.717 1.00 0.00 H ATOM 241 N TYR A 41 -15.824 -20.019 64.758 1.00 20.90 N ATOM 242 CA TYR A 41 -14.966 -19.955 65.930 1.00 19.74 C ATOM 243 C TYR A 41 -13.500 -20.129 65.530 1.00 22.60 C ATOM 244 O TYR A 41 -12.648 -19.297 65.884 1.00 21.66 O ATOM 245 CB TYR A 41 -15.432 -20.993 66.976 1.00 20.04 C ATOM 246 CG TYR A 41 -14.500 -21.166 68.154 1.00 21.54 C ATOM 247 CD1 TYR A 41 -14.157 -20.087 68.966 1.00 23.56 C ATOM 248 CD2 TYR A 41 -13.982 -22.418 68.475 1.00 20.62 C ATOM 249 CE1 TYR A 41 -13.299 -20.242 70.053 1.00 23.30 C ATOM 250 CE2 TYR A 41 -13.152 -22.594 69.581 1.00 21.35 C ATOM 251 CZ TYR A 41 -12.809 -21.499 70.366 1.00 26.76 C ATOM 252 OH TYR A 41 -11.992 -21.634 71.460 1.00 22.81 O ATOM 253 HH TYR A 41 -11.865 -20.750 71.886 1.00 0.00 H ATOM 254 H TYR A 41 -15.995 -20.932 64.291 1.00 0.00 H ATOM 255 N CYS A 42 -13.201 -21.230 64.824 1.00 19.19 N ATOM 256 CA CYS A 42 -11.861 -21.570 64.393 1.00 18.48 C ATOM 257 C CYS A 42 -11.942 -22.353 63.084 1.00 20.36 C ATOM 258 O CYS A 42 -12.984 -22.925 62.742 1.00 19.53 O ATOM 259 CB CYS A 42 -11.177 -22.420 65.466 1.00 20.17 C ATOM 260 SG CYS A 42 -10.458 -21.473 66.828 1.00 23.64 S ATOM 261 H CYS A 42 -13.976 -21.876 64.572 1.00 0.00 H ATOM 262 N GLY A 43 -10.820 -22.396 62.399 1.00 17.41 N ATOM 263 CA GLY A 43 -10.611 -23.265 61.250 1.00 17.79 C ATOM 264 C GLY A 43 -10.221 -24.630 61.800 1.00 19.56 C ATOM 265 O GLY A 43 -9.910 -24.779 62.988 1.00 16.36 O ATOM 266 H GLY A 43 -10.040 -21.775 62.694 1.00 0.00 H ATOM 267 N ALA A 44 -10.282 -25.647 60.948 1.00 18.31 N ATOM 268 CA ALA A 44 -9.913 -27.015 61.247 1.00 18.21 C ATOM 269 C ALA A 44 -9.661 -27.682 59.904 1.00 20.90 C ATOM 270 O ALA A 44 -9.924 -27.080 58.835 1.00 18.06 O ATOM 271 CB ALA A 44 -11.010 -27.750 62.027 1.00 19.33 C ATOM 272 H ALA A 44 -10.623 -25.444 59.987 1.00 0.00 H ATOM 273 N VAL A 45 -9.071 -28.883 59.961 1.00 16.81 N ATOM 274 CA VAL A 45 -8.670 -29.598 58.759 1.00 17.07 C ATOM 275 C VAL A 45 -9.063 -31.068 58.883 1.00 20.36 C ATOM 276 O VAL A 45 -8.674 -31.733 59.843 1.00 20.37 O ATOM 277 CB VAL A 45 -7.136 -29.518 58.505 1.00 20.08 C ATOM 278 CG1 VAL A 45 -6.817 -29.858 57.062 1.00 18.70 C ATOM 279 CG2 VAL A 45 -6.510 -28.184 58.913 1.00 21.22 C ATOM 280 H VAL A 45 -8.895 -29.316 60.890 1.00 0.00 H ATOM 281 N LEU A 46 -9.752 -31.583 57.862 1.00 19.18 N ATOM 282 CA LEU A 46 -10.110 -32.998 57.750 1.00 18.12 C ATOM 283 C LEU A 46 -8.851 -33.848 57.399 1.00 23.05 C ATOM 284 O LEU A 46 -8.237 -33.675 56.337 1.00 21.82 O ATOM 285 CB LEU A 46 -11.234 -33.138 56.700 1.00 18.29 C ATOM 286 CG LEU A 46 -11.919 -34.517 56.588 1.00 20.96 C ATOM 287 CD1 LEU A 46 -12.858 -34.753 57.769 1.00 20.79 C ATOM 288 CD2 LEU A 46 -12.692 -34.623 55.293 1.00 24.87 C ATOM 289 H LEU A 46 -10.052 -30.941 57.101 1.00 0.00 H ATOM 290 N VAL A 47 -8.423 -34.711 58.330 1.00 19.71 N ATOM 291 CA VAL A 47 -7.209 -35.522 58.124 1.00 18.34 C ATOM 292 C VAL A 47 -7.479 -37.036 57.995 1.00 24.60 C ATOM 293 O VAL A 47 -6.562 -37.817 57.757 1.00 25.10 O ATOM 294 CB VAL A 47 -6.137 -35.239 59.209 1.00 20.40 C ATOM 295 CG1 VAL A 47 -5.668 -33.788 59.146 1.00 20.34 C ATOM 296 CG2 VAL A 47 -6.641 -35.615 60.608 1.00 19.88 C ATOM 297 H VAL A 47 -8.958 -34.811 59.216 1.00 0.00 H ATOM 298 N HIS A 48 -8.724 -37.433 58.207 1.00 23.99 N ATOM 299 CA HIS A 48 -9.162 -38.825 58.193 1.00 24.67 C ATOM 300 C HIS A 48 -10.652 -38.781 57.901 1.00 28.08 C ATOM 301 O HIS A 48 -11.290 -37.771 58.236 1.00 28.23 O ATOM 302 CB HIS A 48 -8.883 -39.437 59.602 1.00 25.62 C ATOM 303 CG HIS A 48 -9.291 -40.878 59.789 1.00 28.51 C ATOM 304 ND1 HIS A 48 -10.584 -41.222 60.149 1.00 30.22 N ATOM 305 CD2 HIS A 48 -8.557 -42.014 59.674 1.00 30.73 C ATOM 306 CE1 HIS A 48 -10.607 -42.549 60.231 1.00 29.91 C ATOM 307 NE2 HIS A 48 -9.416 -43.072 59.948 1.00 30.28 N ATOM 308 H HIS A 48 -9.439 -36.702 58.397 1.00 0.00 H ATOM 309 N PRO A 49 -11.286 -39.849 57.359 1.00 24.73 N ATOM 310 CA PRO A 49 -12.744 -39.790 57.156 1.00 23.39 C ATOM 311 C PRO A 49 -13.578 -39.457 58.413 1.00 24.98 C ATOM 312 O PRO A 49 -14.690 -38.974 58.275 1.00 24.19 O ATOM 313 CB PRO A 49 -13.074 -41.177 56.595 1.00 25.61 C ATOM 314 CG PRO A 49 -11.806 -41.612 55.931 1.00 29.88 C ATOM 315 CD PRO A 49 -10.733 -41.127 56.847 1.00 26.10 C ATOM 316 N GLN A 50 -13.022 -39.631 59.622 1.00 23.37 N ATOM 317 CA GLN A 50 -13.761 -39.320 60.856 1.00 23.37 C ATOM 318 C GLN A 50 -13.010 -38.378 61.830 1.00 25.52 C ATOM 319 O GLN A 50 -13.451 -38.238 62.973 1.00 23.16 O ATOM 320 CB GLN A 50 -14.200 -40.624 61.574 1.00 24.49 C ATOM 321 CG GLN A 50 -15.539 -40.451 62.290 1.00 28.11 C ATOM 322 CD GLN A 50 -16.062 -41.683 62.982 1.00 33.01 C ATOM 323 OE1 GLN A 50 -16.966 -41.603 63.816 1.00 32.42 O ATOM 324 NE2 GLN A 50 -15.527 -42.837 62.655 1.00 29.74 N ATOM 325 HE22 GLN A 50 -14.765 -42.875 61.948 1.00 0.00 H ATOM 326 HE21 GLN A 50 -15.865 -43.713 63.103 1.00 0.00 H ATOM 327 H GLN A 50 -12.049 -39.993 59.688 1.00 0.00 H ATOM 328 N TRP A 51 -11.894 -37.732 61.389 1.00 22.33 N ATOM 329 CA TRP A 51 -11.124 -36.871 62.296 1.00 21.48 C ATOM 330 C TRP A 51 -10.654 -35.572 61.698 1.00 23.03 C ATOM 331 O TRP A 51 -10.253 -35.527 60.526 1.00 19.62 O ATOM 332 CB TRP A 51 -9.892 -37.597 62.879 1.00 20.65 C ATOM 333 CG TRP A 51 -10.197 -38.773 63.763 1.00 22.27 C ATOM 334 CD1 TRP A 51 -10.487 -40.045 63.362 1.00 25.34 C ATOM 335 CD2 TRP A 51 -10.156 -38.807 65.195 1.00 22.05 C ATOM 336 NE1 TRP A 51 -10.647 -40.864 64.457 1.00 23.82 N ATOM 337 CE2 TRP A 51 -10.423 -40.133 65.594 1.00 25.57 C ATOM 338 CE3 TRP A 51 -9.870 -37.845 66.184 1.00 23.41 C ATOM 339 CZ2 TRP A 51 -10.468 -40.517 66.936 1.00 24.57 C ATOM 340 CZ3 TRP A 51 -9.930 -38.221 67.520 1.00 24.47 C ATOM 341 CH2 TRP A 51 -10.228 -39.540 67.882 1.00 25.38 C ATOM 342 HE1 TRP A 51 -10.897 -41.873 64.426 1.00 0.00 H ATOM 343 H TRP A 51 -11.585 -37.850 60.403 1.00 0.00 H ATOM 344 N LEU A 52 -10.635 -34.528 62.557 1.00 19.38 N ATOM 345 CA LEU A 52 -10.079 -33.232 62.225 1.00 19.02 C ATOM 346 C LEU A 52 -8.880 -32.966 63.111 1.00 20.39 C ATOM 347 O LEU A 52 -8.772 -33.505 64.221 1.00 21.10 O ATOM 348 CB LEU A 52 -11.065 -32.082 62.496 1.00 19.05 C ATOM 349 CG LEU A 52 -12.502 -32.172 62.024 1.00 22.85 C ATOM 350 CD1 LEU A 52 -13.305 -31.025 62.623 1.00 21.77 C ATOM 351 CD2 LEU A 52 -12.589 -32.195 60.492 1.00 24.43 C ATOM 352 H LEU A 52 -11.041 -34.662 63.505 1.00 0.00 H ATOM 353 N LEU A 53 -8.033 -32.054 62.645 1.00 16.63 N ATOM 354 CA LEU A 53 -7.002 -31.422 63.432 1.00 15.68 C ATOM 355 C LEU A 53 -7.434 -29.955 63.542 1.00 20.88 C ATOM 356 O LEU A 53 -8.011 -29.396 62.601 1.00 19.81 O ATOM 357 CB LEU A 53 -5.626 -31.466 62.758 1.00 15.24 C ATOM 358 CG LEU A 53 -4.814 -32.752 62.945 1.00 20.13 C ATOM 359 CD1 LEU A 53 -3.545 -32.650 62.159 1.00 19.73 C ATOM 360 CD2 LEU A 53 -4.449 -32.989 64.445 1.00 21.04 C ATOM 361 H LEU A 53 -8.119 -31.777 61.646 1.00 0.00 H ATOM 362 N THR A 54 -7.181 -29.345 64.693 1.00 17.13 N ATOM 363 CA THR A 54 -7.382 -27.929 64.907 1.00 15.95 C ATOM 364 C THR A 54 -6.320 -27.491 65.902 1.00 18.03 C ATOM 365 O THR A 54 -5.579 -28.343 66.403 1.00 18.10 O ATOM 366 CB THR A 54 -8.835 -27.580 65.327 1.00 19.86 C ATOM 367 OG1 THR A 54 -8.954 -26.156 65.285 1.00 20.29 O ATOM 368 CG2 THR A 54 -9.160 -28.048 66.747 1.00 17.80 C ATOM 369 HG1 THR A 54 -8.770 -25.838 64.366 1.00 0.00 H ATOM 370 H THR A 54 -6.819 -29.916 65.483 1.00 0.00 H ATOM 371 N ALA A 55 -6.244 -26.192 66.208 1.00 15.04 N ATOM 372 CA ALA A 55 -5.260 -25.748 67.195 1.00 14.84 C ATOM 373 C ALA A 55 -5.821 -26.130 68.567 1.00 19.23 C ATOM 374 O ALA A 55 -7.028 -26.081 68.775 1.00 19.43 O ATOM 375 CB ALA A 55 -5.043 -24.238 67.107 1.00 15.50 C ATOM 376 H ALA A 55 -6.877 -25.505 65.750 1.00 0.00 H ATOM 377 N ALA A 56 -4.954 -26.536 69.487 1.00 17.01 N ATOM 378 CA ALA A 56 -5.403 -26.873 70.840 1.00 17.52 C ATOM 379 C ALA A 56 -5.939 -25.619 71.572 1.00 18.45 C ATOM 380 O ALA A 56 -6.711 -25.764 72.536 1.00 16.99 O ATOM 381 CB ALA A 56 -4.260 -27.506 71.609 1.00 19.19 C ATOM 382 H ALA A 56 -3.946 -26.616 69.245 1.00 0.00 H ATOM 383 N HIS A 57 -5.530 -24.387 71.117 1.00 17.11 N ATOM 384 CA HIS A 57 -6.034 -23.157 71.752 1.00 16.56 C ATOM 385 C HIS A 57 -7.504 -22.883 71.382 1.00 19.95 C ATOM 386 O HIS A 57 -8.115 -21.975 71.978 1.00 18.67 O ATOM 387 CB HIS A 57 -5.129 -21.931 71.484 1.00 16.65 C ATOM 388 CG HIS A 57 -5.240 -21.340 70.108 1.00 18.19 C ATOM 389 ND1 HIS A 57 -4.290 -21.589 69.150 1.00 19.47 N ATOM 390 CD2 HIS A 57 -6.151 -20.474 69.605 1.00 19.04 C ATOM 391 CE1 HIS A 57 -4.677 -20.922 68.069 1.00 18.35 C ATOM 392 NE2 HIS A 57 -5.790 -20.235 68.299 1.00 18.53 N ATOM 393 H HIS A 57 -4.863 -24.324 70.322 1.00 0.00 H ATOM 394 N CYS A 58 -8.057 -23.630 70.383 1.00 16.41 N ATOM 395 CA CYS A 58 -9.472 -23.517 69.984 1.00 16.74 C ATOM 396 C CYS A 58 -10.249 -24.453 70.943 1.00 22.22 C ATOM 397 O CYS A 58 -10.798 -25.467 70.530 1.00 22.67 O ATOM 398 CB CYS A 58 -9.660 -23.906 68.524 1.00 17.90 C ATOM 399 SG CYS A 58 -8.944 -22.714 67.365 1.00 22.81 S ATOM 400 H CYS A 58 -7.453 -24.310 69.880 1.00 0.00 H ATOM 401 N ARG A 59 -10.250 -24.093 72.222 1.00 19.79 N ATOM 402 CA ARG A 59 -10.725 -24.882 73.369 1.00 20.82 C ATOM 403 C ARG A 59 -12.220 -24.974 73.563 1.00 24.79 C ATOM 404 O ARG A 59 -12.683 -25.979 74.094 1.00 24.39 O ATOM 405 CB ARG A 59 -10.116 -24.366 74.688 1.00 24.07 C ATOM 406 CG ARG A 59 -8.620 -24.311 74.737 1.00 33.08 C ATOM 407 CD ARG A 59 -8.151 -24.825 76.066 1.00 35.40 C ATOM 408 NE ARG A 59 -8.371 -23.875 77.155 1.00 30.02 N ATOM 409 CZ ARG A 59 -8.119 -24.153 78.429 1.00 42.20 C ATOM 410 NH1 ARG A 59 -7.681 -25.363 78.780 1.00 27.36 N ATOM 411 NH2 ARG A 59 -8.331 -23.241 79.367 1.00 29.76 N ATOM 412 HE ARG A 59 -8.744 -22.933 76.920 1.00 0.00 H ATOM 413 HH12 ARG A 59 -7.485 -25.576 79.779 1.00 0.00 H ATOM 414 HH11 ARG A 59 -7.535 -26.094 78.055 1.00 0.00 H ATOM 415 HH22 ARG A 59 -8.132 -23.464 80.363 1.00 0.00 H ATOM 416 HH21 ARG A 59 -8.696 -22.303 79.107 1.00 0.00 H ATOM 417 H ARG A 59 -9.873 -23.148 72.436 1.00 0.00 H ATOM 418 N LYS A 60 -12.961 -23.916 73.235 1.00 22.82 N ATOM 419 CA LYS A 60 -14.413 -23.896 73.441 1.00 22.28 C ATOM 420 C LYS A 60 -15.111 -25.104 72.825 1.00 25.89 C ATOM 421 O LYS A 60 -14.721 -25.597 71.760 1.00 23.31 O ATOM 422 CB LYS A 60 -15.055 -22.590 72.952 1.00 25.37 C ATOM 423 CG LYS A 60 -14.718 -21.373 73.811 1.00 35.11 C ATOM 424 CD LYS A 60 -15.628 -20.163 73.513 1.00 45.39 C ATOM 425 CE LYS A 60 -16.835 -20.092 74.395 1.00 49.50 C ATOM 426 NZ LYS A 60 -18.004 -20.714 73.741 1.00 54.19 N ATOM 427 HZ1 LYS A 60 -18.209 -20.214 72.852 1.00 0.00 H ATOM 428 HZ2 LYS A 60 -17.796 -21.713 73.539 1.00 0.00 H ATOM 429 HZ3 LYS A 60 -18.827 -20.652 74.373 1.00 0.00 H ATOM 430 H LYS A 60 -12.497 -23.082 72.822 1.00 0.00 H ATOM 431 N LYS A 61 -16.128 -25.589 73.528 1.00 24.84 N ATOM 432 CA LYS A 61 -16.918 -26.730 73.070 1.00 25.58 C ATOM 433 C LYS A 61 -17.570 -26.364 71.723 1.00 29.54 C ATOM 434 O LYS A 61 -18.259 -25.347 71.630 1.00 28.46 O ATOM 435 CB LYS A 61 -17.955 -27.115 74.160 1.00 28.64 C ATOM 436 CG LYS A 61 -19.208 -27.892 73.732 1.00 48.26 C ATOM 437 CD LYS A 61 -18.959 -29.361 73.364 1.00 55.60 C ATOM 438 CE LYS A 61 -20.243 -30.137 73.174 1.00 63.73 C ATOM 439 NZ LYS A 61 -21.051 -29.652 72.015 1.00 71.45 N ATOM 440 HZ1 LYS A 61 -21.303 -28.654 72.163 1.00 0.00 H ATOM 441 HZ2 LYS A 61 -20.493 -29.744 71.142 1.00 0.00 H ATOM 442 HZ3 LYS A 61 -21.918 -30.221 71.936 1.00 0.00 H ATOM 443 H LYS A 61 -16.370 -25.142 74.435 1.00 0.00 H ATOM 444 N VAL A 62 -17.260 -27.142 70.678 1.00 27.01 N ATOM 445 CA VAL A 62 -17.784 -26.919 69.328 1.00 26.38 C ATOM 446 C VAL A 62 -19.269 -27.328 69.259 1.00 27.89 C ATOM 447 O VAL A 62 -19.616 -28.415 69.731 1.00 26.50 O ATOM 448 CB VAL A 62 -16.938 -27.639 68.223 1.00 31.01 C ATOM 449 CG1 VAL A 62 -17.458 -27.309 66.829 1.00 30.73 C ATOM 450 CG2 VAL A 62 -15.467 -27.273 68.314 1.00 31.90 C ATOM 451 H VAL A 62 -16.616 -27.944 70.832 1.00 0.00 H ATOM 452 N PHE A 63 -20.123 -26.474 68.646 1.00 24.24 N ATOM 453 CA PHE A 63 -21.541 -26.790 68.428 1.00 24.59 C ATOM 454 C PHE A 63 -21.666 -27.707 67.187 1.00 26.27 C ATOM 455 O PHE A 63 -22.190 -28.822 67.277 1.00 24.08 O ATOM 456 CB PHE A 63 -22.388 -25.502 68.281 1.00 26.97 C ATOM 457 CG PHE A 63 -23.832 -25.719 67.870 1.00 29.04 C ATOM 458 CD1 PHE A 63 -24.700 -26.455 68.672 1.00 32.88 C ATOM 459 CD2 PHE A 63 -24.331 -25.160 66.697 1.00 32.12 C ATOM 460 CE1 PHE A 63 -26.035 -26.648 68.295 1.00 34.66 C ATOM 461 CE2 PHE A 63 -25.672 -25.351 66.322 1.00 34.89 C ATOM 462 CZ PHE A 63 -26.512 -26.092 67.124 1.00 33.98 C ATOM 463 H PHE A 63 -19.760 -25.557 68.316 1.00 0.00 H ATOM 464 N ARG A 64 -21.160 -27.238 66.034 1.00 22.55 N ATOM 465 CA ARG A 64 -21.178 -28.000 64.797 1.00 22.01 C ATOM 466 C ARG A 64 -19.882 -27.851 64.021 1.00 24.22 C ATOM 467 O ARG A 64 -19.259 -26.786 64.031 1.00 24.35 O ATOM 468 CB ARG A 64 -22.350 -27.559 63.901 1.00 22.28 C ATOM 469 CG ARG A 64 -23.747 -27.990 64.362 1.00 30.18 C ATOM 470 CD ARG A 64 -23.958 -29.501 64.395 1.00 27.97 C ATOM 471 NE ARG A 64 -25.328 -29.855 64.779 1.00 29.49 N ATOM 472 CZ ARG A 64 -25.769 -29.928 66.030 1.00 38.34 C ATOM 473 NH1 ARG A 64 -24.954 -29.673 67.047 1.00 25.75 N ATOM 474 NH2 ARG A 64 -27.028 -30.259 66.275 1.00 30.18 N ATOM 475 HE ARG A 64 -26.004 -30.064 64.017 1.00 0.00 H ATOM 476 HH12 ARG A 64 -25.307 -29.732 68.024 1.00 0.00 H ATOM 477 HH11 ARG A 64 -23.963 -29.414 66.867 1.00 0.00 H ATOM 478 HH22 ARG A 64 -27.370 -30.315 67.256 1.00 0.00 H ATOM 479 HH21 ARG A 64 -27.675 -30.463 65.487 1.00 0.00 H ATOM 480 H ARG A 64 -20.737 -26.288 66.027 1.00 0.00 H ATOM 481 N VAL A 65 -19.497 -28.927 63.334 1.00 21.36 N ATOM 482 CA VAL A 65 -18.379 -28.956 62.393 1.00 19.98 C ATOM 483 C VAL A 65 -19.035 -28.760 61.025 1.00 24.68 C ATOM 484 O VAL A 65 -19.986 -29.484 60.697 1.00 24.91 O ATOM 485 CB VAL A 65 -17.597 -30.312 62.445 1.00 21.54 C ATOM 486 CG1 VAL A 65 -16.665 -30.459 61.242 1.00 21.24 C ATOM 487 CG2 VAL A 65 -16.808 -30.462 63.750 1.00 21.64 C ATOM 488 H VAL A 65 -20.030 -29.808 63.478 1.00 0.00 H ATOM 489 N ARG A 66 -18.534 -27.808 60.219 1.00 21.19 N ATOM 490 CA ARG A 66 -19.051 -27.612 58.865 1.00 21.04 C ATOM 491 C ARG A 66 -17.961 -27.905 57.838 1.00 24.35 C ATOM 492 O ARG A 66 -16.897 -27.279 57.860 1.00 20.93 O ATOM 493 CB ARG A 66 -19.625 -26.193 58.687 1.00 21.35 C ATOM 494 CG ARG A 66 -20.342 -25.990 57.350 1.00 24.97 C ATOM 495 CD ARG A 66 -21.204 -24.748 57.379 1.00 28.59 C ATOM 496 NE ARG A 66 -20.400 -23.545 57.241 1.00 27.93 N ATOM 497 CZ ARG A 66 -20.799 -22.343 57.614 1.00 40.48 C ATOM 498 NH1 ARG A 66 -20.009 -21.300 57.447 1.00 30.26 N ATOM 499 NH2 ARG A 66 -21.993 -22.176 58.179 1.00 28.88 N ATOM 500 HE ARG A 66 -19.452 -23.637 56.823 1.00 0.00 H ATOM 501 HH12 ARG A 66 -20.327 -20.355 57.742 1.00 0.00 H ATOM 502 HH11 ARG A 66 -19.069 -21.423 57.020 1.00 0.00 H ATOM 503 HH22 ARG A 66 -22.302 -21.227 58.471 1.00 0.00 H ATOM 504 HH21 ARG A 66 -22.617 -22.995 58.329 1.00 0.00 H ATOM 505 H ARG A 66 -17.765 -27.200 60.565 1.00 0.00 H ATOM 506 N LEU A 67 -18.242 -28.860 56.930 1.00 22.89 N ATOM 507 CA LEU A 67 -17.339 -29.241 55.839 1.00 23.20 C ATOM 508 C LEU A 67 -17.990 -28.981 54.477 1.00 26.60 C ATOM 509 O LEU A 67 -19.211 -28.810 54.410 1.00 25.71 O ATOM 510 CB LEU A 67 -16.989 -30.733 55.978 1.00 23.22 C ATOM 511 CG LEU A 67 -15.928 -31.074 57.030 1.00 28.29 C ATOM 512 CD1 LEU A 67 -15.931 -32.539 57.302 1.00 27.62 C ATOM 513 CD2 LEU A 67 -14.531 -30.657 56.553 1.00 31.75 C ATOM 514 H LEU A 67 -19.153 -29.356 57.007 1.00 0.00 H ATOM 515 N GLY A 69 -17.168 -28.950 53.422 1.00 23.90 N ATOM 516 CA GLY A 69 -17.575 -28.772 52.026 1.00 24.09 C ATOM 517 C GLY A 69 -18.357 -27.508 51.748 1.00 28.87 C ATOM 518 O GLY A 69 -19.260 -27.494 50.902 1.00 28.71 O ATOM 519 H GLY A 69 -16.151 -29.062 53.609 1.00 0.00 H ATOM 520 N HIS A 70 -17.975 -26.433 52.431 1.00 24.31 N ATOM 521 CA HIS A 70 -18.666 -25.155 52.381 1.00 23.25 C ATOM 522 C HIS A 70 -17.654 -24.035 52.195 1.00 27.60 C ATOM 523 O HIS A 70 -16.657 -23.944 52.923 1.00 26.48 O ATOM 524 CB HIS A 70 -19.430 -24.986 53.695 1.00 24.27 C ATOM 525 CG HIS A 70 -20.470 -23.914 53.692 1.00 28.08 C ATOM 526 ND1 HIS A 70 -20.175 -22.626 54.088 1.00 29.86 N ATOM 527 CD2 HIS A 70 -21.795 -23.994 53.409 1.00 29.89 C ATOM 528 CE1 HIS A 70 -21.311 -21.951 54.004 1.00 29.89 C ATOM 529 NE2 HIS A 70 -22.319 -22.735 53.621 1.00 30.05 N ATOM 530 H HIS A 70 -17.133 -26.511 53.036 1.00 0.00 H ATOM 531 N TYR A 71 -17.925 -23.194 51.206 1.00 21.54 N ATOM 532 CA TYR A 71 -17.074 -22.092 50.776 1.00 21.62 C ATOM 533 C TYR A 71 -17.331 -20.782 51.474 1.00 25.42 C ATOM 534 O TYR A 71 -16.371 -20.089 51.832 1.00 23.60 O ATOM 535 CB TYR A 71 -17.248 -21.938 49.260 1.00 22.87 C ATOM 536 CG TYR A 71 -16.380 -20.906 48.573 1.00 25.22 C ATOM 537 CD1 TYR A 71 -14.992 -20.992 48.630 1.00 26.98 C ATOM 538 CD2 TYR A 71 -16.943 -19.937 47.745 1.00 25.46 C ATOM 539 CE1 TYR A 71 -14.188 -20.085 47.945 1.00 28.76 C ATOM 540 CE2 TYR A 71 -16.150 -19.053 47.024 1.00 25.90 C ATOM 541 CZ TYR A 71 -14.775 -19.120 47.141 1.00 35.49 C ATOM 542 OH TYR A 71 -14.002 -18.231 46.446 1.00 33.64 O ATOM 543 HH TYR A 71 -13.046 -18.408 46.635 1.00 0.00 H ATOM 544 H TYR A 71 -18.820 -23.333 50.694 1.00 0.00 H ATOM 545 N SER A 72 -18.618 -20.387 51.618 1.00 23.52 N ATOM 546 CA SER A 72 -18.950 -19.095 52.223 1.00 23.34 C ATOM 547 C SER A 72 -18.812 -19.088 53.730 1.00 26.49 C ATOM 548 O SER A 72 -18.890 -20.134 54.376 1.00 26.42 O ATOM 549 CB SER A 72 -20.368 -18.659 51.846 1.00 28.52 C ATOM 550 OG SER A 72 -20.645 -18.754 50.457 1.00 39.60 O ATOM 551 HG SER A 72 -20.538 -19.693 50.164 1.00 0.00 H ATOM 552 H SER A 72 -19.384 -21.011 51.294 1.00 0.00 H ATOM 553 N LEU A 73 -18.596 -17.906 54.294 1.00 24.78 N ATOM 554 CA LEU A 73 -18.540 -17.738 55.740 1.00 25.35 C ATOM 555 C LEU A 73 -19.976 -17.817 56.316 1.00 29.66 C ATOM 556 O LEU A 73 -20.197 -18.433 57.365 1.00 28.75 O ATOM 557 CB LEU A 73 -17.854 -16.402 56.101 1.00 25.90 C ATOM 558 CG LEU A 73 -17.705 -16.073 57.609 1.00 31.27 C ATOM 559 CD1 LEU A 73 -17.153 -17.249 58.412 1.00 31.80 C ATOM 560 CD2 LEU A 73 -16.856 -14.851 57.809 1.00 32.51 C ATOM 561 H LEU A 73 -18.463 -17.074 53.685 1.00 0.00 H ATOM 562 N SER A 74 -20.951 -17.228 55.599 1.00 27.16 N ATOM 563 CA SER A 74 -22.358 -17.247 56.023 1.00 27.80 C ATOM 564 C SER A 74 -23.009 -18.664 55.934 1.00 31.44 C ATOM 565 O SER A 74 -22.478 -19.522 55.232 1.00 28.59 O ATOM 566 CB SER A 74 -23.151 -16.216 55.226 1.00 30.83 C ATOM 567 OG SER A 74 -23.451 -16.707 53.935 1.00 37.47 O ATOM 568 HG SER A 74 -23.965 -16.024 53.435 1.00 0.00 H ATOM 569 H SER A 74 -20.700 -16.743 54.714 1.00 0.00 H ATOM 570 N PRO A 74A -24.172 -18.907 56.597 1.00 31.25 N ATOM 571 CA PRO A 74A -24.806 -20.237 56.524 1.00 31.40 C ATOM 572 C PRO A 74A -25.531 -20.585 55.211 1.00 36.49 C ATOM 573 O PRO A 74A -26.198 -21.626 55.170 1.00 36.05 O ATOM 574 CB PRO A 74A -25.790 -20.212 57.693 1.00 33.23 C ATOM 575 CG PRO A 74A -26.188 -18.779 57.813 1.00 38.05 C ATOM 576 CD PRO A 74A -24.925 -18.010 57.505 1.00 33.70 C ATOM 577 N VAL A 75 -25.407 -19.749 54.156 1.00 32.92 N ATOM 578 CA VAL A 75 -26.003 -19.970 52.823 1.00 33.08 C ATOM 579 C VAL A 75 -25.816 -21.445 52.390 1.00 37.44 C ATOM 580 O VAL A 75 -24.727 -22.011 52.581 1.00 37.44 O ATOM 581 CB VAL A 75 -25.449 -18.947 51.780 1.00 37.24 C ATOM 582 CG1 VAL A 75 -23.931 -19.063 51.608 1.00 36.97 C ATOM 583 CG2 VAL A 75 -26.156 -19.068 50.427 1.00 37.34 C ATOM 584 H VAL A 75 -24.848 -18.883 54.294 1.00 0.00 H ATOM 585 N TYR A 76 -26.879 -22.089 51.876 1.00 32.41 N ATOM 586 CA TYR A 76 -26.824 -23.494 51.473 1.00 31.49 C ATOM 587 C TYR A 76 -25.914 -23.718 50.289 1.00 34.65 C ATOM 588 O TYR A 76 -25.927 -22.947 49.315 1.00 34.77 O ATOM 589 CB TYR A 76 -28.234 -24.073 51.180 1.00 32.03 C ATOM 590 CG TYR A 76 -28.215 -25.558 50.865 1.00 31.61 C ATOM 591 CD1 TYR A 76 -28.148 -26.506 51.880 1.00 32.85 C ATOM 592 CD2 TYR A 76 -28.188 -26.011 49.548 1.00 32.25 C ATOM 593 CE1 TYR A 76 -28.083 -27.869 51.595 1.00 32.06 C ATOM 594 CE2 TYR A 76 -28.119 -27.369 49.251 1.00 33.01 C ATOM 595 CZ TYR A 76 -28.075 -28.296 50.277 1.00 38.67 C ATOM 596 OH TYR A 76 -28.009 -29.638 49.987 1.00 39.46 O ATOM 597 HH TYR A 76 -27.985 -30.156 50.830 1.00 0.00 H ATOM 598 H TYR A 76 -27.772 -21.569 51.761 1.00 0.00 H ATOM 599 N GLU A 77 -25.115 -24.789 50.378 1.00 29.46 N ATOM 600 CA GLU A 77 -24.230 -25.205 49.300 1.00 29.31 C ATOM 601 C GLU A 77 -24.430 -26.712 49.223 1.00 35.28 C ATOM 602 O GLU A 77 -24.418 -27.381 50.265 1.00 34.38 O ATOM 603 CB GLU A 77 -22.758 -24.830 49.597 1.00 30.71 C ATOM 604 CG GLU A 77 -22.523 -23.342 49.793 1.00 35.33 C ATOM 605 CD GLU A 77 -21.094 -22.914 50.046 1.00 36.69 C ATOM 606 OE1 GLU A 77 -20.177 -23.684 49.689 1.00 30.67 O ATOM 607 OE2 GLU A 77 -20.890 -21.775 50.519 1.00 30.56 O ATOM 608 H GLU A 77 -25.127 -25.348 51.255 1.00 0.00 H ATOM 609 N SER A 78 -24.652 -27.250 48.006 1.00 32.66 N ATOM 610 CA SER A 78 -24.913 -28.681 47.808 1.00 32.81 C ATOM 611 C SER A 78 -23.828 -29.620 48.377 1.00 35.91 C ATOM 612 O SER A 78 -24.151 -30.741 48.782 1.00 35.88 O ATOM 613 CB SER A 78 -25.169 -28.982 46.334 1.00 36.00 C ATOM 614 OG SER A 78 -24.067 -28.606 45.524 1.00 43.38 O ATOM 615 HG SER A 78 -24.268 -28.815 44.577 1.00 0.00 H ATOM 616 H SER A 78 -24.638 -26.626 47.174 1.00 0.00 H ATOM 617 N GLY A 79 -22.574 -29.145 48.430 1.00 31.72 N ATOM 618 CA GLY A 79 -21.456 -29.939 48.930 1.00 30.77 C ATOM 619 C GLY A 79 -21.264 -29.959 50.435 1.00 30.57 C ATOM 620 O GLY A 79 -20.414 -30.707 50.921 1.00 28.01 O ATOM 621 H GLY A 79 -22.392 -28.175 48.103 1.00 0.00 H ATOM 622 N GLN A 80 -22.040 -29.159 51.190 1.00 27.68 N ATOM 623 CA GLN A 80 -21.888 -29.063 52.646 1.00 26.43 C ATOM 624 C GLN A 80 -22.264 -30.340 53.396 1.00 29.40 C ATOM 625 O GLN A 80 -23.198 -31.062 53.016 1.00 28.23 O ATOM 626 CB GLN A 80 -22.640 -27.845 53.209 1.00 27.69 C ATOM 627 CG GLN A 80 -24.184 -28.015 53.320 1.00 32.79 C ATOM 628 CD GLN A 80 -24.899 -26.783 53.787 1.00 38.03 C ATOM 629 OE1 GLN A 80 -24.733 -25.677 53.242 1.00 34.37 O ATOM 630 NE2 GLN A 80 -25.773 -26.980 54.756 1.00 32.62 N ATOM 631 HE22 GLN A 80 -25.875 -27.924 55.180 1.00 0.00 H ATOM 632 HE21 GLN A 80 -26.360 -26.191 55.095 1.00 0.00 H ATOM 633 H GLN A 80 -22.774 -28.588 50.724 1.00 0.00 H ATOM 634 N GLN A 81 -21.506 -30.630 54.452 1.00 24.34 N ATOM 635 CA GLN A 81 -21.732 -31.779 55.332 1.00 24.06 C ATOM 636 C GLN A 81 -21.528 -31.304 56.775 1.00 29.49 C ATOM 637 O GLN A 81 -20.474 -30.731 57.095 1.00 28.92 O ATOM 638 CB GLN A 81 -20.804 -32.959 54.991 1.00 25.04 C ATOM 639 CG GLN A 81 -21.177 -33.722 53.715 1.00 26.89 C ATOM 640 CD GLN A 81 -20.222 -34.857 53.428 1.00 35.04 C ATOM 641 OE1 GLN A 81 -19.931 -35.726 54.274 1.00 30.33 O ATOM 642 NE2 GLN A 81 -19.759 -34.901 52.194 1.00 29.19 N ATOM 643 HE22 GLN A 81 -20.022 -34.160 51.513 1.00 0.00 H ATOM 644 HE21 GLN A 81 -19.131 -35.677 51.901 1.00 0.00 H ATOM 645 H GLN A 81 -20.705 -30.002 54.665 1.00 0.00 H ATOM 646 N MET A 82 -22.550 -31.488 57.624 1.00 25.56 N ATOM 647 CA MET A 82 -22.553 -31.076 59.037 1.00 25.98 C ATOM 648 C MET A 82 -22.284 -32.252 59.960 1.00 29.70 C ATOM 649 O MET A 82 -22.830 -33.331 59.755 1.00 29.51 O ATOM 650 CB MET A 82 -23.905 -30.447 59.433 1.00 28.94 C ATOM 651 CG MET A 82 -24.355 -29.288 58.559 1.00 32.97 C ATOM 652 SD MET A 82 -23.156 -27.936 58.500 1.00 38.11 S ATOM 653 CE MET A 82 -23.087 -27.450 60.247 1.00 34.73 C ATOM 654 H MET A 82 -23.403 -31.956 57.257 1.00 0.00 H ATOM 655 N PHE A 83 -21.510 -32.021 61.027 1.00 24.93 N ATOM 656 CA PHE A 83 -21.169 -33.035 62.016 1.00 24.12 C ATOM 657 C PHE A 83 -21.129 -32.438 63.404 1.00 27.73 C ATOM 658 O PHE A 83 -21.099 -31.208 63.577 1.00 25.05 O ATOM 659 CB PHE A 83 -19.771 -33.633 61.720 1.00 25.66 C ATOM 660 CG PHE A 83 -19.596 -34.180 60.327 1.00 26.56 C ATOM 661 CD1 PHE A 83 -19.153 -33.365 59.296 1.00 28.35 C ATOM 662 CD2 PHE A 83 -19.907 -35.507 60.036 1.00 28.23 C ATOM 663 CE1 PHE A 83 -19.052 -33.857 57.995 1.00 29.39 C ATOM 664 CE2 PHE A 83 -19.793 -36.004 58.729 1.00 30.31 C ATOM 665 CZ PHE A 83 -19.360 -35.182 57.723 1.00 28.16 C ATOM 666 H PHE A 83 -21.130 -31.062 61.158 1.00 0.00 H ATOM 667 N GLN A 84 -21.033 -33.322 64.391 1.00 26.64 N ATOM 668 CA GLN A 84 -20.808 -32.977 65.778 1.00 26.22 C ATOM 669 C GLN A 84 -19.480 -33.617 66.175 1.00 29.99 C ATOM 670 O GLN A 84 -19.120 -34.694 65.666 1.00 29.30 O ATOM 671 CB GLN A 84 -21.932 -33.534 66.661 1.00 28.21 C ATOM 672 CG GLN A 84 -23.191 -32.697 66.611 1.00 36.39 C ATOM 673 CD GLN A 84 -24.205 -33.124 67.641 1.00 52.21 C ATOM 674 OE1 GLN A 84 -24.048 -32.898 68.850 1.00 48.36 O ATOM 675 NE2 GLN A 84 -25.247 -33.803 67.189 1.00 49.65 N ATOM 676 HE22 GLN A 84 -25.352 -33.977 66.169 1.00 0.00 H ATOM 677 HE21 GLN A 84 -25.961 -34.163 67.854 1.00 0.00 H ATOM 678 H GLN A 84 -21.126 -34.330 64.151 1.00 0.00 H ATOM 679 N GLY A 85 -18.757 -32.952 67.076 1.00 24.98 N ATOM 680 CA GLY A 85 -17.529 -33.503 67.629 1.00 25.06 C ATOM 681 C GLY A 85 -17.935 -34.396 68.787 1.00 30.31 C ATOM 682 O GLY A 85 -18.788 -34.002 69.575 1.00 30.93 O ATOM 683 H GLY A 85 -19.079 -32.015 67.392 1.00 0.00 H ATOM 684 N VAL A 86 -17.365 -35.600 68.898 1.00 26.21 N ATOM 685 CA VAL A 86 -17.700 -36.540 69.987 1.00 25.89 C ATOM 686 C VAL A 86 -16.505 -36.747 70.918 1.00 29.80 C ATOM 687 O VAL A 86 -16.659 -37.196 72.063 1.00 29.52 O ATOM 688 CB VAL A 86 -18.296 -37.862 69.459 1.00 30.41 C ATOM 689 CG1 VAL A 86 -19.600 -37.599 68.717 1.00 30.43 C ATOM 690 CG2 VAL A 86 -17.298 -38.624 68.578 1.00 30.50 C ATOM 691 H VAL A 86 -16.658 -35.886 68.190 1.00 0.00 H ATOM 692 N LYS A 87 -15.303 -36.453 70.403 1.00 24.13 N ATOM 693 CA LYS A 87 -14.042 -36.489 71.152 1.00 23.26 C ATOM 694 C LYS A 87 -13.218 -35.304 70.692 1.00 26.06 C ATOM 695 O LYS A 87 -13.257 -34.972 69.502 1.00 24.52 O ATOM 696 CB LYS A 87 -13.253 -37.790 70.911 1.00 25.02 C ATOM 697 CG LYS A 87 -13.893 -39.014 71.566 1.00 20.98 C ATOM 698 CD LYS A 87 -12.952 -40.161 71.626 1.00 26.90 C ATOM 699 CE LYS A 87 -13.311 -41.095 72.756 1.00 39.64 C ATOM 700 NZ LYS A 87 -14.452 -41.969 72.431 1.00 47.65 N ATOM 701 HZ1 LYS A 87 -15.287 -41.384 72.223 1.00 0.00 H ATOM 702 HZ2 LYS A 87 -14.217 -42.549 71.600 1.00 0.00 H ATOM 703 HZ3 LYS A 87 -14.655 -42.588 73.241 1.00 0.00 H ATOM 704 H LYS A 87 -15.261 -36.180 69.400 1.00 0.00 H ATOM 705 N SER A 88 -12.496 -34.666 71.631 1.00 23.18 N ATOM 706 CA SER A 88 -11.576 -33.561 71.340 1.00 23.33 C ATOM 707 C SER A 88 -10.385 -33.805 72.210 1.00 25.04 C ATOM 708 O SER A 88 -10.461 -33.741 73.447 1.00 23.97 O ATOM 709 CB SER A 88 -12.212 -32.204 71.617 1.00 25.64 C ATOM 710 OG SER A 88 -13.324 -32.008 70.763 1.00 31.48 O ATOM 711 HG SER A 88 -13.730 -31.125 70.950 1.00 0.00 H ATOM 712 H SER A 88 -12.596 -34.974 72.619 1.00 0.00 H ATOM 713 N ILE A 89 -9.323 -34.238 71.574 1.00 19.31 N ATOM 714 CA ILE A 89 -8.134 -34.661 72.282 1.00 19.25 C ATOM 715 C ILE A 89 -6.986 -33.716 71.980 1.00 22.75 C ATOM 716 O ILE A 89 -6.371 -33.837 70.900 1.00 20.62 O ATOM 717 CB ILE A 89 -7.791 -36.145 71.954 1.00 22.26 C ATOM 718 CG1 ILE A 89 -9.010 -37.063 72.176 1.00 22.56 C ATOM 719 CG2 ILE A 89 -6.561 -36.606 72.737 1.00 21.76 C ATOM 720 CD1 ILE A 89 -8.975 -38.402 71.446 1.00 21.40 C ATOM 721 H ILE A 89 -9.336 -34.278 70.535 1.00 0.00 H ATOM 722 N PRO A 90 -6.667 -32.779 72.918 1.00 20.80 N ATOM 723 CA PRO A 90 -5.504 -31.912 72.686 1.00 20.67 C ATOM 724 C PRO A 90 -4.238 -32.742 72.868 1.00 25.51 C ATOM 725 O PRO A 90 -4.277 -33.743 73.585 1.00 24.34 O ATOM 726 CB PRO A 90 -5.619 -30.829 73.773 1.00 23.06 C ATOM 727 CG PRO A 90 -6.433 -31.455 74.874 1.00 26.34 C ATOM 728 CD PRO A 90 -7.283 -32.541 74.250 1.00 21.77 C ATOM 729 N HIS A 91 -3.132 -32.351 72.228 1.00 22.13 N ATOM 730 CA HIS A 91 -1.867 -33.056 72.418 1.00 22.42 C ATOM 731 C HIS A 91 -1.529 -33.018 73.921 1.00 24.74 C ATOM 732 O HIS A 91 -1.654 -31.963 74.550 1.00 22.95 O ATOM 733 CB HIS A 91 -0.730 -32.419 71.602 1.00 22.09 C ATOM 734 CG HIS A 91 0.533 -33.219 71.648 1.00 23.87 C ATOM 735 ND1 HIS A 91 1.487 -33.013 72.634 1.00 24.86 N ATOM 736 CD2 HIS A 91 0.957 -34.216 70.825 1.00 23.91 C ATOM 737 CE1 HIS A 91 2.459 -33.882 72.373 1.00 23.12 C ATOM 738 NE2 HIS A 91 2.182 -34.624 71.300 1.00 23.24 N ATOM 739 H HIS A 91 -3.173 -31.534 71.586 1.00 0.00 H ATOM 740 N PRO A 92 -1.119 -34.145 74.551 1.00 22.58 N ATOM 741 CA PRO A 92 -0.857 -34.099 76.003 1.00 22.16 C ATOM 742 C PRO A 92 0.247 -33.123 76.439 1.00 25.81 C ATOM 743 O PRO A 92 0.305 -32.775 77.618 1.00 24.80 O ATOM 744 CB PRO A 92 -0.526 -35.557 76.365 1.00 23.81 C ATOM 745 CG PRO A 92 -0.188 -36.224 75.091 1.00 28.67 C ATOM 746 CD PRO A 92 -0.971 -35.514 74.010 1.00 23.49 C ATOM 747 N GLY A 93 1.075 -32.648 75.497 1.00 22.48 N ATOM 748 CA GLY A 93 2.142 -31.698 75.811 1.00 21.10 C ATOM 749 C GLY A 93 1.700 -30.240 75.773 1.00 22.95 C ATOM 750 O GLY A 93 2.472 -29.339 76.090 1.00 22.20 O ATOM 751 H GLY A 93 0.955 -32.965 74.514 1.00 0.00 H ATOM 752 N TYR A 94 0.480 -29.991 75.314 1.00 19.55 N ATOM 753 CA TYR A 94 -0.084 -28.639 75.282 1.00 18.33 C ATOM 754 C TYR A 94 -0.408 -28.247 76.746 1.00 19.92 C ATOM 755 O TYR A 94 -0.896 -29.062 77.516 1.00 19.24 O ATOM 756 CB TYR A 94 -1.412 -28.652 74.457 1.00 17.74 C ATOM 757 CG TYR A 94 -2.054 -27.289 74.351 1.00 17.59 C ATOM 758 CD1 TYR A 94 -1.473 -26.278 73.584 1.00 17.85 C ATOM 759 CD2 TYR A 94 -3.216 -26.979 75.073 1.00 17.00 C ATOM 760 CE1 TYR A 94 -2.061 -25.014 73.481 1.00 17.92 C ATOM 761 CE2 TYR A 94 -3.792 -25.701 75.009 1.00 17.05 C ATOM 762 CZ TYR A 94 -3.201 -24.724 74.220 1.00 21.18 C ATOM 763 OH TYR A 94 -3.745 -23.467 74.107 1.00 22.77 O ATOM 764 HH TYR A 94 -3.183 -22.918 73.505 1.00 0.00 H ATOM 765 H TYR A 94 -0.096 -30.783 74.965 1.00 0.00 H ATOM 766 N SER A 95 -0.134 -27.022 77.100 1.00 18.17 N ATOM 767 CA SER A 95 -0.419 -26.485 78.424 1.00 18.84 C ATOM 768 C SER A 95 -0.891 -25.022 78.241 1.00 22.62 C ATOM 769 O SER A 95 -0.075 -24.103 78.125 1.00 20.11 O ATOM 770 CB SER A 95 0.844 -26.589 79.290 1.00 25.72 C ATOM 771 OG SER A 95 0.540 -26.385 80.660 1.00 34.34 O ATOM 772 HG SER A 95 1.370 -26.457 81.195 1.00 0.00 H ATOM 773 H SER A 95 0.312 -26.395 76.400 1.00 0.00 H ATOM 774 N HIS A 96 -2.239 -24.830 78.154 1.00 21.34 N ATOM 775 CA HIS A 96 -2.858 -23.508 77.964 1.00 21.53 C ATOM 776 C HIS A 96 -2.375 -22.518 79.047 1.00 25.58 C ATOM 777 O HIS A 96 -2.324 -22.905 80.224 1.00 23.35 O ATOM 778 CB HIS A 96 -4.394 -23.628 78.007 1.00 22.35 C ATOM 779 CG HIS A 96 -5.113 -22.449 77.422 1.00 25.94 C ATOM 780 ND1 HIS A 96 -5.171 -22.252 76.050 1.00 27.69 N ATOM 781 CD2 HIS A 96 -5.770 -21.441 78.042 1.00 27.42 C ATOM 782 CE1 HIS A 96 -5.882 -21.150 75.873 1.00 27.55 C ATOM 783 NE2 HIS A 96 -6.257 -20.617 77.047 1.00 27.78 N ATOM 784 H HIS A 96 -2.861 -25.660 78.226 1.00 0.00 H ATOM 785 N PRO A 97 -2.000 -21.263 78.708 1.00 23.24 N ATOM 786 CA PRO A 97 -2.037 -20.594 77.386 1.00 22.89 C ATOM 787 C PRO A 97 -0.750 -20.640 76.570 1.00 23.96 C ATOM 788 O PRO A 97 -0.619 -19.861 75.623 1.00 23.64 O ATOM 789 CB PRO A 97 -2.396 -19.150 77.760 1.00 25.10 C ATOM 790 CG PRO A 97 -1.644 -18.943 79.072 1.00 29.01 C ATOM 791 CD PRO A 97 -1.585 -20.306 79.758 1.00 24.58 C ATOM 792 N GLY A 98 0.181 -21.530 76.909 1.00 20.83 N ATOM 793 CA GLY A 98 1.423 -21.657 76.139 1.00 21.16 C ATOM 794 C GLY A 98 1.209 -22.082 74.688 1.00 23.76 C ATOM 795 O GLY A 98 0.261 -22.807 74.390 1.00 20.24 O ATOM 796 H GLY A 98 0.025 -22.145 77.733 1.00 0.00 H ATOM 797 N HIS A 99 2.100 -21.644 73.773 1.00 20.83 N ATOM 798 CA HIS A 99 1.980 -21.972 72.343 1.00 19.38 C ATOM 799 C HIS A 99 2.475 -23.359 71.925 1.00 22.16 C ATOM 800 O HIS A 99 2.099 -23.817 70.853 1.00 22.15 O ATOM 801 CB HIS A 99 2.669 -20.921 71.463 1.00 18.83 C ATOM 802 CG HIS A 99 2.087 -19.550 71.566 1.00 20.81 C ATOM 803 ND1 HIS A 99 0.764 -19.309 71.311 1.00 21.14 N ATOM 804 CD2 HIS A 99 2.700 -18.375 71.841 1.00 22.66 C ATOM 805 CE1 HIS A 99 0.598 -18.012 71.454 1.00 21.42 C ATOM 806 NE2 HIS A 99 1.743 -17.411 71.782 1.00 22.38 N ATOM 807 H HIS A 99 2.897 -21.056 74.089 1.00 0.00 H ATOM 808 N SER A 100 3.345 -24.001 72.700 1.00 18.67 N ATOM 809 CA SER A 100 3.887 -25.334 72.333 1.00 17.72 C ATOM 810 C SER A 100 2.854 -26.434 72.172 1.00 18.09 C ATOM 811 O SER A 100 1.892 -26.499 72.935 1.00 16.88 O ATOM 812 CB SER A 100 4.942 -25.789 73.344 1.00 22.52 C ATOM 813 OG SER A 100 5.932 -24.790 73.518 1.00 31.17 O ATOM 814 HG SER A 100 5.507 -23.960 73.850 1.00 0.00 H ATOM 815 H SER A 100 3.654 -23.557 73.588 1.00 0.00 H ATOM 816 N ASN A 101 3.059 -27.332 71.180 1.00 15.42 N ATOM 817 CA ASN A 101 2.189 -28.489 70.954 1.00 16.11 C ATOM 818 C ASN A 101 0.755 -28.050 70.697 1.00 21.21 C ATOM 819 O ASN A 101 -0.195 -28.607 71.259 1.00 20.85 O ATOM 820 CB ASN A 101 2.232 -29.483 72.138 1.00 19.54 C ATOM 821 CG ASN A 101 3.607 -29.995 72.465 1.00 34.14 C ATOM 822 OD1 ASN A 101 4.131 -29.789 73.552 1.00 30.21 O ATOM 823 ND2 ASN A 101 4.236 -30.625 71.512 1.00 22.81 N ATOM 824 HD22 ASN A 101 3.767 -30.787 70.598 1.00 0.00 H ATOM 825 HD21 ASN A 101 5.206 -30.966 71.666 1.00 0.00 H ATOM 826 H ASN A 101 3.873 -27.194 70.548 1.00 0.00 H ATOM 827 N ASP A 102 0.606 -27.039 69.853 1.00 16.98 N ATOM 828 CA ASP A 102 -0.686 -26.439 69.590 1.00 15.67 C ATOM 829 C ASP A 102 -1.467 -27.214 68.559 1.00 20.34 C ATOM 830 O ASP A 102 -1.702 -26.724 67.473 1.00 19.93 O ATOM 831 CB ASP A 102 -0.540 -24.948 69.234 1.00 16.06 C ATOM 832 CG ASP A 102 -1.832 -24.157 69.331 1.00 20.91 C ATOM 833 OD1 ASP A 102 -2.840 -24.711 69.837 1.00 20.86 O ATOM 834 OD2 ASP A 102 -1.828 -22.973 68.938 1.00 20.54 O ATOM 835 H ASP A 102 1.444 -26.664 69.364 1.00 0.00 H ATOM 836 N LEU A 103 -1.872 -28.451 68.908 1.00 16.87 N ATOM 837 CA LEU A 103 -2.704 -29.274 68.042 1.00 14.74 C ATOM 838 C LEU A 103 -3.685 -30.094 68.850 1.00 18.38 C ATOM 839 O LEU A 103 -3.422 -30.479 69.991 1.00 17.21 O ATOM 840 CB LEU A 103 -1.912 -30.137 67.023 1.00 13.77 C ATOM 841 CG LEU A 103 -1.145 -31.348 67.578 1.00 16.82 C ATOM 842 CD1 LEU A 103 -0.771 -32.336 66.458 1.00 17.93 C ATOM 843 CD2 LEU A 103 0.115 -30.912 68.275 1.00 16.24 C ATOM 844 H LEU A 103 -1.579 -28.832 69.830 1.00 0.00 H ATOM 845 N MET A 104 -4.825 -30.356 68.238 1.00 16.12 N ATOM 846 CA MET A 104 -5.880 -31.130 68.862 1.00 15.81 C ATOM 847 C MET A 104 -6.615 -31.925 67.807 1.00 21.01 C ATOM 848 O MET A 104 -6.864 -31.417 66.719 1.00 19.44 O ATOM 849 CB MET A 104 -6.832 -30.160 69.595 1.00 16.84 C ATOM 850 CG MET A 104 -8.087 -30.822 70.154 1.00 20.12 C ATOM 851 SD MET A 104 -8.875 -29.844 71.480 1.00 23.65 S ATOM 852 CE MET A 104 -9.831 -28.706 70.488 1.00 21.21 C ATOM 853 H MET A 104 -4.971 -29.994 67.274 1.00 0.00 H ATOM 854 N LEU A 105 -6.943 -33.187 68.125 1.00 17.78 N ATOM 855 CA LEU A 105 -7.733 -34.039 67.247 1.00 17.54 C ATOM 856 C LEU A 105 -9.210 -33.983 67.634 1.00 21.85 C ATOM 857 O LEU A 105 -9.547 -34.108 68.815 1.00 21.34 O ATOM 858 CB LEU A 105 -7.242 -35.502 67.296 1.00 17.93 C ATOM 859 CG LEU A 105 -6.026 -35.845 66.407 1.00 23.61 C ATOM 860 CD1 LEU A 105 -5.366 -37.099 66.901 1.00 23.47 C ATOM 861 CD2 LEU A 105 -6.433 -36.027 64.943 1.00 26.08 C ATOM 862 H LEU A 105 -6.620 -33.572 69.035 1.00 0.00 H ATOM 863 N ILE A 106 -10.098 -33.844 66.648 1.00 19.37 N ATOM 864 CA ILE A 106 -11.548 -33.853 66.881 1.00 20.12 C ATOM 865 C ILE A 106 -12.152 -35.031 66.141 1.00 24.12 C ATOM 866 O ILE A 106 -11.994 -35.115 64.926 1.00 24.19 O ATOM 867 CB ILE A 106 -12.245 -32.526 66.471 1.00 21.78 C ATOM 868 CG1 ILE A 106 -11.700 -31.352 67.308 1.00 21.64 C ATOM 869 CG2 ILE A 106 -13.789 -32.648 66.605 1.00 22.52 C ATOM 870 CD1 ILE A 106 -12.184 -29.925 66.826 1.00 20.14 C ATOM 871 H ILE A 106 -9.749 -33.724 65.675 1.00 0.00 H ATOM 872 N LYS A 107 -12.866 -35.914 66.861 1.00 20.64 N ATOM 873 CA LYS A 107 -13.522 -37.050 66.220 1.00 20.29 C ATOM 874 C LYS A 107 -14.923 -36.643 65.828 1.00 23.15 C ATOM 875 O LYS A 107 -15.677 -36.146 66.666 1.00 24.42 O ATOM 876 CB LYS A 107 -13.575 -38.280 67.151 1.00 22.77 C ATOM 877 CG LYS A 107 -13.932 -39.551 66.388 1.00 27.07 C ATOM 878 CD LYS A 107 -13.973 -40.770 67.273 1.00 25.91 C ATOM 879 CE LYS A 107 -14.349 -41.988 66.452 1.00 28.98 C ATOM 880 NZ LYS A 107 -14.544 -43.178 67.324 1.00 33.98 N ATOM 881 HZ1 LYS A 107 -13.662 -43.379 67.836 1.00 0.00 H ATOM 882 HZ2 LYS A 107 -15.306 -42.986 68.005 1.00 0.00 H ATOM 883 HZ3 LYS A 107 -14.801 -43.998 66.738 1.00 0.00 H ATOM 884 H LYS A 107 -12.952 -35.786 67.889 1.00 0.00 H ATOM 885 N LEU A 108 -15.289 -36.872 64.558 1.00 21.17 N ATOM 886 CA LEU A 108 -16.645 -36.581 64.079 1.00 21.07 C ATOM 887 C LEU A 108 -17.598 -37.712 64.532 1.00 27.62 C ATOM 888 O LEU A 108 -17.142 -38.843 64.763 1.00 25.53 O ATOM 889 CB LEU A 108 -16.666 -36.462 62.543 1.00 21.21 C ATOM 890 CG LEU A 108 -15.656 -35.465 61.908 1.00 24.26 C ATOM 891 CD1 LEU A 108 -15.842 -35.393 60.398 1.00 23.43 C ATOM 892 CD2 LEU A 108 -15.746 -34.082 62.550 1.00 23.91 C ATOM 893 H LEU A 108 -14.592 -37.267 63.894 1.00 0.00 H ATOM 894 N ASN A 109 -18.907 -37.397 64.652 1.00 26.95 N ATOM 895 CA ASN A 109 -19.948 -38.355 65.063 1.00 27.77 C ATOM 896 C ASN A 109 -20.150 -39.502 64.067 1.00 32.78 C ATOM 897 O ASN A 109 -20.570 -40.590 64.460 1.00 31.91 O ATOM 898 CB ASN A 109 -21.274 -37.651 65.363 1.00 30.92 C ATOM 899 CG ASN A 109 -21.891 -36.960 64.178 1.00 48.96 C ATOM 900 OD1 ASN A 109 -21.298 -36.060 63.574 1.00 32.24 O ATOM 901 ND2 ASN A 109 -23.106 -37.358 63.833 1.00 45.15 N ATOM 902 HD22 ASN A 109 -23.575 -38.119 64.365 1.00 0.00 H ATOM 903 HD21 ASN A 109 -23.592 -36.910 63.030 1.00 0.00 H ATOM 904 H ASN A 109 -19.196 -36.420 64.442 1.00 0.00 H ATOM 905 N ARG A 110 -19.824 -39.259 62.792 1.00 29.44 N ATOM 906 CA ARG A 110 -19.899 -40.243 61.711 1.00 29.34 C ATOM 907 C ARG A 110 -18.788 -39.944 60.713 1.00 32.46 C ATOM 908 O ARG A 110 -18.274 -38.811 60.669 1.00 30.51 O ATOM 909 CB ARG A 110 -21.291 -40.193 61.010 1.00 27.51 C ATOM 910 CG ARG A 110 -21.541 -38.956 60.153 1.00 33.07 C ATOM 911 CD ARG A 110 -22.970 -38.805 59.664 1.00 39.88 C ATOM 912 NE ARG A 110 -23.076 -37.704 58.705 1.00 53.26 N ATOM 913 CZ ARG A 110 -23.301 -36.433 59.038 1.00 58.12 C ATOM 914 NH1 ARG A 110 -23.369 -35.497 58.098 1.00 38.76 N ATOM 915 NH2 ARG A 110 -23.446 -36.089 60.315 1.00 33.53 N ATOM 916 HE ARG A 110 -22.968 -37.929 57.695 1.00 0.00 H ATOM 917 HH12 ARG A 110 -23.545 -34.507 58.362 1.00 0.00 H ATOM 918 HH11 ARG A 110 -23.247 -35.755 57.098 1.00 0.00 H ATOM 919 HH22 ARG A 110 -23.621 -35.096 60.569 1.00 0.00 H ATOM 920 HH21 ARG A 110 -23.384 -36.813 61.059 1.00 0.00 H ATOM 921 H ARG A 110 -19.494 -38.302 62.552 1.00 0.00 H ATOM 922 N ARG A 111 -18.454 -40.932 59.882 1.00 28.55 N ATOM 923 CA ARG A 111 -17.476 -40.747 58.814 1.00 27.83 C ATOM 924 C ARG A 111 -18.073 -39.824 57.744 1.00 29.89 C ATOM 925 O ARG A 111 -19.289 -39.780 57.570 1.00 30.42 O ATOM 926 CB ARG A 111 -17.118 -42.114 58.196 1.00 26.69 C ATOM 927 CG ARG A 111 -16.156 -42.943 59.044 1.00 28.92 C ATOM 928 CD ARG A 111 -16.064 -44.377 58.544 1.00 32.50 C ATOM 929 NE ARG A 111 -15.382 -44.473 57.250 1.00 36.37 N ATOM 930 CZ ARG A 111 -14.071 -44.621 57.093 1.00 49.45 C ATOM 931 NH1 ARG A 111 -13.270 -44.680 58.154 1.00 38.84 N ATOM 932 NH2 ARG A 111 -13.549 -44.704 55.874 1.00 38.59 N ATOM 933 HE ARG A 111 -15.967 -44.421 56.392 1.00 0.00 H ATOM 934 HH12 ARG A 111 -12.244 -44.796 58.026 1.00 0.00 H ATOM 935 HH11 ARG A 111 -13.669 -44.610 59.112 1.00 0.00 H ATOM 936 HH22 ARG A 111 -12.522 -44.820 55.755 1.00 0.00 H ATOM 937 HH21 ARG A 111 -14.167 -44.653 55.039 1.00 0.00 H ATOM 938 H ARG A 111 -18.904 -41.862 59.998 1.00 0.00 H ATOM 939 N ILE A 112 -17.221 -39.087 57.022 1.00 26.45 N ATOM 940 CA ILE A 112 -17.683 -38.208 55.946 1.00 26.19 C ATOM 941 C ILE A 112 -18.235 -39.035 54.764 1.00 31.66 C ATOM 942 O ILE A 112 -17.949 -40.228 54.647 1.00 30.93 O ATOM 943 CB ILE A 112 -16.527 -37.286 55.447 1.00 28.81 C ATOM 944 CG1 ILE A 112 -15.310 -38.109 54.947 1.00 28.93 C ATOM 945 CG2 ILE A 112 -16.128 -36.287 56.537 1.00 28.80 C ATOM 946 CD1 ILE A 112 -14.917 -37.882 53.513 1.00 32.69 C ATOM 947 H ILE A 112 -16.204 -39.140 57.231 1.00 0.00 H ATOM 948 N ARG A 113 -19.014 -38.382 53.906 1.00 30.23 N ATOM 949 CA ARG A 113 -19.495 -38.940 52.652 1.00 30.86 C ATOM 950 C ARG A 113 -18.459 -38.421 51.632 1.00 35.74 C ATOM 951 O ARG A 113 -18.354 -37.200 51.439 1.00 34.84 O ATOM 952 CB ARG A 113 -20.907 -38.425 52.361 1.00 31.08 C ATOM 953 CG ARG A 113 -21.520 -38.968 51.070 1.00 43.95 C ATOM 954 CD ARG A 113 -22.967 -38.555 50.910 1.00 53.07 C ATOM 955 NE ARG A 113 -23.120 -37.192 50.394 1.00 56.44 N ATOM 956 CZ ARG A 113 -23.566 -36.161 51.113 1.00 66.47 C ATOM 957 NH1 ARG A 113 -23.647 -34.950 50.573 1.00 48.45 N ATOM 958 NH2 ARG A 113 -23.901 -36.325 52.391 1.00 56.19 N ATOM 959 HE ARG A 113 -22.864 -37.017 49.401 1.00 0.00 H ATOM 960 HH12 ARG A 113 -23.996 -34.150 51.139 1.00 0.00 H ATOM 961 HH11 ARG A 113 -23.362 -34.802 49.584 1.00 0.00 H ATOM 962 HH22 ARG A 113 -24.248 -35.516 52.945 1.00 0.00 H ATOM 963 HH21 ARG A 113 -23.816 -37.262 52.835 1.00 0.00 H ATOM 964 H ARG A 113 -19.297 -37.411 54.147 1.00 0.00 H ATOM 965 N PRO A 114 -17.590 -39.297 51.069 1.00 33.72 N ATOM 966 CA PRO A 114 -16.537 -38.792 50.169 1.00 34.01 C ATOM 967 C PRO A 114 -17.053 -38.123 48.896 1.00 37.34 C ATOM 968 O PRO A 114 -17.761 -38.755 48.115 1.00 37.84 O ATOM 969 CB PRO A 114 -15.672 -40.028 49.886 1.00 36.09 C ATOM 970 CG PRO A 114 -16.578 -41.191 50.131 1.00 40.43 C ATOM 971 CD PRO A 114 -17.536 -40.769 51.209 1.00 35.69 C ATOM 972 N THR A 115 -16.754 -36.811 48.728 1.00 32.80 N ATOM 973 CA THR A 115 -17.140 -36.032 47.544 1.00 32.12 C ATOM 974 C THR A 115 -15.970 -35.164 47.070 1.00 36.03 C ATOM 975 O THR A 115 -14.908 -35.156 47.701 1.00 35.73 O ATOM 976 CB THR A 115 -18.390 -35.160 47.793 1.00 36.24 C ATOM 977 OG1 THR A 115 -18.031 -34.045 48.615 1.00 34.32 O ATOM 978 CG2 THR A 115 -19.605 -35.945 48.358 1.00 34.21 C ATOM 979 HG1 THR A 115 -18.831 -33.484 48.776 1.00 0.00 H ATOM 980 H THR A 115 -16.221 -36.329 49.480 1.00 0.00 H ATOM 981 N LYS A 116 -16.179 -34.397 45.984 1.00 32.06 N ATOM 982 CA LYS A 116 -15.188 -33.456 45.449 1.00 31.99 C ATOM 983 C LYS A 116 -15.024 -32.273 46.423 1.00 34.07 C ATOM 984 O LYS A 116 -13.990 -31.618 46.413 1.00 33.58 O ATOM 985 CB LYS A 116 -15.584 -32.962 44.033 1.00 35.30 C ATOM 986 CG LYS A 116 -16.979 -32.319 43.952 1.00 52.86 C ATOM 987 CD LYS A 116 -17.129 -31.342 42.813 1.00 63.55 C ATOM 988 CE LYS A 116 -18.467 -30.640 42.864 1.00 73.62 C ATOM 989 NZ LYS A 116 -18.590 -29.608 41.799 1.00 83.64 N ATOM 990 HZ1 LYS A 116 -17.842 -28.896 41.920 1.00 0.00 H ATOM 991 HZ2 LYS A 116 -18.493 -30.060 40.867 1.00 0.00 H ATOM 992 HZ3 LYS A 116 -19.521 -29.150 41.868 1.00 0.00 H ATOM 993 H LYS A 116 -17.094 -34.476 45.496 1.00 0.00 H ATOM 994 N ASP A 117 -16.057 -32.014 47.260 1.00 28.52 N ATOM 995 CA ASP A 117 -16.052 -30.933 48.240 1.00 27.45 C ATOM 996 C ASP A 117 -15.551 -31.348 49.630 1.00 28.34 C ATOM 997 O ASP A 117 -15.134 -30.488 50.415 1.00 26.62 O ATOM 998 CB ASP A 117 -17.451 -30.316 48.338 1.00 29.86 C ATOM 999 CG ASP A 117 -17.815 -29.495 47.118 1.00 41.24 C ATOM 1000 OD1 ASP A 117 -17.110 -28.504 46.840 1.00 41.35 O ATOM 1001 OD2 ASP A 117 -18.818 -29.826 46.463 1.00 47.62 O ATOM 1002 H ASP A 117 -16.901 -32.619 47.201 1.00 0.00 H ATOM 1003 N VAL A 118 -15.635 -32.647 49.954 1.00 24.54 N ATOM 1004 CA VAL A 118 -15.238 -33.170 51.262 1.00 23.81 C ATOM 1005 C VAL A 118 -14.250 -34.306 51.054 1.00 29.13 C ATOM 1006 O VAL A 118 -14.625 -35.410 50.620 1.00 29.03 O ATOM 1007 CB VAL A 118 -16.448 -33.546 52.165 1.00 26.46 C ATOM 1008 CG1 VAL A 118 -15.981 -34.025 53.531 1.00 26.37 C ATOM 1009 CG2 VAL A 118 -17.420 -32.373 52.330 1.00 25.75 C ATOM 1010 H VAL A 118 -15.999 -33.313 49.243 1.00 0.00 H ATOM 1011 N ARG A 119 -12.980 -34.022 51.350 1.00 25.92 N ATOM 1012 CA ARG A 119 -11.899 -34.975 51.154 1.00 25.39 C ATOM 1013 C ARG A 119 -10.799 -34.798 52.193 1.00 26.30 C ATOM 1014 O ARG A 119 -10.306 -33.686 52.362 1.00 26.46 O ATOM 1015 CB ARG A 119 -11.323 -34.817 49.720 1.00 26.72 C ATOM 1016 CG ARG A 119 -10.253 -35.845 49.338 1.00 32.82 C ATOM 1017 CD ARG A 119 -10.021 -35.903 47.834 1.00 42.05 C ATOM 1018 NE ARG A 119 -9.358 -34.703 47.303 1.00 55.34 N ATOM 1019 CZ ARG A 119 -8.082 -34.637 46.946 1.00 69.11 C ATOM 1020 NH1 ARG A 119 -7.572 -33.497 46.501 1.00 53.32 N ATOM 1021 NH2 ARG A 119 -7.307 -35.716 47.013 1.00 55.16 N ATOM 1022 HE ARG A 119 -9.932 -33.842 47.200 1.00 0.00 H ATOM 1023 HH12 ARG A 119 -6.571 -33.449 46.222 1.00 0.00 H ATOM 1024 HH11 ARG A 119 -8.173 -32.651 46.431 1.00 0.00 H ATOM 1025 HH22 ARG A 119 -6.308 -35.657 46.731 1.00 0.00 H ATOM 1026 HH21 ARG A 119 -7.700 -36.619 47.347 1.00 0.00 H ATOM 1027 H ARG A 119 -12.755 -33.083 51.736 1.00 0.00 H ATOM 1028 N PRO A 120 -10.343 -35.878 52.855 1.00 22.96 N ATOM 1029 CA PRO A 120 -9.242 -35.726 53.816 1.00 22.35 C ATOM 1030 C PRO A 120 -7.897 -35.433 53.150 1.00 25.71 C ATOM 1031 O PRO A 120 -7.687 -35.706 51.945 1.00 25.29 O ATOM 1032 CB PRO A 120 -9.256 -37.061 54.587 1.00 23.61 C ATOM 1033 CG PRO A 120 -10.610 -37.692 54.250 1.00 29.04 C ATOM 1034 CD PRO A 120 -10.796 -37.279 52.822 1.00 24.86 C ATOM 1035 N ILE A 121 -6.974 -34.864 53.938 1.00 19.56 N ATOM 1036 CA ILE A 121 -5.611 -34.582 53.495 1.00 20.00 C ATOM 1037 C ILE A 121 -4.650 -35.267 54.490 1.00 26.11 C ATOM 1038 O ILE A 121 -4.961 -35.370 55.681 1.00 28.63 O ATOM 1039 CB ILE A 121 -5.333 -33.043 53.307 1.00 22.89 C ATOM 1040 CG1 ILE A 121 -3.968 -32.790 52.620 1.00 23.24 C ATOM 1041 CG2 ILE A 121 -5.465 -32.266 54.638 1.00 22.17 C ATOM 1042 CD1 ILE A 121 -3.764 -31.393 52.039 1.00 29.18 C ATOM 1043 H ILE A 121 -7.241 -34.611 54.911 1.00 0.00 H ATOM 1044 N ASN A 122 -3.523 -35.765 54.000 1.00 20.73 N ATOM 1045 CA ASN A 122 -2.578 -36.444 54.878 1.00 21.48 C ATOM 1046 C ASN A 122 -1.483 -35.527 55.385 1.00 24.11 C ATOM 1047 O ASN A 122 -1.124 -34.557 54.720 1.00 22.51 O ATOM 1048 CB ASN A 122 -1.970 -37.654 54.153 1.00 29.07 C ATOM 1049 CG ASN A 122 -2.967 -38.773 53.980 1.00 64.40 C ATOM 1050 OD1 ASN A 122 -3.759 -38.805 53.032 1.00 58.43 O ATOM 1051 ND2 ASN A 122 -2.991 -39.692 54.931 1.00 60.97 N ATOM 1052 HD22 ASN A 122 -2.314 -39.643 55.719 1.00 0.00 H ATOM 1053 HD21 ASN A 122 -3.687 -40.464 54.891 1.00 0.00 H ATOM 1054 H ASN A 122 -3.313 -35.671 52.986 1.00 0.00 H ATOM 1055 N VAL A 123 -0.971 -35.840 56.587 1.00 22.89 N ATOM 1056 CA VAL A 123 0.142 -35.155 57.225 1.00 23.00 C ATOM 1057 C VAL A 123 1.366 -36.022 56.939 1.00 28.80 C ATOM 1058 O VAL A 123 1.347 -37.228 57.204 1.00 28.86 O ATOM 1059 CB VAL A 123 -0.058 -34.924 58.757 1.00 26.44 C ATOM 1060 CG1 VAL A 123 1.212 -34.382 59.404 1.00 25.48 C ATOM 1061 CG2 VAL A 123 -1.225 -33.978 59.033 1.00 26.62 C ATOM 1062 H VAL A 123 -1.404 -36.634 57.101 1.00 0.00 H ATOM 1063 N SER A 124 2.410 -35.419 56.391 1.00 25.07 N ATOM 1064 CA SER A 124 3.635 -36.147 56.099 1.00 24.81 C ATOM 1065 C SER A 124 4.631 -35.941 57.230 1.00 24.77 C ATOM 1066 O SER A 124 4.693 -34.849 57.812 1.00 21.50 O ATOM 1067 CB SER A 124 4.232 -35.677 54.769 1.00 28.67 C ATOM 1068 OG SER A 124 5.533 -36.207 54.553 1.00 30.66 O ATOM 1069 HG SER A 124 5.881 -35.880 53.686 1.00 0.00 H ATOM 1070 H SER A 124 2.353 -34.405 56.165 1.00 0.00 H ATOM 1071 N SER A 125 5.435 -36.997 57.531 1.00 20.77 N ATOM 1072 CA SER A 125 6.479 -36.910 58.551 1.00 21.18 C ATOM 1073 C SER A 125 7.651 -36.084 58.043 1.00 25.56 C ATOM 1074 O SER A 125 8.502 -35.693 58.835 1.00 25.21 O ATOM 1075 CB SER A 125 6.961 -38.299 58.967 1.00 24.93 C ATOM 1076 OG SER A 125 5.901 -39.048 59.529 1.00 35.22 O ATOM 1077 HG SER A 125 5.553 -38.577 60.327 1.00 0.00 H ATOM 1078 H SER A 125 5.303 -37.893 57.020 1.00 0.00 H ATOM 1079 N HIS A 128 7.705 -35.795 56.708 1.00 25.26 N ATOM 1080 CA HIS A 128 8.774 -34.982 56.148 1.00 24.51 C ATOM 1081 C HIS A 128 8.499 -33.533 56.530 1.00 26.19 C ATOM 1082 O HIS A 128 7.425 -32.994 56.208 1.00 26.59 O ATOM 1083 CB HIS A 128 8.845 -35.125 54.612 1.00 26.26 C ATOM 1084 CG HIS A 128 9.693 -34.082 53.946 1.00 30.14 C ATOM 1085 ND1 HIS A 128 11.066 -34.101 54.044 1.00 32.07 N ATOM 1086 CD2 HIS A 128 9.323 -33.030 53.180 1.00 32.32 C ATOM 1087 CE1 HIS A 128 11.490 -33.060 53.344 1.00 31.78 C ATOM 1088 NE2 HIS A 128 10.477 -32.400 52.788 1.00 32.26 N ATOM 1089 H HIS A 128 6.965 -36.165 56.078 1.00 0.00 H ATOM 1090 N CYS A 129 9.432 -32.923 57.250 1.00 22.30 N ATOM 1091 CA CYS A 129 9.300 -31.528 57.658 1.00 24.79 C ATOM 1092 C CYS A 129 9.584 -30.619 56.447 1.00 29.35 C ATOM 1093 O CYS A 129 10.589 -30.819 55.758 1.00 28.76 O ATOM 1094 CB CYS A 129 10.205 -31.203 58.848 1.00 26.20 C ATOM 1095 SG CYS A 129 9.779 -32.097 60.374 1.00 30.30 S ATOM 1096 H CYS A 129 10.281 -33.454 57.531 1.00 0.00 H ATOM 1097 N PRO A 130 8.685 -29.662 56.116 1.00 27.13 N ATOM 1098 CA PRO A 130 8.983 -28.778 54.974 1.00 26.75 C ATOM 1099 C PRO A 130 10.221 -27.934 55.261 1.00 30.98 C ATOM 1100 O PRO A 130 10.414 -27.457 56.372 1.00 31.35 O ATOM 1101 CB PRO A 130 7.719 -27.916 54.827 1.00 28.19 C ATOM 1102 CG PRO A 130 7.073 -27.954 56.156 1.00 33.11 C ATOM 1103 CD PRO A 130 7.421 -29.275 56.793 1.00 28.08 C ATOM 1104 N SER A 131 11.092 -27.795 54.257 1.00 28.55 N ATOM 1105 CA SER A 131 12.347 -27.070 54.411 1.00 28.89 C ATOM 1106 C SER A 131 12.201 -25.568 54.208 1.00 31.31 C ATOM 1107 O SER A 131 11.245 -25.133 53.581 1.00 30.46 O ATOM 1108 CB SER A 131 13.367 -27.604 53.411 1.00 34.05 C ATOM 1109 OG SER A 131 13.142 -28.966 53.116 1.00 45.50 O ATOM 1110 HG SER A 131 13.820 -29.278 52.466 1.00 0.00 H ATOM 1111 H SER A 131 10.867 -28.219 53.334 1.00 0.00 H ATOM 1112 N ALA A 132 13.167 -24.779 54.703 1.00 27.96 N ATOM 1113 CA ALA A 132 13.177 -23.317 54.539 1.00 27.04 C ATOM 1114 C ALA A 132 13.158 -22.950 53.056 1.00 28.72 C ATOM 1115 O ALA A 132 13.877 -23.559 52.258 1.00 28.45 O ATOM 1116 CB ALA A 132 14.393 -22.707 55.211 1.00 27.84 C ATOM 1117 H ALA A 132 13.947 -25.223 55.228 1.00 0.00 H ATOM 1118 N GLY A 133 12.275 -22.021 52.705 1.00 24.76 N ATOM 1119 CA GLY A 133 12.064 -21.583 51.330 1.00 23.23 C ATOM 1120 C GLY A 133 10.887 -22.272 50.666 1.00 24.45 C ATOM 1121 O GLY A 133 10.423 -21.787 49.641 1.00 24.35 O ATOM 1122 H GLY A 133 11.702 -21.581 53.453 1.00 0.00 H ATOM 1123 N THR A 134 10.388 -23.395 51.225 1.00 20.14 N ATOM 1124 CA THR A 134 9.231 -24.130 50.660 1.00 19.49 C ATOM 1125 C THR A 134 7.997 -23.235 50.635 1.00 22.40 C ATOM 1126 O THR A 134 7.678 -22.600 51.646 1.00 23.29 O ATOM 1127 CB THR A 134 8.918 -25.442 51.456 1.00 24.19 C ATOM 1128 OG1 THR A 134 10.080 -26.281 51.448 1.00 23.89 O ATOM 1129 CG2 THR A 134 7.748 -26.230 50.869 1.00 23.09 C ATOM 1130 HG1 THR A 134 10.834 -25.802 51.875 1.00 0.00 H ATOM 1131 H THR A 134 10.835 -23.761 52.090 1.00 0.00 H ATOM 1132 N LYS A 135 7.297 -23.228 49.501 1.00 19.19 N ATOM 1133 CA LYS A 135 6.060 -22.467 49.299 1.00 18.61 C ATOM 1134 C LYS A 135 4.856 -23.282 49.813 1.00 22.01 C ATOM 1135 O LYS A 135 4.620 -24.402 49.372 1.00 21.19 O ATOM 1136 CB LYS A 135 5.897 -22.106 47.804 1.00 20.66 C ATOM 1137 CG LYS A 135 4.694 -21.189 47.527 1.00 29.21 C ATOM 1138 CD LYS A 135 4.420 -21.086 46.001 1.00 32.33 C ATOM 1139 CE LYS A 135 4.337 -19.655 45.558 1.00 47.09 C ATOM 1140 NZ LYS A 135 3.988 -19.513 44.119 1.00 46.57 N ATOM 1141 HZ1 LYS A 135 4.713 -19.983 43.540 1.00 0.00 H ATOM 1142 HZ2 LYS A 135 3.063 -19.954 43.943 1.00 0.00 H ATOM 1143 HZ3 LYS A 135 3.945 -18.504 43.872 1.00 0.00 H ATOM 1144 H LYS A 135 7.651 -23.800 48.708 1.00 0.00 H ATOM 1145 N CYS A 136 4.080 -22.697 50.734 1.00 18.57 N ATOM 1146 CA CYS A 136 2.900 -23.343 51.297 1.00 17.81 C ATOM 1147 C CYS A 136 1.667 -22.462 51.143 1.00 20.52 C ATOM 1148 O CYS A 136 1.784 -21.238 51.107 1.00 21.15 O ATOM 1149 CB CYS A 136 3.124 -23.699 52.761 1.00 19.36 C ATOM 1150 SG CYS A 136 4.627 -24.668 53.071 1.00 23.34 S ATOM 1151 H CYS A 136 4.329 -21.742 51.062 1.00 0.00 H ATOM 1152 N LEU A 137 0.487 -23.082 51.130 1.00 17.49 N ATOM 1153 CA LEU A 137 -0.762 -22.355 51.080 1.00 16.98 C ATOM 1154 C LEU A 137 -1.461 -22.413 52.451 1.00 18.81 C ATOM 1155 O LEU A 137 -1.612 -23.495 53.039 1.00 17.27 O ATOM 1156 CB LEU A 137 -1.667 -22.938 49.975 1.00 17.87 C ATOM 1157 CG LEU A 137 -2.898 -22.081 49.642 1.00 22.11 C ATOM 1158 CD1 LEU A 137 -2.542 -20.940 48.712 1.00 22.08 C ATOM 1159 CD2 LEU A 137 -4.023 -22.914 49.027 1.00 25.93 C ATOM 1160 H LEU A 137 0.464 -24.121 51.157 1.00 0.00 H ATOM 1161 N VAL A 138 -1.857 -21.227 52.970 1.00 15.53 N ATOM 1162 CA VAL A 138 -2.631 -21.103 54.208 1.00 15.34 C ATOM 1163 C VAL A 138 -4.050 -20.591 53.870 1.00 19.74 C ATOM 1164 O VAL A 138 -4.197 -19.771 52.959 1.00 19.42 O ATOM 1165 CB VAL A 138 -1.900 -20.273 55.313 1.00 18.71 C ATOM 1166 CG1 VAL A 138 -1.716 -18.794 54.908 1.00 16.84 C ATOM 1167 CG2 VAL A 138 -2.604 -20.392 56.669 1.00 18.50 C ATOM 1168 H VAL A 138 -1.598 -20.357 52.463 1.00 0.00 H ATOM 1169 N SER A 139 -5.089 -21.085 54.572 1.00 15.56 N ATOM 1170 CA SER A 139 -6.447 -20.664 54.230 1.00 16.16 C ATOM 1171 C SER A 139 -7.295 -20.460 55.464 1.00 21.41 C ATOM 1172 O SER A 139 -7.028 -21.073 56.493 1.00 21.56 O ATOM 1173 CB SER A 139 -7.107 -21.659 53.274 1.00 19.36 C ATOM 1174 OG SER A 139 -7.076 -22.988 53.776 1.00 23.34 O ATOM 1175 HG SER A 139 -7.512 -23.595 53.127 1.00 0.00 H ATOM 1176 H SER A 139 -4.927 -21.758 55.348 1.00 0.00 H ATOM 1177 N GLY A 140 -8.301 -19.602 55.351 1.00 18.44 N ATOM 1178 CA GLY A 140 -9.187 -19.338 56.474 1.00 17.13 C ATOM 1179 C GLY A 140 -10.225 -18.266 56.220 1.00 19.25 C ATOM 1180 O GLY A 140 -10.212 -17.621 55.169 1.00 17.77 O ATOM 1181 H GLY A 140 -8.458 -19.112 54.447 1.00 0.00 H ATOM 1182 N TRP A 141 -11.150 -18.111 57.182 1.00 18.24 N ATOM 1183 CA TRP A 141 -12.234 -17.114 57.108 1.00 19.61 C ATOM 1184 C TRP A 141 -11.993 -16.015 58.131 1.00 21.98 C ATOM 1185 O TRP A 141 -12.907 -15.248 58.442 1.00 20.73 O ATOM 1186 CB TRP A 141 -13.603 -17.770 57.367 1.00 18.07 C ATOM 1187 CG TRP A 141 -14.087 -18.701 56.290 1.00 18.54 C ATOM 1188 CD1 TRP A 141 -14.745 -18.368 55.149 1.00 21.02 C ATOM 1189 CD2 TRP A 141 -14.090 -20.129 56.354 1.00 18.85 C ATOM 1190 NE1 TRP A 141 -15.099 -19.505 54.453 1.00 20.71 N ATOM 1191 CE2 TRP A 141 -14.700 -20.604 55.169 1.00 22.77 C ATOM 1192 CE3 TRP A 141 -13.595 -21.057 57.279 1.00 20.87 C ATOM 1193 CZ2 TRP A 141 -14.807 -21.960 54.880 1.00 22.32 C ATOM 1194 CZ3 TRP A 141 -13.717 -22.400 57.000 1.00 21.75 C ATOM 1195 CH2 TRP A 141 -14.347 -22.841 55.826 1.00 22.33 C ATOM 1196 HE1 TRP A 141 -15.588 -19.525 53.536 1.00 0.00 H ATOM 1197 H TRP A 141 -11.099 -18.724 58.020 1.00 0.00 H ATOM 1198 N GLY A 142 -10.764 -15.947 58.645 1.00 18.33 N ATOM 1199 CA GLY A 142 -10.362 -14.947 59.624 1.00 18.61 C ATOM 1200 C GLY A 142 -10.326 -13.558 59.030 1.00 20.88 C ATOM 1201 O GLY A 142 -10.524 -13.388 57.824 1.00 20.10 O ATOM 1202 H GLY A 142 -10.058 -16.643 58.331 1.00 0.00 H ATOM 1203 N THR A 143 -10.037 -12.554 59.862 1.00 19.00 N ATOM 1204 CA THR A 143 -10.016 -11.179 59.366 1.00 19.31 C ATOM 1205 C THR A 143 -9.050 -10.976 58.172 1.00 23.76 C ATOM 1206 O THR A 143 -7.970 -11.579 58.128 1.00 23.57 O ATOM 1207 CB THR A 143 -9.765 -10.203 60.505 1.00 23.99 C ATOM 1208 OG1 THR A 143 -9.842 -8.883 59.967 1.00 24.17 O ATOM 1209 CG2 THR A 143 -8.416 -10.432 61.201 1.00 20.35 C ATOM 1210 HG1 THR A 143 -9.156 -8.775 59.262 1.00 0.00 H ATOM 1211 H THR A 143 -9.827 -12.750 60.862 1.00 0.00 H ATOM 1212 N THR A 144 -9.478 -10.161 57.185 1.00 19.14 N ATOM 1213 CA THR A 144 -8.664 -9.823 56.008 1.00 18.61 C ATOM 1214 C THR A 144 -7.887 -8.508 56.261 1.00 23.53 C ATOM 1215 O THR A 144 -7.048 -8.089 55.454 1.00 23.58 O ATOM 1216 CB THR A 144 -9.546 -9.729 54.745 1.00 24.14 C ATOM 1217 OG1 THR A 144 -10.482 -8.689 54.920 1.00 26.59 O ATOM 1218 CG2 THR A 144 -10.289 -11.017 54.445 1.00 20.83 C ATOM 1219 HG1 THR A 144 -11.046 -8.884 55.710 1.00 0.00 H ATOM 1220 H THR A 144 -10.431 -9.752 57.261 1.00 0.00 H ATOM 1221 N LYS A 145 -8.181 -7.861 57.392 1.00 22.05 N ATOM 1222 CA LYS A 145 -7.507 -6.636 57.803 1.00 22.07 C ATOM 1223 C LYS A 145 -7.004 -6.802 59.241 1.00 23.29 C ATOM 1224 O LYS A 145 -7.514 -7.620 60.007 1.00 20.90 O ATOM 1225 CB LYS A 145 -8.474 -5.425 57.704 1.00 25.94 C ATOM 1226 CG LYS A 145 -8.890 -5.072 56.278 1.00 33.83 C ATOM 1227 CD LYS A 145 -9.902 -3.926 56.271 1.00 45.89 C ATOM 1228 CE LYS A 145 -10.540 -3.742 54.919 1.00 63.05 C ATOM 1229 NZ LYS A 145 -11.520 -2.632 54.915 1.00 75.91 N ATOM 1230 HZ1 LYS A 145 -12.272 -2.832 55.605 1.00 0.00 H ATOM 1231 HZ2 LYS A 145 -11.040 -1.746 55.171 1.00 0.00 H ATOM 1232 HZ3 LYS A 145 -11.935 -2.541 53.966 1.00 0.00 H ATOM 1233 H LYS A 145 -8.924 -8.249 58.007 1.00 0.00 H ATOM 1234 N SER A 146 -5.996 -6.042 59.597 1.00 20.97 N ATOM 1235 CA SER A 146 -5.480 -5.991 60.960 1.00 21.03 C ATOM 1236 C SER A 146 -4.771 -4.645 61.107 1.00 22.62 C ATOM 1237 O SER A 146 -4.009 -4.305 60.219 1.00 22.54 O ATOM 1238 CB SER A 146 -4.518 -7.142 61.251 1.00 22.41 C ATOM 1239 OG SER A 146 -4.137 -7.093 62.614 1.00 26.80 O ATOM 1240 HG SER A 146 -4.942 -7.179 63.184 1.00 0.00 H ATOM 1241 H SER A 146 -5.543 -5.448 58.873 1.00 0.00 H ATOM 1242 N PRO A 147 -4.994 -3.852 62.182 1.00 21.33 N ATOM 1243 CA PRO A 147 -5.829 -4.130 63.375 1.00 21.50 C ATOM 1244 C PRO A 147 -7.350 -4.115 63.208 1.00 27.11 C ATOM 1245 O PRO A 147 -8.041 -4.617 64.097 1.00 26.77 O ATOM 1246 CB PRO A 147 -5.393 -3.039 64.360 1.00 23.81 C ATOM 1247 CG PRO A 147 -4.985 -1.880 63.476 1.00 27.55 C ATOM 1248 CD PRO A 147 -4.284 -2.557 62.316 1.00 22.75 C ATOM 1249 N GLN A 148 -7.875 -3.553 62.108 1.00 25.14 N ATOM 1250 CA GLN A 148 -9.322 -3.508 61.884 1.00 26.96 C ATOM 1251 C GLN A 148 -9.890 -4.918 61.657 1.00 30.80 C ATOM 1252 O GLN A 148 -9.299 -5.705 60.919 1.00 28.41 O ATOM 1253 CB GLN A 148 -9.622 -2.582 60.703 1.00 29.27 C ATOM 1254 CG GLN A 148 -11.081 -2.362 60.369 1.00 47.74 C ATOM 1255 CD GLN A 148 -11.167 -1.688 59.025 1.00 65.85 C ATOM 1256 OE1 GLN A 148 -10.297 -0.892 58.626 1.00 55.87 O ATOM 1257 NE2 GLN A 148 -12.206 -2.012 58.287 1.00 63.56 N ATOM 1258 HE22 GLN A 148 -12.914 -2.681 58.651 1.00 0.00 H ATOM 1259 HE21 GLN A 148 -12.319 -1.600 57.339 1.00 0.00 H ATOM 1260 H GLN A 148 -7.239 -3.139 61.397 1.00 0.00 H ATOM 1261 N VAL A 149 -10.998 -5.254 62.326 1.00 29.00 N ATOM 1262 CA VAL A 149 -11.625 -6.569 62.158 1.00 29.68 C ATOM 1263 C VAL A 149 -12.572 -6.499 60.963 1.00 33.12 C ATOM 1264 O VAL A 149 -13.512 -5.706 60.964 1.00 33.24 O ATOM 1265 CB VAL A 149 -12.288 -7.079 63.468 1.00 33.73 C ATOM 1266 CG1 VAL A 149 -13.145 -8.326 63.223 1.00 33.50 C ATOM 1267 CG2 VAL A 149 -11.233 -7.359 64.530 1.00 33.51 C ATOM 1268 H VAL A 149 -11.425 -4.567 62.980 1.00 0.00 H ATOM 1269 N HIS A 150 -12.278 -7.281 59.918 1.00 29.00 N ATOM 1270 CA HIS A 150 -13.082 -7.333 58.705 1.00 29.41 C ATOM 1271 C HIS A 150 -13.092 -8.763 58.165 1.00 30.29 C ATOM 1272 O HIS A 150 -12.091 -9.221 57.610 1.00 29.53 O ATOM 1273 CB HIS A 150 -12.594 -6.327 57.630 1.00 31.60 C ATOM 1274 CG HIS A 150 -13.318 -6.483 56.324 1.00 36.37 C ATOM 1275 ND1 HIS A 150 -12.764 -7.203 55.284 1.00 38.91 N ATOM 1276 CD2 HIS A 150 -14.582 -6.134 55.984 1.00 39.46 C ATOM 1277 CE1 HIS A 150 -13.665 -7.198 54.313 1.00 39.04 C ATOM 1278 NE2 HIS A 150 -14.785 -6.587 54.695 1.00 39.66 N ATOM 1279 H HIS A 150 -11.432 -7.883 59.975 1.00 0.00 H ATOM 1280 N PHE A 151 -14.223 -9.458 58.340 1.00 26.16 N ATOM 1281 CA PHE A 151 -14.361 -10.832 57.881 1.00 24.59 C ATOM 1282 C PHE A 151 -14.682 -10.919 56.400 1.00 28.50 C ATOM 1283 O PHE A 151 -15.389 -10.051 55.880 1.00 27.94 O ATOM 1284 CB PHE A 151 -15.358 -11.615 58.742 1.00 25.55 C ATOM 1285 CG PHE A 151 -14.865 -11.751 60.166 1.00 26.74 C ATOM 1286 CD1 PHE A 151 -13.771 -12.554 60.468 1.00 28.39 C ATOM 1287 CD2 PHE A 151 -15.465 -11.034 61.201 1.00 27.60 C ATOM 1288 CE1 PHE A 151 -13.289 -12.647 61.777 1.00 28.97 C ATOM 1289 CE2 PHE A 151 -15.003 -11.158 62.519 1.00 30.39 C ATOM 1290 CZ PHE A 151 -13.903 -11.946 62.796 1.00 28.52 C ATOM 1291 H PHE A 151 -15.026 -9.002 58.818 1.00 0.00 H ATOM 1292 N PRO A 152 -14.155 -11.941 55.679 1.00 24.57 N ATOM 1293 CA PRO A 152 -14.467 -12.050 54.244 1.00 23.71 C ATOM 1294 C PRO A 152 -15.840 -12.679 54.031 1.00 27.91 C ATOM 1295 O PRO A 152 -16.460 -13.192 54.971 1.00 27.98 O ATOM 1296 CB PRO A 152 -13.374 -13.003 53.731 1.00 24.19 C ATOM 1297 CG PRO A 152 -13.146 -13.937 54.904 1.00 27.51 C ATOM 1298 CD PRO A 152 -13.295 -13.062 56.134 1.00 24.04 C ATOM 1299 N LYS A 153 -16.278 -12.715 52.761 1.00 24.43 N ATOM 1300 CA LYS A 153 -17.522 -13.380 52.419 1.00 24.18 C ATOM 1301 C LYS A 153 -17.259 -14.847 52.183 1.00 25.85 C ATOM 1302 O LYS A 153 -18.120 -15.682 52.473 1.00 26.27 O ATOM 1303 CB LYS A 153 -18.169 -12.755 51.186 1.00 27.83 C ATOM 1304 CG LYS A 153 -18.931 -11.475 51.522 1.00 41.48 C ATOM 1305 CD LYS A 153 -19.673 -10.904 50.345 1.00 55.51 C ATOM 1306 CE LYS A 153 -19.024 -9.662 49.773 1.00 66.90 C ATOM 1307 NZ LYS A 153 -19.914 -8.971 48.793 1.00 75.86 N ATOM 1308 HZ1 LYS A 153 -20.131 -9.617 48.008 1.00 0.00 H ATOM 1309 HZ2 LYS A 153 -20.797 -8.690 49.266 1.00 0.00 H ATOM 1310 HZ3 LYS A 153 -19.432 -8.126 48.425 1.00 0.00 H ATOM 1311 H LYS A 153 -15.718 -12.260 52.012 1.00 0.00 H ATOM 1312 N VAL A 154 -16.075 -15.174 51.627 1.00 22.75 N ATOM 1313 CA VAL A 154 -15.715 -16.550 51.282 1.00 21.37 C ATOM 1314 C VAL A 154 -14.312 -16.938 51.762 1.00 22.84 C ATOM 1315 O VAL A 154 -13.521 -16.073 52.120 1.00 22.23 O ATOM 1316 CB VAL A 154 -15.875 -16.810 49.758 1.00 25.51 C ATOM 1317 CG1 VAL A 154 -17.331 -16.561 49.288 1.00 25.90 C ATOM 1318 CG2 VAL A 154 -14.868 -15.998 48.937 1.00 24.89 C ATOM 1319 H VAL A 154 -15.389 -14.417 51.435 1.00 0.00 H ATOM 1320 N LEU A 155 -13.993 -18.244 51.678 1.00 21.80 N ATOM 1321 CA LEU A 155 -12.692 -18.783 52.067 1.00 19.56 C ATOM 1322 C LEU A 155 -11.541 -18.095 51.324 1.00 21.90 C ATOM 1323 O LEU A 155 -11.573 -17.997 50.102 1.00 20.87 O ATOM 1324 CB LEU A 155 -12.635 -20.308 51.883 1.00 19.28 C ATOM 1325 CG LEU A 155 -11.338 -20.982 52.442 1.00 22.63 C ATOM 1326 CD1 LEU A 155 -11.313 -20.959 53.974 1.00 21.17 C ATOM 1327 CD2 LEU A 155 -11.169 -22.391 51.891 1.00 24.29 C ATOM 1328 H LEU A 155 -14.711 -18.904 51.317 1.00 0.00 H ATOM 1329 N GLN A 156 -10.513 -17.653 52.076 1.00 16.43 N ATOM 1330 CA GLN A 156 -9.347 -16.946 51.531 1.00 16.13 C ATOM 1331 C GLN A 156 -8.122 -17.862 51.532 1.00 19.43 C ATOM 1332 O GLN A 156 -7.985 -18.657 52.455 1.00 18.98 O ATOM 1333 CB GLN A 156 -9.026 -15.703 52.377 1.00 16.70 C ATOM 1334 CG GLN A 156 -10.168 -14.679 52.487 1.00 16.56 C ATOM 1335 CD GLN A 156 -10.449 -14.016 51.154 1.00 22.36 C ATOM 1336 OE1 GLN A 156 -9.649 -13.232 50.649 1.00 19.64 O ATOM 1337 NE2 GLN A 156 -11.580 -14.364 50.538 1.00 22.99 N ATOM 1338 HE22 GLN A 156 -12.236 -15.030 50.993 1.00 0.00 H ATOM 1339 HE21 GLN A 156 -11.806 -13.969 49.603 1.00 0.00 H ATOM 1340 H GLN A 156 -10.548 -17.823 53.101 1.00 0.00 H ATOM 1341 N CYS A 157 -7.263 -17.753 50.513 1.00 18.96 N ATOM 1342 CA CYS A 157 -6.046 -18.558 50.298 1.00 20.56 C ATOM 1343 C CYS A 157 -4.855 -17.612 50.159 1.00 23.26 C ATOM 1344 O CYS A 157 -4.980 -16.549 49.555 1.00 22.08 O ATOM 1345 CB CYS A 157 -6.201 -19.436 49.047 1.00 21.86 C ATOM 1346 SG CYS A 157 -7.262 -20.895 49.291 1.00 26.77 S ATOM 1347 H CYS A 157 -7.475 -17.027 49.799 1.00 0.00 H ATOM 1348 N LEU A 158 -3.703 -17.985 50.705 1.00 19.78 N ATOM 1349 CA LEU A 158 -2.496 -17.153 50.611 1.00 17.95 C ATOM 1350 C LEU A 158 -1.257 -18.046 50.601 1.00 19.23 C ATOM 1351 O LEU A 158 -1.187 -18.994 51.399 1.00 17.51 O ATOM 1352 CB LEU A 158 -2.436 -16.211 51.841 1.00 18.21 C ATOM 1353 CG LEU A 158 -1.088 -15.501 52.143 1.00 21.40 C ATOM 1354 CD1 LEU A 158 -0.795 -14.431 51.083 1.00 21.57 C ATOM 1355 CD2 LEU A 158 -1.083 -14.876 53.588 1.00 22.22 C ATOM 1356 H LEU A 158 -3.654 -18.891 51.213 1.00 0.00 H ATOM 1357 N ASN A 159 -0.299 -17.750 49.700 1.00 17.28 N ATOM 1358 CA ASN A 159 0.967 -18.472 49.680 1.00 16.79 C ATOM 1359 C ASN A 159 1.946 -17.798 50.604 1.00 21.20 C ATOM 1360 O ASN A 159 2.072 -16.564 50.609 1.00 20.35 O ATOM 1361 CB ASN A 159 1.553 -18.588 48.269 1.00 16.70 C ATOM 1362 CG ASN A 159 0.900 -19.652 47.439 1.00 31.31 C ATOM 1363 OD1 ASN A 159 0.716 -20.798 47.866 1.00 24.11 O ATOM 1364 ND2 ASN A 159 0.541 -19.292 46.216 1.00 28.05 N ATOM 1365 HD22 ASN A 159 0.711 -18.319 45.889 1.00 0.00 H ATOM 1366 HD21 ASN A 159 0.089 -19.982 45.582 1.00 0.00 H ATOM 1367 H ASN A 159 -0.466 -16.993 49.007 1.00 0.00 H ATOM 1368 N ILE A 160 2.635 -18.614 51.402 1.00 17.97 N ATOM 1369 CA ILE A 160 3.629 -18.187 52.369 1.00 17.84 C ATOM 1370 C ILE A 160 4.835 -19.132 52.276 1.00 23.14 C ATOM 1371 O ILE A 160 4.665 -20.323 51.993 1.00 23.90 O ATOM 1372 CB ILE A 160 3.045 -18.139 53.806 1.00 21.19 C ATOM 1373 CG1 ILE A 160 2.475 -19.517 54.249 1.00 21.30 C ATOM 1374 CG2 ILE A 160 1.996 -16.971 53.975 1.00 21.89 C ATOM 1375 CD1 ILE A 160 1.906 -19.583 55.682 1.00 21.12 C ATOM 1376 H ILE A 160 2.446 -19.634 51.326 1.00 0.00 H ATOM 1377 N SER A 161 6.040 -18.603 52.524 1.00 21.20 N ATOM 1378 CA SER A 161 7.264 -19.395 52.453 1.00 20.83 C ATOM 1379 C SER A 161 7.793 -19.698 53.858 1.00 22.83 C ATOM 1380 O SER A 161 7.774 -18.837 54.741 1.00 19.39 O ATOM 1381 CB SER A 161 8.323 -18.683 51.612 1.00 28.30 C ATOM 1382 OG SER A 161 7.995 -18.805 50.240 1.00 44.62 O ATOM 1383 HG SER A 161 8.681 -18.344 49.696 1.00 0.00 H ATOM 1384 H SER A 161 6.106 -17.596 52.775 1.00 0.00 H ATOM 1385 N VAL A 162 8.247 -20.942 54.047 1.00 20.16 N ATOM 1386 CA VAL A 162 8.781 -21.447 55.328 1.00 21.38 C ATOM 1387 C VAL A 162 10.107 -20.759 55.614 1.00 26.49 C ATOM 1388 O VAL A 162 10.960 -20.686 54.734 1.00 24.77 O ATOM 1389 CB VAL A 162 8.896 -23.001 55.329 1.00 24.28 C ATOM 1390 CG1 VAL A 162 9.634 -23.529 56.582 1.00 23.35 C ATOM 1391 CG2 VAL A 162 7.532 -23.668 55.173 1.00 23.76 C ATOM 1392 H VAL A 162 8.222 -21.596 53.239 1.00 0.00 H ATOM 1393 N LEU A 163 10.250 -20.197 56.816 1.00 25.11 N ATOM 1394 CA LEU A 163 11.489 -19.528 57.211 1.00 27.01 C ATOM 1395 C LEU A 163 12.361 -20.553 57.929 1.00 29.37 C ATOM 1396 O LEU A 163 11.842 -21.530 58.489 1.00 26.64 O ATOM 1397 CB LEU A 163 11.183 -18.380 58.177 1.00 27.49 C ATOM 1398 CG LEU A 163 10.799 -17.019 57.618 1.00 33.68 C ATOM 1399 CD1 LEU A 163 9.358 -16.967 57.155 1.00 33.25 C ATOM 1400 CD2 LEU A 163 10.946 -15.952 58.688 1.00 36.90 C ATOM 1401 H LEU A 163 9.459 -20.236 57.490 1.00 0.00 H ATOM 1402 N SER A 164 13.679 -20.329 57.932 1.00 27.67 N ATOM 1403 CA SER A 164 14.618 -21.183 58.678 1.00 27.80 C ATOM 1404 C SER A 164 14.325 -21.024 60.184 1.00 32.98 C ATOM 1405 O SER A 164 13.898 -19.943 60.613 1.00 30.95 O ATOM 1406 CB SER A 164 16.058 -20.739 58.416 1.00 29.30 C ATOM 1407 OG SER A 164 16.253 -19.428 58.917 1.00 31.12 O ATOM 1408 HG SER A 164 16.079 -19.419 59.891 1.00 0.00 H ATOM 1409 H SER A 164 14.053 -19.525 57.389 1.00 0.00 H ATOM 1410 N GLN A 165 14.566 -22.080 60.975 1.00 32.54 N ATOM 1411 CA GLN A 165 14.341 -22.045 62.427 1.00 33.41 C ATOM 1412 C GLN A 165 15.122 -20.910 63.124 1.00 40.12 C ATOM 1413 O GLN A 165 14.615 -20.338 64.096 1.00 39.98 O ATOM 1414 CB GLN A 165 14.600 -23.420 63.076 1.00 34.89 C ATOM 1415 CG GLN A 165 13.708 -23.723 64.296 1.00 41.46 C ATOM 1416 CD GLN A 165 12.199 -23.836 64.049 1.00 53.00 C ATOM 1417 OE1 GLN A 165 11.686 -23.666 62.931 1.00 43.39 O ATOM 1418 NE2 GLN A 165 11.445 -24.139 65.110 1.00 38.50 N ATOM 1419 HE22 GLN A 165 11.888 -24.279 66.040 1.00 0.00 H ATOM 1420 HE21 GLN A 165 10.415 -24.235 65.005 1.00 0.00 H ATOM 1421 H GLN A 165 14.925 -22.956 60.545 1.00 0.00 H ATOM 1422 N LYS A 166 16.300 -20.520 62.562 1.00 36.74 N ATOM 1423 CA LYS A 166 17.138 -19.412 63.033 1.00 36.02 C ATOM 1424 C LYS A 166 16.411 -18.076 62.843 1.00 37.92 C ATOM 1425 O LYS A 166 16.351 -17.291 63.786 1.00 36.67 O ATOM 1426 CB LYS A 166 18.504 -19.406 62.309 1.00 38.70 C ATOM 1427 CG LYS A 166 19.484 -18.327 62.789 1.00 55.99 C ATOM 1428 CD LYS A 166 20.271 -18.742 64.040 1.00 73.38 C ATOM 1429 CE LYS A 166 21.222 -17.653 64.486 1.00 90.42 C ATOM 1430 NZ LYS A 166 21.960 -18.028 65.714 1.00100.45 N ATOM 1431 HZ1 LYS A 166 21.283 -18.204 66.484 1.00 0.00 H ATOM 1432 HZ2 LYS A 166 22.514 -18.890 65.535 1.00 0.00 H ATOM 1433 HZ3 LYS A 166 22.599 -17.253 65.983 1.00 0.00 H ATOM 1434 H LYS A 166 16.632 -21.051 61.732 1.00 0.00 H ATOM 1435 N ARG A 167 15.845 -17.820 61.639 1.00 33.01 N ATOM 1436 CA ARG A 167 15.082 -16.599 61.363 1.00 32.16 C ATOM 1437 C ARG A 167 13.810 -16.560 62.225 1.00 35.00 C ATOM 1438 O ARG A 167 13.433 -15.477 62.674 1.00 35.69 O ATOM 1439 CB ARG A 167 14.752 -16.438 59.871 1.00 29.83 C ATOM 1440 CG ARG A 167 15.967 -16.061 59.028 1.00 45.67 C ATOM 1441 CD ARG A 167 15.605 -15.639 57.611 1.00 60.94 C ATOM 1442 NE ARG A 167 14.895 -14.363 57.592 1.00 71.83 N ATOM 1443 CZ ARG A 167 13.988 -14.022 56.687 1.00 83.79 C ATOM 1444 NH1 ARG A 167 13.378 -12.845 56.761 1.00 65.88 N ATOM 1445 NH2 ARG A 167 13.658 -14.866 55.710 1.00 70.94 N ATOM 1446 HE ARG A 167 15.116 -13.675 58.340 1.00 0.00 H ATOM 1447 HH12 ARG A 167 12.667 -12.582 56.049 1.00 0.00 H ATOM 1448 HH11 ARG A 167 13.611 -12.186 57.531 1.00 0.00 H ATOM 1449 HH22 ARG A 167 12.946 -14.591 55.004 1.00 0.00 H ATOM 1450 HH21 ARG A 167 14.113 -15.800 55.654 1.00 0.00 H ATOM 1451 H ARG A 167 15.957 -18.520 60.878 1.00 0.00 H ATOM 1452 N CYS A 168 13.185 -17.741 62.489 1.00 29.66 N ATOM 1453 CA CYS A 168 11.996 -17.862 63.356 1.00 28.19 C ATOM 1454 C CYS A 168 12.350 -17.465 64.817 1.00 33.38 C ATOM 1455 O CYS A 168 11.640 -16.659 65.426 1.00 30.69 O ATOM 1456 CB CYS A 168 11.390 -19.264 63.271 1.00 26.56 C ATOM 1457 SG CYS A 168 9.724 -19.404 63.977 1.00 29.04 S ATOM 1458 H CYS A 168 13.567 -18.606 62.056 1.00 0.00 H ATOM 1459 N GLU A 169 13.495 -17.980 65.336 1.00 34.15 N ATOM 1460 CA GLU A 169 14.024 -17.679 66.679 1.00 35.10 C ATOM 1461 C GLU A 169 14.340 -16.179 66.826 1.00 39.55 C ATOM 1462 O GLU A 169 13.981 -15.598 67.840 1.00 39.73 O ATOM 1463 CB GLU A 169 15.259 -18.555 66.992 1.00 37.27 C ATOM 1464 CG GLU A 169 15.895 -18.338 68.364 1.00 51.62 C ATOM 1465 CD GLU A 169 15.075 -18.684 69.596 1.00 75.88 C ATOM 1466 OE1 GLU A 169 14.166 -19.542 69.504 1.00 75.65 O ATOM 1467 OE2 GLU A 169 15.402 -18.145 70.677 1.00 69.27 O ATOM 1468 H GLU A 169 14.040 -18.636 64.741 1.00 0.00 H ATOM 1469 N ASP A 170 14.958 -15.551 65.802 1.00 36.20 N ATOM 1470 CA ASP A 170 15.284 -14.119 65.775 1.00 36.06 C ATOM 1471 C ASP A 170 14.034 -13.243 65.850 1.00 37.00 C ATOM 1472 O ASP A 170 14.069 -12.187 66.484 1.00 35.64 O ATOM 1473 CB ASP A 170 16.067 -13.766 64.497 1.00 39.07 C ATOM 1474 CG ASP A 170 17.481 -14.305 64.405 1.00 57.08 C ATOM 1475 OD1 ASP A 170 18.041 -14.708 65.458 1.00 58.37 O ATOM 1476 OD2 ASP A 170 18.041 -14.302 63.283 1.00 65.34 O ATOM 1477 H ASP A 170 15.222 -16.122 64.974 1.00 0.00 H ATOM 1478 N ALA A 171 12.926 -13.671 65.180 1.00 30.87 N ATOM 1479 CA ALA A 171 11.667 -12.928 65.173 1.00 29.41 C ATOM 1480 C ALA A 171 10.964 -13.002 66.525 1.00 31.35 C ATOM 1481 O ALA A 171 10.401 -12.006 66.959 1.00 32.18 O ATOM 1482 CB ALA A 171 10.744 -13.445 64.072 1.00 29.79 C ATOM 1483 H ALA A 171 12.979 -14.565 64.651 1.00 0.00 H ATOM 1484 N TYR A 172 10.987 -14.166 67.174 1.00 27.11 N ATOM 1485 CA TYR A 172 10.322 -14.380 68.464 1.00 26.47 C ATOM 1486 C TYR A 172 11.312 -14.977 69.458 1.00 31.58 C ATOM 1487 O TYR A 172 11.229 -16.181 69.755 1.00 30.29 O ATOM 1488 CB TYR A 172 9.090 -15.286 68.286 1.00 25.86 C ATOM 1489 CG TYR A 172 8.087 -14.731 67.301 1.00 24.83 C ATOM 1490 CD1 TYR A 172 7.182 -13.743 67.683 1.00 25.82 C ATOM 1491 CD2 TYR A 172 8.068 -15.163 65.977 1.00 23.96 C ATOM 1492 CE1 TYR A 172 6.267 -13.215 66.777 1.00 25.61 C ATOM 1493 CE2 TYR A 172 7.173 -14.623 65.055 1.00 23.52 C ATOM 1494 CZ TYR A 172 6.271 -13.652 65.460 1.00 28.12 C ATOM 1495 OH TYR A 172 5.360 -13.140 64.568 1.00 26.28 O ATOM 1496 HH TYR A 172 4.786 -13.871 64.228 1.00 0.00 H ATOM 1497 H TYR A 172 11.502 -14.961 66.745 1.00 0.00 H ATOM 1498 N PRO A 173 12.297 -14.165 69.942 1.00 30.51 N ATOM 1499 CA PRO A 173 13.320 -14.720 70.839 1.00 30.79 C ATOM 1500 C PRO A 173 12.761 -15.368 72.094 1.00 33.55 C ATOM 1501 O PRO A 173 11.897 -14.799 72.754 1.00 31.46 O ATOM 1502 CB PRO A 173 14.258 -13.537 71.126 1.00 32.65 C ATOM 1503 CG PRO A 173 13.540 -12.335 70.719 1.00 36.99 C ATOM 1504 CD PRO A 173 12.550 -12.735 69.662 1.00 32.31 C ATOM 1505 N ARG A 174 13.233 -16.608 72.363 1.00 32.24 N ATOM 1506 CA ARG A 174 12.876 -17.457 73.516 1.00 33.01 C ATOM 1507 C ARG A 174 11.371 -17.823 73.568 1.00 36.56 C ATOM 1508 O ARG A 174 10.848 -18.197 74.622 1.00 36.41 O ATOM 1509 CB ARG A 174 13.352 -16.830 74.848 1.00 34.57 C ATOM 1510 CG ARG A 174 14.818 -16.365 74.853 1.00 46.06 C ATOM 1511 CD ARG A 174 15.141 -15.434 76.014 1.00 56.55 C ATOM 1512 NE ARG A 174 14.331 -14.212 75.999 1.00 63.12 N ATOM 1513 CZ ARG A 174 14.640 -13.095 75.346 1.00 72.74 C ATOM 1514 NH1 ARG A 174 13.834 -12.048 75.399 1.00 60.02 N ATOM 1515 NH2 ARG A 174 15.774 -13.009 74.659 1.00 53.95 N ATOM 1516 HE ARG A 174 13.444 -14.219 76.542 1.00 0.00 H ATOM 1517 HH12 ARG A 174 14.079 -11.177 74.887 1.00 0.00 H ATOM 1518 HH11 ARG A 174 12.955 -12.096 75.953 1.00 0.00 H ATOM 1519 HH22 ARG A 174 16.009 -12.133 74.151 1.00 0.00 H ATOM 1520 HH21 ARG A 174 16.427 -13.818 74.629 1.00 0.00 H ATOM 1521 H ARG A 174 13.918 -17.003 71.687 1.00 0.00 H ATOM 1522 N GLN A 174A 10.689 -17.743 72.414 1.00 31.61 N ATOM 1523 CA GLN A 174A 9.256 -18.054 72.311 1.00 30.00 C ATOM 1524 C GLN A 174A 9.006 -19.258 71.403 1.00 33.43 C ATOM 1525 O GLN A 174A 7.888 -19.780 71.354 1.00 31.58 O ATOM 1526 CB GLN A 174A 8.498 -16.836 71.758 1.00 29.96 C ATOM 1527 CG GLN A 174A 8.519 -15.620 72.672 1.00 38.45 C ATOM 1528 CD GLN A 174A 8.189 -14.359 71.917 1.00 48.96 C ATOM 1529 OE1 GLN A 174A 7.047 -14.115 71.512 1.00 42.89 O ATOM 1530 NE2 GLN A 174A 9.191 -13.537 71.687 1.00 42.00 N ATOM 1531 HE22 GLN A 174A 10.143 -13.766 72.039 1.00 0.00 H ATOM 1532 HE21 GLN A 174A 9.031 -12.659 71.153 1.00 0.00 H ATOM 1533 H GLN A 174A 11.197 -17.448 71.556 1.00 0.00 H ATOM 1534 N ILE A 176 10.047 -19.688 70.686 1.00 28.67 N ATOM 1535 CA ILE A 176 9.999 -20.748 69.683 1.00 29.25 C ATOM 1536 C ILE A 176 10.637 -22.062 70.134 1.00 32.18 C ATOM 1537 O ILE A 176 11.687 -22.064 70.781 1.00 33.00 O ATOM 1538 CB ILE A 176 10.664 -20.199 68.361 1.00 32.63 C ATOM 1539 CG1 ILE A 176 9.969 -18.897 67.847 1.00 33.06 C ATOM 1540 CG2 ILE A 176 10.808 -21.248 67.226 1.00 34.23 C ATOM 1541 CD1 ILE A 176 8.426 -18.982 67.460 1.00 33.83 C ATOM 1542 H ILE A 176 10.966 -19.231 70.856 1.00 0.00 H ATOM 1543 N ASP A 177 10.021 -23.174 69.734 1.00 26.14 N ATOM 1544 CA ASP A 177 10.546 -24.524 69.891 1.00 24.93 C ATOM 1545 C ASP A 177 10.261 -25.329 68.616 1.00 29.11 C ATOM 1546 O ASP A 177 9.545 -24.835 67.723 1.00 27.59 O ATOM 1547 CB ASP A 177 10.078 -25.216 71.184 1.00 26.38 C ATOM 1548 CG ASP A 177 8.612 -25.596 71.254 1.00 32.37 C ATOM 1549 OD1 ASP A 177 7.984 -25.739 70.189 1.00 30.76 O ATOM 1550 OD2 ASP A 177 8.124 -25.842 72.365 1.00 33.15 O ATOM 1551 H ASP A 177 9.094 -23.070 69.274 1.00 0.00 H ATOM 1552 N ASP A 178 10.786 -26.563 68.536 1.00 26.35 N ATOM 1553 CA ASP A 178 10.629 -27.452 67.364 1.00 27.52 C ATOM 1554 C ASP A 178 9.188 -27.868 67.057 1.00 28.03 C ATOM 1555 O ASP A 178 8.953 -28.493 66.021 1.00 27.98 O ATOM 1556 CB ASP A 178 11.524 -28.702 67.492 1.00 30.73 C ATOM 1557 CG ASP A 178 13.021 -28.451 67.581 1.00 51.28 C ATOM 1558 OD1 ASP A 178 13.469 -27.340 67.198 1.00 52.35 O ATOM 1559 OD2 ASP A 178 13.752 -29.381 67.996 1.00 62.15 O ATOM 1560 H ASP A 178 11.335 -26.914 69.346 1.00 0.00 H ATOM 1561 N THR A 179 8.214 -27.541 67.944 1.00 22.16 N ATOM 1562 CA THR A 179 6.812 -27.897 67.670 1.00 19.97 C ATOM 1563 C THR A 179 6.144 -26.802 66.807 1.00 22.04 C ATOM 1564 O THR A 179 4.946 -26.879 66.531 1.00 19.31 O ATOM 1565 CB THR A 179 5.989 -28.118 68.970 1.00 23.99 C ATOM 1566 OG1 THR A 179 5.700 -26.863 69.575 1.00 23.78 O ATOM 1567 CG2 THR A 179 6.674 -29.078 69.971 1.00 26.72 C ATOM 1568 HG1 THR A 179 6.548 -26.402 69.797 1.00 0.00 H ATOM 1569 H THR A 179 8.459 -27.037 68.820 1.00 0.00 H ATOM 1570 N MET A 180 6.922 -25.783 66.430 1.00 18.58 N ATOM 1571 CA MET A 180 6.471 -24.648 65.644 1.00 18.41 C ATOM 1572 C MET A 180 7.415 -24.381 64.462 1.00 23.01 C ATOM 1573 O MET A 180 8.614 -24.707 64.523 1.00 23.03 O ATOM 1574 CB MET A 180 6.497 -23.377 66.515 1.00 20.00 C ATOM 1575 CG MET A 180 5.863 -23.503 67.877 1.00 22.69 C ATOM 1576 SD MET A 180 6.280 -22.031 68.835 1.00 24.36 S ATOM 1577 CE MET A 180 5.781 -22.563 70.469 1.00 22.02 C ATOM 1578 H MET A 180 7.921 -25.804 66.720 1.00 0.00 H ATOM 1579 N PHE A 181 6.884 -23.745 63.408 1.00 20.11 N ATOM 1580 CA PHE A 181 7.675 -23.219 62.293 1.00 18.82 C ATOM 1581 C PHE A 181 7.141 -21.836 61.927 1.00 23.21 C ATOM 1582 O PHE A 181 5.959 -21.579 62.115 1.00 21.19 O ATOM 1583 CB PHE A 181 7.752 -24.167 61.079 1.00 19.41 C ATOM 1584 CG PHE A 181 6.495 -24.366 60.249 1.00 18.93 C ATOM 1585 CD1 PHE A 181 6.235 -23.560 59.149 1.00 21.32 C ATOM 1586 CD2 PHE A 181 5.622 -25.412 60.516 1.00 20.44 C ATOM 1587 CE1 PHE A 181 5.127 -23.787 58.338 1.00 21.82 C ATOM 1588 CE2 PHE A 181 4.478 -25.605 59.730 1.00 22.54 C ATOM 1589 CZ PHE A 181 4.249 -24.792 58.633 1.00 21.09 C ATOM 1590 H PHE A 181 5.852 -23.618 63.380 1.00 0.00 H ATOM 1591 N CYS A 182 8.007 -20.961 61.400 1.00 20.54 N ATOM 1592 CA CYS A 182 7.625 -19.620 60.957 1.00 21.43 C ATOM 1593 C CYS A 182 7.438 -19.698 59.494 1.00 22.69 C ATOM 1594 O CYS A 182 8.194 -20.396 58.814 1.00 21.53 O ATOM 1595 CB CYS A 182 8.673 -18.567 61.304 1.00 23.05 C ATOM 1596 SG CYS A 182 8.609 -17.988 63.017 1.00 27.52 S ATOM 1597 H CYS A 182 9.001 -21.249 61.301 1.00 0.00 H ATOM 1598 N ALA A 183 6.462 -18.946 58.987 1.00 18.67 N ATOM 1599 CA ALA A 183 6.205 -18.915 57.556 1.00 18.77 C ATOM 1600 C ALA A 183 5.558 -17.602 57.180 1.00 19.61 C ATOM 1601 O ALA A 183 4.716 -17.055 57.917 1.00 18.74 O ATOM 1602 CB ALA A 183 5.315 -20.094 57.152 1.00 19.88 C ATOM 1603 H ALA A 183 5.875 -18.372 59.625 1.00 0.00 H ATOM 1604 N GLY A 184 5.958 -17.104 56.034 1.00 18.34 N ATOM 1605 CA GLY A 184 5.393 -15.876 55.497 1.00 19.99 C ATOM 1606 C GLY A 184 6.355 -14.749 55.703 1.00 29.96 C ATOM 1607 O GLY A 184 6.339 -14.089 56.749 1.00 28.38 O ATOM 1608 H GLY A 184 6.697 -17.600 55.496 1.00 0.00 H ATOM 1609 N ASP A 185 7.180 -14.539 54.682 1.00 28.53 N ATOM 1610 CA ASP A 185 8.268 -13.571 54.668 1.00 30.73 C ATOM 1611 C ASP A 185 7.915 -12.181 54.130 1.00 36.40 C ATOM 1612 O ASP A 185 8.735 -11.265 54.256 1.00 37.46 O ATOM 1613 CB ASP A 185 9.401 -14.182 53.820 1.00 33.38 C ATOM 1614 CG ASP A 185 10.774 -13.925 54.349 1.00 50.02 C ATOM 1615 OD1 ASP A 185 10.900 -13.669 55.568 1.00 50.07 O ATOM 1616 OD2 ASP A 185 11.735 -14.018 53.555 1.00 58.31 O ATOM 1617 H ASP A 185 7.037 -15.111 53.825 1.00 0.00 H ATOM 1618 N LYS A 186 6.715 -12.015 53.540 1.00 31.63 N ATOM 1619 CA LYS A 186 6.345 -10.751 52.909 1.00 31.00 C ATOM 1620 C LYS A 186 5.431 -9.887 53.740 1.00 35.21 C ATOM 1621 O LYS A 186 4.302 -10.290 54.047 1.00 33.71 O ATOM 1622 CB LYS A 186 5.736 -10.983 51.522 1.00 33.94 C ATOM 1623 CG LYS A 186 6.505 -11.959 50.625 1.00 52.73 C ATOM 1624 CD LYS A 186 7.898 -11.475 50.210 1.00 66.20 C ATOM 1625 CE LYS A 186 8.714 -12.623 49.652 1.00 78.80 C ATOM 1626 NZ LYS A 186 10.075 -12.188 49.258 1.00 89.79 N ATOM 1627 HZ1 LYS A 186 10.004 -11.451 48.528 1.00 0.00 H ATOM 1628 HZ2 LYS A 186 10.570 -11.808 50.090 1.00 0.00 H ATOM 1629 HZ3 LYS A 186 10.602 -13.001 48.881 1.00 0.00 H ATOM 1630 H LYS A 186 6.038 -12.804 53.534 1.00 0.00 H ATOM 1631 N ALA A 186A 5.889 -8.650 54.032 1.00 31.39 N ATOM 1632 CA ALA A 186A 5.110 -7.660 54.774 1.00 31.58 C ATOM 1633 C ALA A 186A 3.760 -7.475 54.075 1.00 32.42 C ATOM 1634 O ALA A 186A 3.690 -7.510 52.846 1.00 31.80 O ATOM 1635 CB ALA A 186A 5.870 -6.338 54.801 1.00 33.27 C ATOM 1636 H ALA A 186A 6.844 -8.389 53.713 1.00 0.00 H ATOM 1637 N GLY A 187 2.702 -7.382 54.859 1.00 26.66 N ATOM 1638 CA GLY A 187 1.361 -7.206 54.345 1.00 25.60 C ATOM 1639 C GLY A 187 0.630 -8.498 54.058 1.00 25.47 C ATOM 1640 O GLY A 187 -0.547 -8.455 53.706 1.00 25.14 O ATOM 1641 H GLY A 187 2.838 -7.438 55.889 1.00 0.00 H ATOM 1642 N ARG A 188 1.305 -9.656 54.230 1.00 21.25 N ATOM 1643 CA ARG A 188 0.717 -10.968 53.999 1.00 20.02 C ATOM 1644 C ARG A 188 0.955 -11.864 55.207 1.00 21.81 C ATOM 1645 O ARG A 188 2.099 -12.036 55.649 1.00 22.48 O ATOM 1646 CB ARG A 188 1.275 -11.595 52.701 1.00 20.68 C ATOM 1647 CG ARG A 188 0.631 -11.014 51.436 1.00 26.31 C ATOM 1648 CD ARG A 188 1.286 -11.504 50.149 1.00 30.73 C ATOM 1649 NE ARG A 188 2.361 -10.614 49.709 1.00 41.49 N ATOM 1650 CZ ARG A 188 3.323 -10.953 48.852 1.00 52.38 C ATOM 1651 NH1 ARG A 188 3.437 -12.206 48.429 1.00 44.80 N ATOM 1652 NH2 ARG A 188 4.244 -10.068 48.500 1.00 31.61 N ATOM 1653 HE ARG A 188 2.375 -9.648 50.093 1.00 0.00 H ATOM 1654 HH12 ARG A 188 4.191 -12.462 47.760 1.00 0.00 H ATOM 1655 HH11 ARG A 188 2.773 -12.931 48.767 1.00 0.00 H ATOM 1656 HH22 ARG A 188 4.994 -10.336 47.831 1.00 0.00 H ATOM 1657 HH21 ARG A 188 4.217 -9.105 48.893 1.00 0.00 H ATOM 1658 H ARG A 188 2.295 -9.608 54.543 1.00 0.00 H ATOM 1659 N ASP A 189 -0.138 -12.407 55.757 1.00 19.03 N ATOM 1660 CA ASP A 189 -0.118 -13.259 56.965 1.00 17.82 C ATOM 1661 C ASP A 189 -1.485 -13.874 57.184 1.00 20.15 C ATOM 1662 O ASP A 189 -2.476 -13.474 56.547 1.00 18.60 O ATOM 1663 CB ASP A 189 0.206 -12.353 58.188 1.00 18.93 C ATOM 1664 CG ASP A 189 0.740 -12.991 59.480 1.00 19.11 C ATOM 1665 OD1 ASP A 189 0.960 -14.201 59.490 1.00 19.50 O ATOM 1666 OD2 ASP A 189 0.810 -12.276 60.512 1.00 22.72 O ATOM 1667 H ASP A 189 -1.057 -12.218 55.307 1.00 0.00 H ATOM 1668 N SER A 190 -1.557 -14.852 58.116 1.00 16.95 N ATOM 1669 CA SER A 190 -2.829 -15.385 58.584 1.00 16.45 C ATOM 1670 C SER A 190 -3.127 -14.444 59.767 1.00 18.78 C ATOM 1671 O SER A 190 -2.280 -13.598 60.097 1.00 17.80 O ATOM 1672 CB SER A 190 -2.715 -16.849 59.015 1.00 19.28 C ATOM 1673 OG SER A 190 -1.687 -17.014 59.975 1.00 18.64 O ATOM 1674 HG SER A 190 -0.823 -16.728 59.584 1.00 0.00 H ATOM 1675 H SER A 190 -0.675 -15.236 58.511 1.00 0.00 H ATOM 1676 N CYS A 191 -4.326 -14.497 60.327 1.00 16.45 N ATOM 1677 CA CYS A 191 -4.692 -13.561 61.393 1.00 16.83 C ATOM 1678 C CYS A 191 -5.790 -14.148 62.290 1.00 19.62 C ATOM 1679 O CYS A 191 -6.174 -15.314 62.110 1.00 17.29 O ATOM 1680 CB CYS A 191 -5.128 -12.246 60.743 1.00 18.00 C ATOM 1681 SG CYS A 191 -5.010 -10.806 61.832 1.00 20.65 S ATOM 1682 H CYS A 191 -5.013 -15.209 60.007 1.00 0.00 H ATOM 1683 N GLN A 192 -6.337 -13.357 63.216 1.00 19.22 N ATOM 1684 CA GLN A 192 -7.422 -13.840 64.094 1.00 18.71 C ATOM 1685 C GLN A 192 -8.630 -14.347 63.303 1.00 21.28 C ATOM 1686 O GLN A 192 -9.004 -13.780 62.272 1.00 19.44 O ATOM 1687 CB GLN A 192 -7.807 -12.842 65.221 1.00 22.16 C ATOM 1688 CG GLN A 192 -8.419 -11.537 64.875 1.00 36.71 C ATOM 1689 CD GLN A 192 -8.405 -10.580 66.040 1.00 36.68 C ATOM 1690 OE1 GLN A 192 -8.142 -9.433 65.817 1.00 34.35 O ATOM 1691 NE2 GLN A 192 -8.524 -11.040 67.295 1.00 23.00 N ATOM 1692 HE22 GLN A 192 -8.753 -12.041 67.463 1.00 0.00 H ATOM 1693 HE21 GLN A 192 -8.387 -10.396 68.100 1.00 0.00 H ATOM 1694 H GLN A 192 -5.992 -12.381 63.321 1.00 0.00 H ATOM 1695 N GLY A 193 -9.162 -15.488 63.757 1.00 17.83 N ATOM 1696 CA GLY A 193 -10.253 -16.167 63.076 1.00 19.17 C ATOM 1697 C GLY A 193 -9.721 -17.246 62.149 1.00 20.15 C ATOM 1698 O GLY A 193 -10.486 -18.109 61.736 1.00 20.20 O ATOM 1699 H GLY A 193 -8.781 -15.905 64.630 1.00 0.00 H ATOM 1700 N ASP A 194 -8.407 -17.230 61.840 1.00 16.00 N ATOM 1701 CA ASP A 194 -7.802 -18.270 60.971 1.00 15.75 C ATOM 1702 C ASP A 194 -7.294 -19.459 61.766 1.00 16.94 C ATOM 1703 O ASP A 194 -6.983 -20.497 61.166 1.00 15.90 O ATOM 1704 CB ASP A 194 -6.664 -17.711 60.121 1.00 17.47 C ATOM 1705 CG ASP A 194 -7.117 -16.732 59.072 1.00 18.45 C ATOM 1706 OD1 ASP A 194 -8.155 -16.991 58.432 1.00 17.83 O ATOM 1707 OD2 ASP A 194 -6.394 -15.767 58.832 1.00 20.62 O ATOM 1708 H ASP A 194 -7.805 -16.472 62.220 1.00 0.00 H ATOM 1709 N SER A 195 -7.192 -19.310 63.102 1.00 15.01 N ATOM 1710 CA SER A 195 -6.702 -20.361 64.016 1.00 13.93 C ATOM 1711 C SER A 195 -7.147 -21.783 63.653 1.00 17.93 C ATOM 1712 O SER A 195 -8.312 -22.003 63.355 1.00 16.84 O ATOM 1713 CB SER A 195 -7.184 -20.096 65.432 1.00 16.81 C ATOM 1714 OG SER A 195 -6.472 -19.010 65.992 1.00 18.00 O ATOM 1715 HG SER A 195 -6.620 -18.201 65.441 1.00 0.00 H ATOM 1716 H SER A 195 -7.476 -18.398 63.514 1.00 0.00 H ATOM 1717 N GLY A 196 -6.201 -22.705 63.666 1.00 16.31 N ATOM 1718 CA GLY A 196 -6.451 -24.115 63.436 1.00 16.09 C ATOM 1719 C GLY A 196 -6.654 -24.510 61.998 1.00 17.21 C ATOM 1720 O GLY A 196 -6.807 -25.704 61.718 1.00 18.10 O ATOM 1721 H GLY A 196 -5.223 -22.403 63.851 1.00 0.00 H ATOM 1722 N GLY A 197 -6.594 -23.526 61.095 1.00 14.74 N ATOM 1723 CA GLY A 197 -6.746 -23.754 59.666 1.00 15.42 C ATOM 1724 C GLY A 197 -5.499 -24.373 59.061 1.00 19.63 C ATOM 1725 O GLY A 197 -4.440 -24.382 59.689 1.00 18.21 O ATOM 1726 H GLY A 197 -6.431 -22.554 61.429 1.00 0.00 H ATOM 1727 N PRO A 198 -5.604 -24.880 57.819 1.00 17.30 N ATOM 1728 CA PRO A 198 -4.485 -25.612 57.228 1.00 17.75 C ATOM 1729 C PRO A 198 -3.373 -24.818 56.568 1.00 19.65 C ATOM 1730 O PRO A 198 -3.597 -23.743 55.980 1.00 17.50 O ATOM 1731 CB PRO A 198 -5.165 -26.473 56.160 1.00 19.09 C ATOM 1732 CG PRO A 198 -6.345 -25.652 55.708 1.00 20.73 C ATOM 1733 CD PRO A 198 -6.814 -24.946 56.969 1.00 16.03 C ATOM 1734 N VAL A 199 -2.147 -25.397 56.664 1.00 16.23 N ATOM 1735 CA VAL A 199 -0.970 -24.928 55.932 1.00 14.85 C ATOM 1736 C VAL A 199 -0.543 -26.154 55.122 1.00 19.01 C ATOM 1737 O VAL A 199 -0.188 -27.189 55.705 1.00 19.44 O ATOM 1738 CB VAL A 199 0.180 -24.382 56.808 1.00 18.07 C ATOM 1739 CG1 VAL A 199 1.368 -23.936 55.947 1.00 15.92 C ATOM 1740 CG2 VAL A 199 -0.305 -23.235 57.680 1.00 16.85 C ATOM 1741 H VAL A 199 -2.040 -26.219 57.292 1.00 0.00 H ATOM 1742 N VAL A 200 -0.664 -26.057 53.790 1.00 16.14 N ATOM 1743 CA VAL A 200 -0.442 -27.187 52.891 1.00 16.30 C ATOM 1744 C VAL A 200 0.758 -26.886 52.040 1.00 21.08 C ATOM 1745 O VAL A 200 0.822 -25.817 51.419 1.00 18.25 O ATOM 1746 CB VAL A 200 -1.739 -27.517 52.064 1.00 18.88 C ATOM 1747 CG1 VAL A 200 -1.486 -28.617 51.017 1.00 19.56 C ATOM 1748 CG2 VAL A 200 -2.910 -27.904 52.989 1.00 18.13 C ATOM 1749 H VAL A 200 -0.927 -25.138 53.380 1.00 0.00 H ATOM 1750 N CYS A 201 1.728 -27.820 52.032 1.00 20.04 N ATOM 1751 CA CYS A 201 2.985 -27.694 51.282 1.00 18.86 C ATOM 1752 C CYS A 201 3.121 -28.914 50.390 1.00 21.89 C ATOM 1753 O CYS A 201 3.134 -30.046 50.903 1.00 18.44 O ATOM 1754 CB CYS A 201 4.187 -27.586 52.221 1.00 18.78 C ATOM 1755 SG CYS A 201 3.945 -26.503 53.649 1.00 22.76 S ATOM 1756 H CYS A 201 1.578 -28.684 52.591 1.00 0.00 H ATOM 1757 N ASN A 202 3.220 -28.695 49.061 1.00 19.27 N ATOM 1758 CA ASN A 202 3.373 -29.792 48.089 1.00 19.74 C ATOM 1759 C ASN A 202 2.352 -30.936 48.294 1.00 24.00 C ATOM 1760 O ASN A 202 2.709 -32.106 48.328 1.00 23.40 O ATOM 1761 CB ASN A 202 4.830 -30.281 48.127 1.00 19.67 C ATOM 1762 CG ASN A 202 5.794 -29.197 47.708 1.00 26.56 C ATOM 1763 OD1 ASN A 202 6.339 -28.454 48.527 1.00 19.74 O ATOM 1764 ND2 ASN A 202 5.989 -29.068 46.418 1.00 24.68 N ATOM 1765 HD22 ASN A 202 5.514 -29.711 45.753 1.00 0.00 H ATOM 1766 HD21 ASN A 202 6.619 -28.322 46.059 1.00 0.00 H ATOM 1767 H ASN A 202 3.187 -27.716 48.711 1.00 0.00 H ATOM 1768 N GLY A 203 1.080 -30.573 48.399 1.00 21.80 N ATOM 1769 CA GLY A 203 -0.013 -31.535 48.512 1.00 22.18 C ATOM 1770 C GLY A 203 -0.234 -32.173 49.880 1.00 25.09 C ATOM 1771 O GLY A 203 -1.211 -32.912 50.050 1.00 25.99 O ATOM 1772 H GLY A 203 0.851 -29.558 48.401 1.00 0.00 H ATOM 1773 N SER A 204 0.627 -31.892 50.874 1.00 18.86 N ATOM 1774 CA SER A 204 0.366 -32.506 52.196 1.00 18.77 C ATOM 1775 C SER A 204 0.158 -31.457 53.303 1.00 20.11 C ATOM 1776 O SER A 204 0.638 -30.324 53.191 1.00 19.45 O ATOM 1777 CB SER A 204 1.437 -33.526 52.575 1.00 20.90 C ATOM 1778 OG SER A 204 2.698 -32.905 52.689 1.00 24.11 O ATOM 1779 HG SER A 204 2.658 -32.206 53.389 1.00 0.00 H ATOM 1780 H SER A 204 1.444 -31.268 50.720 1.00 0.00 H ATOM 1781 N LEU A 209 -0.566 -31.830 54.349 1.00 15.54 N ATOM 1782 CA LEU A 209 -0.845 -30.909 55.466 1.00 15.53 C ATOM 1783 C LEU A 209 0.387 -30.838 56.396 1.00 19.49 C ATOM 1784 O LEU A 209 0.732 -31.841 57.024 1.00 21.62 O ATOM 1785 CB LEU A 209 -2.070 -31.396 56.269 1.00 15.42 C ATOM 1786 CG LEU A 209 -2.452 -30.504 57.431 1.00 19.79 C ATOM 1787 CD1 LEU A 209 -2.884 -29.104 56.955 1.00 18.83 C ATOM 1788 CD2 LEU A 209 -3.546 -31.143 58.242 1.00 25.40 C ATOM 1789 H LEU A 209 -0.947 -32.797 54.383 1.00 0.00 H ATOM 1790 N GLN A 210 1.034 -29.683 56.498 1.00 15.93 N ATOM 1791 CA GLN A 210 2.259 -29.580 57.310 1.00 16.59 C ATOM 1792 C GLN A 210 2.159 -28.592 58.482 1.00 20.10 C ATOM 1793 O GLN A 210 3.016 -28.588 59.386 1.00 18.07 O ATOM 1794 CB GLN A 210 3.501 -29.285 56.434 1.00 16.87 C ATOM 1795 CG GLN A 210 3.806 -30.371 55.381 1.00 17.45 C ATOM 1796 CD GLN A 210 3.763 -31.809 55.899 1.00 27.30 C ATOM 1797 OE1 GLN A 210 3.063 -32.669 55.352 1.00 21.98 O ATOM 1798 NE2 GLN A 210 4.421 -32.078 57.030 1.00 23.71 N ATOM 1799 HE22 GLN A 210 5.006 -31.344 57.478 1.00 0.00 H ATOM 1800 HE21 GLN A 210 4.348 -33.021 57.462 1.00 0.00 H ATOM 1801 H GLN A 210 0.673 -28.844 56.001 1.00 0.00 H ATOM 1802 N GLY A 211 1.134 -27.745 58.455 1.00 17.06 N ATOM 1803 CA GLY A 211 0.955 -26.784 59.535 1.00 14.62 C ATOM 1804 C GLY A 211 -0.481 -26.498 59.857 1.00 17.66 C ATOM 1805 O GLY A 211 -1.375 -26.811 59.074 1.00 18.94 O ATOM 1806 H GLY A 211 0.460 -27.769 57.663 1.00 0.00 H ATOM 1807 N LEU A 212 -0.698 -25.916 61.049 1.00 15.34 N ATOM 1808 CA LEU A 212 -1.970 -25.366 61.510 1.00 14.73 C ATOM 1809 C LEU A 212 -1.711 -23.925 61.833 1.00 14.83 C ATOM 1810 O LEU A 212 -0.681 -23.615 62.419 1.00 14.93 O ATOM 1811 CB LEU A 212 -2.485 -26.069 62.786 1.00 14.57 C ATOM 1812 CG LEU A 212 -2.753 -27.553 62.663 1.00 18.47 C ATOM 1813 CD1 LEU A 212 -3.142 -28.157 64.028 1.00 19.48 C ATOM 1814 CD2 LEU A 212 -3.797 -27.843 61.577 1.00 18.56 C ATOM 1815 H LEU A 212 0.111 -25.852 61.700 1.00 0.00 H ATOM 1816 N VAL A 213 -2.676 -23.046 61.569 1.00 14.19 N ATOM 1817 CA VAL A 213 -2.549 -21.630 61.965 1.00 15.78 C ATOM 1818 C VAL A 213 -2.515 -21.598 63.503 1.00 18.59 C ATOM 1819 O VAL A 213 -3.432 -22.123 64.139 1.00 17.14 O ATOM 1820 CB VAL A 213 -3.736 -20.803 61.435 1.00 18.14 C ATOM 1821 CG1 VAL A 213 -3.628 -19.356 61.916 1.00 17.70 C ATOM 1822 CG2 VAL A 213 -3.821 -20.872 59.908 1.00 17.72 C ATOM 1823 H VAL A 213 -3.534 -23.363 61.075 1.00 0.00 H ATOM 1824 N SER A 214 -1.422 -21.095 64.076 1.00 16.22 N ATOM 1825 CA SER A 214 -1.295 -21.096 65.538 1.00 17.32 C ATOM 1826 C SER A 214 -1.276 -19.671 66.084 1.00 19.80 C ATOM 1827 O SER A 214 -2.228 -19.281 66.760 1.00 19.21 O ATOM 1828 CB SER A 214 -0.050 -21.867 65.968 1.00 19.04 C ATOM 1829 OG SER A 214 0.019 -22.035 67.374 1.00 18.64 O ATOM 1830 HG SER A 214 -0.776 -22.537 67.685 1.00 0.00 H ATOM 1831 H SER A 214 -0.660 -20.702 63.488 1.00 0.00 H ATOM 1832 N TRP A 215 -0.212 -18.905 65.832 1.00 16.15 N ATOM 1833 CA TRP A 215 -0.127 -17.544 66.405 1.00 17.16 C ATOM 1834 C TRP A 215 0.791 -16.650 65.575 1.00 19.12 C ATOM 1835 O TRP A 215 1.155 -16.974 64.435 1.00 17.90 O ATOM 1836 CB TRP A 215 0.344 -17.620 67.896 1.00 16.40 C ATOM 1837 CG TRP A 215 1.712 -18.231 68.099 1.00 18.41 C ATOM 1838 CD1 TRP A 215 2.020 -19.563 68.103 1.00 21.17 C ATOM 1839 CD2 TRP A 215 2.909 -17.542 68.488 1.00 18.85 C ATOM 1840 NE1 TRP A 215 3.355 -19.741 68.393 1.00 21.31 N ATOM 1841 CE2 TRP A 215 3.925 -18.518 68.639 1.00 22.89 C ATOM 1842 CE3 TRP A 215 3.231 -16.191 68.700 1.00 20.21 C ATOM 1843 CZ2 TRP A 215 5.249 -18.182 68.987 1.00 21.43 C ATOM 1844 CZ3 TRP A 215 4.548 -15.860 69.015 1.00 22.71 C ATOM 1845 CH2 TRP A 215 5.534 -16.850 69.162 1.00 23.15 C ATOM 1846 HE1 TRP A 215 3.850 -20.655 68.421 1.00 0.00 H ATOM 1847 H TRP A 215 0.558 -19.265 65.232 1.00 0.00 H ATOM 1848 N GLY A 216 1.181 -15.529 66.155 1.00 16.05 N ATOM 1849 CA GLY A 216 2.045 -14.593 65.452 1.00 17.88 C ATOM 1850 C GLY A 216 2.024 -13.291 66.192 1.00 23.14 C ATOM 1851 O GLY A 216 1.840 -13.279 67.412 1.00 24.01 O ATOM 1852 H GLY A 216 0.868 -15.314 67.123 1.00 0.00 H ATOM 1853 N ASP A 217 2.121 -12.193 65.458 1.00 20.07 N ATOM 1854 CA ASP A 217 2.122 -10.899 66.112 1.00 20.20 C ATOM 1855 C ASP A 217 0.889 -10.077 65.750 1.00 22.99 C ATOM 1856 O ASP A 217 0.153 -10.435 64.824 1.00 20.08 O ATOM 1857 CB ASP A 217 3.418 -10.153 65.759 1.00 22.39 C ATOM 1858 CG ASP A 217 3.996 -9.369 66.931 1.00 30.50 C ATOM 1859 OD1 ASP A 217 3.200 -8.919 67.804 1.00 28.01 O ATOM 1860 OD2 ASP A 217 5.224 -9.193 66.970 1.00 38.06 O ATOM 1861 H ASP A 217 2.196 -12.258 64.423 1.00 0.00 H ATOM 1862 N TYR A 218 0.640 -9.005 66.545 1.00 20.09 N ATOM 1863 CA TYR A 218 -0.441 -8.057 66.382 1.00 19.46 C ATOM 1864 C TYR A 218 0.134 -6.635 66.172 1.00 24.26 C ATOM 1865 O TYR A 218 0.973 -6.211 66.962 1.00 23.22 O ATOM 1866 CB TYR A 218 -1.350 -8.028 67.639 1.00 19.57 C ATOM 1867 CG TYR A 218 -2.398 -6.922 67.607 1.00 18.24 C ATOM 1868 CD1 TYR A 218 -3.538 -7.035 66.812 1.00 18.20 C ATOM 1869 CD2 TYR A 218 -2.215 -5.734 68.332 1.00 17.34 C ATOM 1870 CE1 TYR A 218 -4.493 -6.021 66.769 1.00 19.45 C ATOM 1871 CE2 TYR A 218 -3.167 -4.716 68.298 1.00 16.08 C ATOM 1872 CZ TYR A 218 -4.310 -4.873 67.532 1.00 22.16 C ATOM 1873 OH TYR A 218 -5.236 -3.871 67.468 1.00 22.28 O ATOM 1874 HH TYR A 218 -5.982 -4.150 66.881 1.00 0.00 H ATOM 1875 H TYR A 218 1.286 -8.851 67.345 1.00 0.00 H ATOM 1876 N PRO A 219 -0.405 -5.854 65.203 1.00 22.24 N ATOM 1877 CA PRO A 219 -1.349 -6.293 64.157 1.00 21.20 C ATOM 1878 C PRO A 219 -0.686 -7.380 63.311 1.00 20.83 C ATOM 1879 O PRO A 219 0.528 -7.521 63.346 1.00 19.90 O ATOM 1880 CB PRO A 219 -1.578 -5.020 63.318 1.00 23.71 C ATOM 1881 CG PRO A 219 -0.426 -4.141 63.596 1.00 30.04 C ATOM 1882 CD PRO A 219 0.035 -4.458 64.993 1.00 24.79 C ATOM 1883 N CYS A 220 -1.485 -8.163 62.581 1.00 19.87 N ATOM 1884 CA CYS A 220 -0.958 -9.221 61.700 1.00 18.96 C ATOM 1885 C CYS A 220 -0.233 -8.588 60.528 1.00 23.04 C ATOM 1886 O CYS A 220 -0.446 -7.410 60.254 1.00 20.73 O ATOM 1887 CB CYS A 220 -2.098 -10.103 61.212 1.00 18.26 C ATOM 1888 SG CYS A 220 -3.112 -10.785 62.551 1.00 20.57 S ATOM 1889 H CYS A 220 -2.514 -8.021 62.636 1.00 0.00 H ATOM 1890 N ALA A 221 0.579 -9.393 59.799 1.00 21.24 N ATOM 1891 CA ALA A 221 1.261 -8.991 58.559 1.00 22.33 C ATOM 1892 C ALA A 221 2.309 -7.891 58.713 1.00 27.58 C ATOM 1893 O ALA A 221 2.633 -7.216 57.727 1.00 25.47 O ATOM 1894 CB ALA A 221 0.238 -8.611 57.492 1.00 23.33 C ATOM 1895 H ALA A 221 0.730 -10.364 60.141 1.00 0.00 H ATOM 1896 N ARG A 221A 2.896 -7.762 59.921 1.00 24.90 N ATOM 1897 CA ARG A 221A 3.930 -6.755 60.181 1.00 25.76 C ATOM 1898 C ARG A 221A 5.264 -7.177 59.538 1.00 30.02 C ATOM 1899 O ARG A 221A 5.631 -8.358 59.584 1.00 27.40 O ATOM 1900 CB ARG A 221A 4.155 -6.578 61.691 1.00 24.84 C ATOM 1901 CG ARG A 221A 3.173 -5.679 62.425 1.00 31.84 C ATOM 1902 CD ARG A 221A 3.278 -5.881 63.940 1.00 31.89 C ATOM 1903 NE ARG A 221A 4.613 -5.589 64.478 1.00 38.34 N ATOM 1904 CZ ARG A 221A 4.955 -5.711 65.759 1.00 53.04 C ATOM 1905 NH1 ARG A 221A 6.191 -5.435 66.152 1.00 38.78 N ATOM 1906 NH2 ARG A 221A 4.059 -6.101 66.659 1.00 45.03 N ATOM 1907 HE ARG A 221A 5.342 -5.264 63.812 1.00 0.00 H ATOM 1908 HH12 ARG A 221A 6.452 -5.532 67.154 1.00 0.00 H ATOM 1909 HH11 ARG A 221A 6.899 -5.121 65.458 1.00 0.00 H ATOM 1910 HH22 ARG A 221A 4.332 -6.194 67.658 1.00 0.00 H ATOM 1911 HH21 ARG A 221A 3.084 -6.313 66.364 1.00 0.00 H ATOM 1912 H ARG A 221A 2.606 -8.397 60.692 1.00 0.00 H ATOM 1913 N PRO A 222 6.056 -6.224 58.993 1.00 30.38 N ATOM 1914 CA PRO A 222 7.373 -6.615 58.449 1.00 30.99 C ATOM 1915 C PRO A 222 8.232 -7.274 59.533 1.00 36.31 C ATOM 1916 O PRO A 222 8.198 -6.839 60.686 1.00 37.61 O ATOM 1917 CB PRO A 222 7.971 -5.297 57.929 1.00 32.80 C ATOM 1918 CG PRO A 222 7.123 -4.196 58.511 1.00 37.27 C ATOM 1919 CD PRO A 222 5.797 -4.771 58.860 1.00 32.54 C ATOM 1920 N ASN A 223 8.889 -8.400 59.188 1.00 32.55 N ATOM 1921 CA ASN A 223 9.773 -9.192 60.066 1.00 32.50 C ATOM 1922 C ASN A 223 9.042 -9.901 61.250 1.00 33.51 C ATOM 1923 O ASN A 223 9.699 -10.382 62.180 1.00 32.39 O ATOM 1924 CB ASN A 223 10.979 -8.361 60.563 1.00 35.74 C ATOM 1925 CG ASN A 223 11.687 -7.626 59.455 1.00 60.20 C ATOM 1926 OD1 ASN A 223 11.534 -6.411 59.305 1.00 50.68 O ATOM 1927 ND2 ASN A 223 12.427 -8.360 58.620 1.00 54.99 N ATOM 1928 HD22 ASN A 223 12.532 -9.382 58.780 1.00 0.00 H ATOM 1929 HD21 ASN A 223 12.898 -7.909 57.810 1.00 0.00 H ATOM 1930 H ASN A 223 8.761 -8.742 58.214 1.00 0.00 H ATOM 1931 N ARG A 224 7.698 -10.018 61.192 1.00 28.98 N ATOM 1932 CA ARG A 224 6.949 -10.766 62.218 1.00 27.46 C ATOM 1933 C ARG A 224 6.176 -11.869 61.463 1.00 28.00 C ATOM 1934 O ARG A 224 5.005 -11.671 61.145 1.00 27.38 O ATOM 1935 CB ARG A 224 5.971 -9.867 63.015 1.00 26.51 C ATOM 1936 CG ARG A 224 6.513 -8.540 63.553 1.00 39.57 C ATOM 1937 CD ARG A 224 7.821 -8.624 64.310 1.00 45.17 C ATOM 1938 NE ARG A 224 7.750 -9.472 65.496 1.00 43.34 N ATOM 1939 CZ ARG A 224 8.550 -9.336 66.546 1.00 70.14 C ATOM 1940 NH1 ARG A 224 9.465 -8.374 66.573 1.00 60.34 N ATOM 1941 NH2 ARG A 224 8.428 -10.145 67.588 1.00 64.06 N ATOM 1942 HE ARG A 224 7.033 -10.225 65.519 1.00 0.00 H ATOM 1943 HH12 ARG A 224 10.089 -8.273 67.399 1.00 0.00 H ATOM 1944 HH11 ARG A 224 9.558 -7.722 65.768 1.00 0.00 H ATOM 1945 HH22 ARG A 224 9.057 -10.035 68.409 1.00 0.00 H ATOM 1946 HH21 ARG A 224 7.703 -10.891 67.585 1.00 0.00 H ATOM 1947 H ARG A 224 7.181 -9.571 60.408 1.00 0.00 H ATOM 1948 N PRO A 225 6.822 -12.992 61.066 1.00 23.04 N ATOM 1949 CA PRO A 225 6.080 -14.014 60.309 1.00 22.10 C ATOM 1950 C PRO A 225 5.034 -14.731 61.165 1.00 23.44 C ATOM 1951 O PRO A 225 5.113 -14.698 62.393 1.00 22.83 O ATOM 1952 CB PRO A 225 7.177 -14.997 59.893 1.00 23.41 C ATOM 1953 CG PRO A 225 8.202 -14.884 60.984 1.00 28.02 C ATOM 1954 CD PRO A 225 8.219 -13.415 61.316 1.00 23.73 C ATOM 1955 N GLY A 226 4.081 -15.388 60.515 1.00 17.24 N ATOM 1956 CA GLY A 226 3.103 -16.198 61.242 1.00 16.97 C ATOM 1957 C GLY A 226 3.801 -17.425 61.806 1.00 18.85 C ATOM 1958 O GLY A 226 4.817 -17.905 61.260 1.00 18.54 O ATOM 1959 H GLY A 226 4.029 -15.326 59.478 1.00 0.00 H ATOM 1960 N VAL A 227 3.289 -17.915 62.906 1.00 16.86 N ATOM 1961 CA VAL A 227 3.786 -19.109 63.597 1.00 16.95 C ATOM 1962 C VAL A 227 2.756 -20.207 63.473 1.00 19.78 C ATOM 1963 O VAL A 227 1.574 -20.004 63.777 1.00 19.41 O ATOM 1964 CB VAL A 227 4.235 -18.897 65.066 1.00 20.01 C ATOM 1965 CG1 VAL A 227 5.051 -20.097 65.538 1.00 19.16 C ATOM 1966 CG2 VAL A 227 5.079 -17.623 65.191 1.00 20.58 C ATOM 1967 H VAL A 227 2.472 -17.423 63.320 1.00 0.00 H ATOM 1968 N TYR A 228 3.226 -21.383 63.060 1.00 17.31 N ATOM 1969 CA TYR A 228 2.404 -22.520 62.711 1.00 16.44 C ATOM 1970 C TYR A 228 2.801 -23.789 63.460 1.00 21.21 C ATOM 1971 O TYR A 228 3.980 -23.979 63.735 1.00 21.94 O ATOM 1972 CB TYR A 228 2.523 -22.721 61.193 1.00 16.66 C ATOM 1973 CG TYR A 228 1.990 -21.528 60.430 1.00 16.41 C ATOM 1974 CD1 TYR A 228 0.621 -21.376 60.213 1.00 17.43 C ATOM 1975 CD2 TYR A 228 2.834 -20.500 60.025 1.00 16.35 C ATOM 1976 CE1 TYR A 228 0.111 -20.223 59.611 1.00 19.61 C ATOM 1977 CE2 TYR A 228 2.340 -19.353 59.403 1.00 16.40 C ATOM 1978 CZ TYR A 228 0.979 -19.235 59.175 1.00 22.36 C ATOM 1979 OH TYR A 228 0.489 -18.135 58.526 1.00 19.38 O ATOM 1980 HH TYR A 228 0.719 -17.321 59.040 1.00 0.00 H ATOM 1981 H TYR A 228 4.258 -21.491 62.983 1.00 0.00 H ATOM 1982 N THR A 229 1.814 -24.621 63.819 1.00 18.68 N ATOM 1983 CA THR A 229 2.066 -25.898 64.500 1.00 18.79 C ATOM 1984 C THR A 229 2.808 -26.772 63.489 1.00 21.94 C ATOM 1985 O THR A 229 2.327 -26.961 62.377 1.00 21.10 O ATOM 1986 CB THR A 229 0.746 -26.552 64.964 1.00 22.64 C ATOM 1987 OG1 THR A 229 0.022 -25.593 65.742 1.00 19.95 O ATOM 1988 CG2 THR A 229 0.983 -27.824 65.812 1.00 20.52 C ATOM 1989 HG1 THR A 229 -0.829 -25.994 66.049 1.00 0.00 H ATOM 1990 H THR A 229 0.832 -24.352 63.607 1.00 0.00 H ATOM 1991 N ASN A 230 3.973 -27.301 63.896 1.00 19.29 N ATOM 1992 CA ASN A 230 4.855 -28.097 63.020 1.00 20.08 C ATOM 1993 C ASN A 230 4.412 -29.539 63.024 1.00 22.16 C ATOM 1994 O ASN A 230 4.928 -30.358 63.790 1.00 23.60 O ATOM 1995 CB ASN A 230 6.316 -27.934 63.481 1.00 20.35 C ATOM 1996 CG ASN A 230 7.312 -28.262 62.395 1.00 25.55 C ATOM 1997 OD1 ASN A 230 6.948 -28.455 61.232 1.00 23.94 O ATOM 1998 ND2 ASN A 230 8.586 -28.364 62.769 1.00 25.67 N ATOM 1999 HD22 ASN A 230 8.852 -28.193 63.760 1.00 0.00 H ATOM 2000 HD21 ASN A 230 9.315 -28.614 62.070 1.00 0.00 H ATOM 2001 H ASN A 230 4.270 -27.142 64.880 1.00 0.00 H ATOM 2002 N LEU A 231 3.432 -29.857 62.175 1.00 16.95 N ATOM 2003 CA LEU A 231 2.750 -31.142 62.179 1.00 15.78 C ATOM 2004 C LEU A 231 3.614 -32.386 61.882 1.00 23.03 C ATOM 2005 O LEU A 231 3.251 -33.472 62.338 1.00 22.63 O ATOM 2006 CB LEU A 231 1.533 -31.130 61.252 1.00 15.44 C ATOM 2007 CG LEU A 231 0.415 -30.143 61.620 1.00 16.45 C ATOM 2008 CD1 LEU A 231 -0.710 -30.293 60.634 1.00 16.92 C ATOM 2009 CD2 LEU A 231 -0.191 -30.438 63.093 1.00 17.08 C ATOM 2010 H LEU A 231 3.140 -29.148 61.473 1.00 0.00 H ATOM 2011 N CYS A 232 4.725 -32.233 61.150 1.00 22.54 N ATOM 2012 CA CYS A 232 5.629 -33.352 60.829 1.00 23.92 C ATOM 2013 C CYS A 232 6.150 -34.004 62.120 1.00 26.68 C ATOM 2014 O CYS A 232 6.444 -35.199 62.107 1.00 26.37 O ATOM 2015 CB CYS A 232 6.784 -32.874 59.957 1.00 24.67 C ATOM 2016 SG CYS A 232 7.826 -31.637 60.758 1.00 29.08 S ATOM 2017 H CYS A 232 4.960 -31.285 60.793 1.00 0.00 H ATOM 2018 N LYS A 233 6.232 -33.227 63.224 1.00 21.89 N ATOM 2019 CA LYS A 233 6.669 -33.704 64.553 1.00 22.88 C ATOM 2020 C LYS A 233 5.632 -34.581 65.311 1.00 27.67 C ATOM 2021 O LYS A 233 5.972 -35.119 66.377 1.00 29.54 O ATOM 2022 CB LYS A 233 7.057 -32.499 65.448 1.00 25.16 C ATOM 2023 CG LYS A 233 8.090 -31.540 64.832 1.00 33.93 C ATOM 2024 CD LYS A 233 9.483 -32.183 64.674 1.00 37.73 C ATOM 2025 CE LYS A 233 10.497 -31.192 64.177 1.00 42.75 C ATOM 2026 NZ LYS A 233 11.825 -31.817 63.997 1.00 47.81 N ATOM 2027 HZ1 LYS A 233 12.154 -32.196 64.908 1.00 0.00 H ATOM 2028 HZ2 LYS A 233 11.752 -32.589 63.304 1.00 0.00 H ATOM 2029 HZ3 LYS A 233 12.499 -31.103 63.653 1.00 0.00 H ATOM 2030 H LYS A 233 5.970 -32.225 63.131 1.00 0.00 H ATOM 2031 N PHE A 234 4.403 -34.735 64.780 1.00 22.06 N ATOM 2032 CA PHE A 234 3.283 -35.391 65.474 1.00 20.67 C ATOM 2033 C PHE A 234 2.575 -36.529 64.747 1.00 25.49 C ATOM 2034 O PHE A 234 1.550 -37.002 65.243 1.00 27.99 O ATOM 2035 CB PHE A 234 2.243 -34.294 65.858 1.00 22.15 C ATOM 2036 CG PHE A 234 2.833 -33.232 66.752 1.00 23.36 C ATOM 2037 CD1 PHE A 234 3.012 -33.465 68.115 1.00 24.39 C ATOM 2038 CD2 PHE A 234 3.218 -31.994 66.234 1.00 24.03 C ATOM 2039 CE1 PHE A 234 3.576 -32.491 68.937 1.00 23.64 C ATOM 2040 CE2 PHE A 234 3.785 -31.016 67.061 1.00 26.14 C ATOM 2041 CZ PHE A 234 3.935 -31.258 68.411 1.00 24.13 C ATOM 2042 H PHE A 234 4.236 -34.368 63.821 1.00 0.00 H ATOM 2043 N THR A 235 3.114 -37.018 63.613 1.00 21.59 N ATOM 2044 CA THR A 235 2.474 -38.098 62.865 1.00 21.62 C ATOM 2045 C THR A 235 2.252 -39.349 63.715 1.00 26.58 C ATOM 2046 O THR A 235 1.185 -39.926 63.600 1.00 27.37 O ATOM 2047 CB THR A 235 3.208 -38.415 61.559 1.00 28.70 C ATOM 2048 OG1 THR A 235 4.527 -38.839 61.885 1.00 28.07 O ATOM 2049 CG2 THR A 235 3.272 -37.206 60.598 1.00 27.46 C ATOM 2050 HG1 THR A 235 5.020 -39.049 61.053 1.00 0.00 H ATOM 2051 H THR A 235 4.007 -36.617 63.262 1.00 0.00 H ATOM 2052 N LYS A 236 3.218 -39.724 64.599 1.00 25.52 N ATOM 2053 CA LYS A 236 3.071 -40.900 65.478 1.00 26.59 C ATOM 2054 C LYS A 236 1.903 -40.658 66.432 1.00 30.93 C ATOM 2055 O LYS A 236 0.988 -41.482 66.454 1.00 31.10 O ATOM 2056 CB LYS A 236 4.371 -41.201 66.249 1.00 29.17 C ATOM 2057 CG LYS A 236 4.346 -42.502 67.035 1.00 49.70 C ATOM 2058 CD LYS A 236 5.320 -42.469 68.220 1.00 64.19 C ATOM 2059 CE LYS A 236 6.624 -43.197 67.946 1.00 78.25 C ATOM 2060 NZ LYS A 236 7.614 -42.975 69.024 1.00 87.64 N ATOM 2061 HZ1 LYS A 236 7.817 -41.958 69.102 1.00 0.00 H ATOM 2062 HZ2 LYS A 236 7.228 -43.323 69.925 1.00 0.00 H ATOM 2063 HZ3 LYS A 236 8.490 -43.488 68.800 1.00 0.00 H ATOM 2064 H LYS A 236 4.091 -39.161 64.657 1.00 0.00 H ATOM 2065 N TRP A 237 1.897 -39.495 67.161 1.00 27.60 N ATOM 2066 CA TRP A 237 0.774 -39.147 68.041 1.00 27.26 C ATOM 2067 C TRP A 237 -0.551 -39.140 67.267 1.00 29.43 C ATOM 2068 O TRP A 237 -1.511 -39.717 67.755 1.00 30.05 O ATOM 2069 CB TRP A 237 0.965 -37.803 68.785 1.00 26.54 C ATOM 2070 CG TRP A 237 -0.190 -37.442 69.678 1.00 27.66 C ATOM 2071 CD1 TRP A 237 -0.461 -37.954 70.916 1.00 30.73 C ATOM 2072 CD2 TRP A 237 -1.264 -36.532 69.376 1.00 27.72 C ATOM 2073 NE1 TRP A 237 -1.649 -37.444 71.389 1.00 30.51 N ATOM 2074 CE2 TRP A 237 -2.148 -36.548 70.478 1.00 31.89 C ATOM 2075 CE3 TRP A 237 -1.553 -35.689 68.291 1.00 28.89 C ATOM 2076 CZ2 TRP A 237 -3.318 -35.767 70.514 1.00 30.82 C ATOM 2077 CZ3 TRP A 237 -2.714 -34.924 68.323 1.00 30.46 C ATOM 2078 CH2 TRP A 237 -3.571 -34.953 69.433 1.00 30.83 C ATOM 2079 HE1 TRP A 237 -2.097 -37.698 72.293 1.00 0.00 H ATOM 2080 H TRP A 237 2.706 -38.846 67.089 1.00 0.00 H ATOM 2081 N ILE A 238 -0.615 -38.504 66.067 1.00 24.48 N ATOM 2082 CA ILE A 238 -1.868 -38.460 65.284 1.00 23.06 C ATOM 2083 C ILE A 238 -2.378 -39.869 64.943 1.00 29.06 C ATOM 2084 O ILE A 238 -3.554 -40.184 65.179 1.00 28.44 O ATOM 2085 CB ILE A 238 -1.742 -37.548 64.013 1.00 26.42 C ATOM 2086 CG1 ILE A 238 -1.466 -36.066 64.389 1.00 26.98 C ATOM 2087 CG2 ILE A 238 -2.985 -37.667 63.140 1.00 27.40 C ATOM 2088 CD1 ILE A 238 -0.867 -35.189 63.226 1.00 26.26 C ATOM 2089 H ILE A 238 0.236 -38.038 65.692 1.00 0.00 H ATOM 2090 N GLN A 239 -1.483 -40.712 64.371 1.00 27.61 N ATOM 2091 CA GLN A 239 -1.812 -42.089 63.983 1.00 27.74 C ATOM 2092 C GLN A 239 -2.263 -42.920 65.194 1.00 30.20 C ATOM 2093 O GLN A 239 -3.357 -43.471 65.168 1.00 29.84 O ATOM 2094 CB GLN A 239 -0.624 -42.764 63.262 1.00 29.46 C ATOM 2095 CG GLN A 239 -0.402 -42.278 61.839 1.00 50.45 C ATOM 2096 CD GLN A 239 0.803 -42.904 61.152 1.00 69.52 C ATOM 2097 OE1 GLN A 239 0.811 -43.085 59.934 1.00 65.49 O ATOM 2098 NE2 GLN A 239 1.895 -43.141 61.889 1.00 60.49 N ATOM 2099 HE22 GLN A 239 1.873 -42.983 62.917 1.00 0.00 H ATOM 2100 HE21 GLN A 239 2.765 -43.483 61.434 1.00 0.00 H ATOM 2101 H GLN A 239 -0.517 -40.366 64.199 1.00 0.00 H ATOM 2102 N GLU A 240 -1.463 -42.934 66.262 1.00 28.41 N ATOM 2103 CA GLU A 240 -1.751 -43.699 67.494 1.00 28.99 C ATOM 2104 C GLU A 240 -3.047 -43.274 68.187 1.00 31.51 C ATOM 2105 O GLU A 240 -3.826 -44.138 68.594 1.00 31.78 O ATOM 2106 CB GLU A 240 -0.556 -43.659 68.460 1.00 31.12 C ATOM 2107 CG GLU A 240 0.529 -44.633 68.042 1.00 45.04 C ATOM 2108 CD GLU A 240 1.871 -44.591 68.739 1.00 70.94 C ATOM 2109 OE1 GLU A 240 2.818 -45.165 68.157 1.00 71.94 O ATOM 2110 OE2 GLU A 240 2.030 -43.832 69.723 1.00 65.33 O ATOM 2111 H GLU A 240 -0.587 -42.375 66.226 1.00 0.00 H ATOM 2112 N THR A 241 -3.325 -41.953 68.248 1.00 27.28 N ATOM 2113 CA THR A 241 -4.559 -41.429 68.866 1.00 25.40 C ATOM 2114 C THR A 241 -5.793 -41.816 68.043 1.00 29.30 C ATOM 2115 O THR A 241 -6.795 -42.248 68.624 1.00 28.87 O ATOM 2116 CB THR A 241 -4.423 -39.920 69.136 1.00 23.98 C ATOM 2117 OG1 THR A 241 -3.210 -39.695 69.857 1.00 24.53 O ATOM 2118 CG2 THR A 241 -5.614 -39.327 69.888 1.00 23.55 C ATOM 2119 HG1 THR A 241 -2.443 -40.012 69.317 1.00 0.00 H ATOM 2120 H THR A 241 -2.643 -41.279 67.844 1.00 0.00 H ATOM 2121 N ILE A 242 -5.726 -41.700 66.692 1.00 26.35 N ATOM 2122 CA ILE A 242 -6.863 -42.089 65.850 1.00 26.32 C ATOM 2123 C ILE A 242 -7.140 -43.594 66.054 1.00 31.18 C ATOM 2124 O ILE A 242 -8.289 -43.985 66.260 1.00 29.54 O ATOM 2125 CB ILE A 242 -6.647 -41.719 64.348 1.00 29.43 C ATOM 2126 CG1 ILE A 242 -6.784 -40.187 64.148 1.00 29.53 C ATOM 2127 CG2 ILE A 242 -7.627 -42.479 63.435 1.00 31.24 C ATOM 2128 CD1 ILE A 242 -6.427 -39.653 62.740 1.00 31.56 C ATOM 2129 H ILE A 242 -4.860 -41.332 66.249 1.00 0.00 H ATOM 2130 N GLN A 243 -6.075 -44.413 66.016 1.00 32.34 N ATOM 2131 CA GLN A 243 -6.176 -45.875 66.182 1.00 33.84 C ATOM 2132 C GLN A 243 -6.726 -46.276 67.553 1.00 39.35 C ATOM 2133 O GLN A 243 -7.604 -47.126 67.620 1.00 40.92 O ATOM 2134 CB GLN A 243 -4.837 -46.568 65.879 1.00 35.50 C ATOM 2135 CG GLN A 243 -4.456 -46.570 64.387 1.00 57.73 C ATOM 2136 CD GLN A 243 -5.501 -47.159 63.471 1.00 83.21 C ATOM 2137 OE1 GLN A 243 -5.724 -48.361 63.441 1.00 79.53 O ATOM 2138 NE2 GLN A 243 -6.166 -46.316 62.701 1.00 76.98 N ATOM 2139 HE22 GLN A 243 -5.959 -45.298 62.744 1.00 0.00 H ATOM 2140 HE21 GLN A 243 -6.897 -46.671 62.052 1.00 0.00 H ATOM 2141 H GLN A 243 -5.135 -43.996 65.862 1.00 0.00 H ATOM 2142 N ALA A 244 -6.255 -45.623 68.635 1.00 34.87 N ATOM 2143 CA ALA A 244 -6.714 -45.875 70.009 1.00 33.92 C ATOM 2144 C ALA A 244 -8.164 -45.445 70.252 1.00 37.99 C ATOM 2145 O ALA A 244 -8.797 -45.925 71.198 1.00 38.35 O ATOM 2146 CB ALA A 244 -5.795 -45.193 71.009 1.00 34.12 C ATOM 2147 H ALA A 244 -5.524 -44.898 68.489 1.00 0.00 H ATOM 2148 N ASN A 245 -8.694 -44.547 69.405 1.00 32.99 N ATOM 2149 CA ASN A 245 -10.056 -44.061 69.553 1.00 32.29 C ATOM 2150 C ASN A 245 -10.964 -44.485 68.384 1.00 38.07 C ATOM 2151 O ASN A 245 -11.920 -43.789 68.049 1.00 37.17 O ATOM 2152 CB ASN A 245 -10.063 -42.554 69.814 1.00 29.08 C ATOM 2153 CG ASN A 245 -9.433 -42.205 71.136 1.00 40.17 C ATOM 2154 OD1 ASN A 245 -10.098 -42.184 72.169 1.00 40.23 O ATOM 2155 ND2 ASN A 245 -8.124 -42.008 71.152 1.00 32.77 N ATOM 2156 HD22 ASN A 245 -7.584 -42.031 70.264 1.00 0.00 H ATOM 2157 HD21 ASN A 245 -7.636 -41.830 72.053 1.00 0.00 H ATOM 2158 H ASN A 245 -8.113 -44.189 68.620 1.00 0.00 H ATOM 2159 N SER A 246 -10.693 -45.663 67.817 1.00 37.87 N ATOM 2160 CA SER A 246 -11.477 -46.294 66.748 1.00 44.15 C ATOM 2161 C SER A 246 -12.300 -47.458 67.338 1.00 62.45 C ATOM 2162 O SER A 246 -13.447 -47.674 66.902 1.00 63.70 O ATOM 2163 CB SER A 246 -10.557 -46.829 65.656 1.00 49.08 C ATOM 2164 OG SER A 246 -9.844 -45.783 65.018 1.00 61.50 O ATOM 2165 OXT SER A 246 -11.782 -48.184 68.212 1.00 82.99 O ATOM 2166 HG SER A 246 -9.292 -45.305 65.687 1.00 0.00 H ATOM 2167 H SER A 246 -9.857 -46.176 68.161 1.00 0.00 H TER 2168 SER A 246 HETATM 2169 NA NA A 1 -7.600 -10.138 48.624 1.00 35.66 NA HETATM 2170 O HOH 2 -12.960 -26.788 70.051 1.00 44.57 O HETATM 2171 O HOH 3 -2.287 -21.506 73.233 1.00 22.45 O HETATM 2172 O HOH 4 -20.404 -14.980 53.495 1.00 30.79 O HETATM 2173 O HOH 5 6.113 -25.947 47.707 1.00 20.52 O HETATM 2174 O HOH 6 -7.692 -4.551 66.750 1.00 22.34 O HETATM 2175 O HOH 7 6.720 -37.676 63.019 1.00 44.04 O HETATM 2176 O HOH 8 -8.293 -17.086 65.791 1.00 26.41 O HETATM 2177 O HOH 9 -11.355 -19.439 72.826 1.00 28.63 O HETATM 2178 O HOH 10 -20.177 -33.173 49.938 1.00 30.70 O HETATM 2179 O HOH 11 -7.080 -17.973 45.417 1.00 40.95 O HETATM 2180 O HOH 12 -18.931 -36.863 73.427 1.00 42.53 O HETATM 2181 O HOH 13 7.226 -30.004 50.514 1.00 23.45 O HETATM 2182 O HOH 14 -5.648 -8.535 64.282 1.00 24.24 O HETATM 2183 O HOH 15 -21.699 -39.172 56.576 1.00 46.72 O HETATM 2184 O HOH 16 -15.107 -16.507 44.719 1.00 38.94 O HETATM 2185 O HOH 17 -15.805 -41.827 54.496 1.00 39.52 O HETATM 2186 O HOH 18 2.011 -16.044 57.826 1.00 20.35 O HETATM 2187 O HOH 19 3.188 -7.765 70.223 1.00 40.80 O HETATM 2188 O HOH 20 5.297 -30.006 59.304 1.00 20.07 O HETATM 2189 O HOH 21 2.014 -8.048 50.812 1.00 49.48 O HETATM 2190 O HOH 22 -22.515 -18.797 70.186 1.00 45.25 O HETATM 2191 O HOH 23 -12.698 -17.327 67.723 1.00 43.92 O HETATM 2192 O HOH 24 -19.230 -25.936 48.550 1.00 29.64 O HETATM 2193 O HOH 25 -5.806 -8.808 48.612 1.00 40.13 O HETATM 2194 O HOH 26 2.609 -12.955 69.980 1.00 38.71 O HETATM 2195 O HOH 27 -14.342 -29.418 53.481 1.00 29.48 O HETATM 2196 O HOH 28 -1.679 -3.005 59.802 1.00 36.48 O HETATM 2197 O HOH 29 -6.465 -8.137 52.809 1.00 27.52 O HETATM 2198 O HOH 30 -9.881 -6.814 53.059 1.00 32.33 O HETATM 2199 O HOH 31 0.192 -17.439 74.719 1.00 39.53 O HETATM 2200 O HOH 32 5.123 -15.745 72.507 1.00 39.66 O HETATM 2201 O HOH 33 2.517 -9.197 62.576 1.00 22.36 O HETATM 2202 O HOH 34 -13.621 -29.371 70.200 1.00 35.12 O HETATM 2203 O HOH 35 -20.970 -25.279 71.717 1.00 43.99 O HETATM 2204 O HOH 36 6.197 -32.482 71.773 1.00 33.70 O HETATM 2205 O HOH 37 -25.121 -27.361 43.355 1.00 58.65 O HETATM 2206 O HOH 38 -26.638 -31.708 48.279 1.00 46.69 O HETATM 2207 O HOH 39 13.617 -15.872 52.927 1.00 54.01 O HETATM 2208 O HOH 40 5.047 -12.375 70.923 1.00 52.31 O HETATM 2209 O HOH 41 -1.351 -20.920 70.748 1.00 21.28 O HETATM 2210 O HOH 42 -21.985 -19.563 59.271 1.00 32.76 O HETATM 2211 O HOH 43 3.565 -10.989 58.937 1.00 30.70 O HETATM 2212 O HOH 44 2.639 -22.898 68.345 1.00 21.59 O HETATM 2213 O HOH 45 0.796 -23.380 46.996 1.00 27.42 O HETATM 2214 O HOH 46 -4.671 -35.602 75.540 1.00 20.19 O HETATM 2215 O HOH 47 -27.745 -31.399 52.052 1.00 48.98 O HETATM 2216 O HOH 48 9.925 -29.003 51.490 1.00 25.31 O HETATM 2217 O HOH 49 -0.952 -15.617 47.741 1.00 20.15 O HETATM 2218 O HOH 50 -6.037 -25.188 52.443 1.00 37.35 O HETATM 2219 O HOH 51 -18.543 -11.836 56.096 1.00 43.12 O HETATM 2220 O HOH 52 1.215 -25.218 75.247 1.00 19.24 O HETATM 2221 O HOH 53 -9.657 -14.826 55.672 1.00 19.76 O HETATM 2222 O HOH 54 -2.976 -46.617 69.377 1.00 43.35 O HETATM 2223 O HOH 55 -9.602 -11.432 48.590 1.00 27.79 O HETATM 2224 O HOH 56 10.341 -12.454 57.955 1.00 40.56 O HETATM 2225 O HOH 57 1.956 -17.421 44.807 1.00 38.01 O HETATM 2226 O HOH 58 -15.417 -26.342 54.078 1.00 35.44 O HETATM 2227 O HOH 59 1.222 -39.399 58.867 1.00 43.27 O HETATM 2228 O HOH 60 4.132 -36.305 70.369 1.00 32.20 O HETATM 2229 O HOH 61 3.982 -22.739 40.345 1.00 50.27 O HETATM 2230 O HOH 62 -19.657 -32.412 46.128 1.00 42.26 O HETATM 2231 O HOH 63 9.510 -35.526 61.377 1.00 47.69 O HETATM 2232 O HOH 64 -7.462 -12.359 52.060 1.00 23.91 O HETATM 2233 O HOH 65 -7.392 -38.196 50.839 1.00 46.70 O HETATM 2234 O HOH 66 2.484 -27.796 81.981 1.00 33.95 O HETATM 2235 O HOH 67 -11.295 -43.532 64.431 1.00 38.08 O HETATM 2236 O HOH 68 10.411 -19.158 48.858 1.00 32.90 O HETATM 2237 O HOH 69 -8.928 -20.302 73.999 1.00 31.89 O HETATM 2238 O HOH 70 4.631 -41.331 60.734 1.00 42.55 O HETATM 2239 O HOH 71 -11.777 -31.096 44.843 1.00 49.01 O HETATM 2240 O HOH 72 -16.877 -25.269 55.985 1.00 40.71 O HETATM 2241 O HOH 73 9.626 -25.305 74.609 1.00 45.26 O HETATM 2242 O HOH 74 5.981 -18.786 73.074 1.00 37.45 O HETATM 2243 O HOH 75 -22.245 -36.410 55.606 1.00 37.83 O HETATM 2244 O HOH 76 2.056 -14.696 72.147 1.00 37.72 O HETATM 2245 O HOH 77 -23.818 -23.734 59.546 1.00 37.99 O HETATM 2246 O HOH 78 -15.023 -27.846 49.618 1.00 38.13 O HETATM 2247 O HOH 79 5.095 -33.447 48.707 1.00 27.90 O HETATM 2248 O HOH 80 9.096 -11.341 70.007 1.00 45.66 O HETATM 2249 O HOH 81 -22.510 -33.456 48.535 1.00 48.55 O HETATM 2250 O HOH 82 -18.875 -23.340 73.577 1.00 42.31 O HETATM 2251 O HOH 83 5.674 -38.619 65.264 1.00 37.83 O HETATM 2252 O HOH 84 2.653 -12.049 62.577 1.00 21.03 O HETATM 2253 O HOH 85 -24.531 -24.023 55.464 1.00 41.00 O HETATM 2254 O HOH 86 -1.522 -33.375 79.622 1.00 38.76 O HETATM 2255 O HOH 87 0.366 -4.797 59.770 1.00 37.89 O HETATM 2256 O HOH 88 5.392 -30.929 52.263 1.00 25.38 O HETATM 2257 O HOH 89 6.534 -10.548 69.583 1.00 45.23 O HETATM 2258 O HOH 90 11.730 -34.317 57.963 1.00 42.86 O HETATM 2259 O HOH 91 -6.151 -25.475 81.100 1.00 25.17 O HETATM 2260 O HOH 92 13.729 -13.071 61.310 1.00 40.64 O HETATM 2261 O HOH 93 -12.350 -28.599 73.220 1.00 43.71 O HETATM 2262 O HOH 94 -2.440 -41.233 72.049 1.00 37.71 O HETATM 2263 O HOH 95 -13.672 -44.150 61.041 1.00 36.14 O HETATM 2264 O HOH 96 4.506 -34.519 51.299 1.00 25.76 O HETATM 2265 O HOH 97 -9.402 -21.378 76.439 1.00 34.40 O HETATM 2266 O HOH 98 -7.208 -27.741 74.452 1.00 27.53 O HETATM 2267 O HOH 99 -16.085 -29.609 71.278 1.00 39.73 O HETATM 2268 O HOH 100 0.163 -28.104 47.454 1.00 22.22 O HETATM 2269 O HOH 101 -0.185 -18.225 62.317 1.00 19.92 O HETATM 2270 O HOH 102 -20.886 -16.156 49.408 1.00 50.88 O HETATM 2271 O HOH 103 14.674 -18.671 55.885 1.00 36.29 O HETATM 2272 O HOH 104 3.463 -13.565 57.581 1.00 28.27 O HETATM 2273 O HOH 105 -12.317 -23.731 48.218 1.00 35.67 O HETATM 2274 O HOH 106 4.901 -39.451 56.253 1.00 48.20 O HETATM 2275 O HOH 107 10.685 -21.809 61.059 1.00 24.59 O HETATM 2276 O HOH 108 3.739 -14.459 51.480 1.00 28.50 O HETATM 2277 O HOH 109 -13.428 -37.314 48.906 1.00 37.66 O HETATM 2278 O HOH 110 -10.862 -19.848 59.396 1.00 18.34 O HETATM 2279 O HOH 111 -17.700 -44.617 62.302 1.00 43.49 O HETATM 2280 O HOH 112 11.719 -36.558 55.293 1.00 56.29 O HETATM 2281 O HOH 113 -1.634 -5.839 53.634 1.00 44.04 O HETATM 2282 O HOH 114 4.521 -23.173 75.369 1.00 34.73 O HETATM 2283 O HOH 115 -20.394 -30.788 68.384 1.00 34.07 O HETATM 2284 O HOH 116 -21.234 -27.165 46.895 1.00 39.14 O HETATM 2285 O HOH 117 2.882 -26.553 47.224 1.00 41.51 O HETATM 2286 O HOH 118 1.830 -34.760 48.850 1.00 26.05 O HETATM 2287 O HOH 119 4.252 -37.923 67.467 1.00 32.06 O HETATM 2288 O HOH 120 1.967 -14.649 48.373 1.00 25.45 O HETATM 2289 O HOH 121 -13.012 -26.281 48.586 1.00 49.98 O HETATM 2290 O HOH 122 1.960 -4.531 57.031 1.00 37.91 O HETATM 2291 O HOH 123 -7.636 -21.913 45.630 1.00 43.57 O HETATM 2292 O HOH 124 2.713 -25.888 68.307 1.00 21.84 O HETATM 2293 O HOH 125 -16.565 -8.111 59.269 1.00 32.66 O HETATM 2294 O HOH 126 -14.611 -12.742 50.436 1.00 30.04 O HETATM 2295 O HOH 127 6.254 -15.773 52.104 1.00 33.20 O HETATM 2296 O HOH 128 4.147 -13.247 54.044 1.00 22.88 O HETATM 2297 O HOH 129 -2.371 -6.034 58.617 1.00 33.70 O HETATM 2298 O HOH 130 -5.149 -4.297 57.481 1.00 30.07 O HETATM 2299 O HOH 131 -8.566 -21.420 58.902 1.00 19.31 O HETATM 2300 O HOH 132 6.573 -7.525 68.906 1.00 57.42 O HETATM 2301 O HOH 133 -13.953 -26.232 51.544 1.00 41.40 O HETATM 2302 O HOH 134 -11.657 -33.849 45.767 1.00 58.80 O HETATM 2303 O HOH 135 -4.146 -21.208 45.303 1.00 37.11 O HETATM 2304 O HOH 136 -12.439 -3.325 63.941 1.00 37.63 O HETATM 2305 O HOH 137 -9.758 -12.563 45.460 1.00 32.12 O HETATM 2306 O HOH 138 0.066 -24.983 83.157 1.00 40.47 O HETATM 2307 O HOH 139 -25.675 -33.735 64.317 1.00 75.23 O HETATM 2308 O HOH 140 0.863 -30.490 79.349 1.00 26.71 O HETATM 2309 O HOH 141 1.096 -5.941 69.862 1.00 54.36 O HETATM 2310 O HOH 142 -24.133 -24.800 62.381 1.00 39.40 O HETATM 2311 O HOH 143 8.722 -8.144 53.556 1.00 39.48 O HETATM 2312 O HOH 144 -3.052 -13.919 46.790 1.00 41.81 O HETATM 2313 O HOH 145 -0.704 -40.604 56.522 1.00 48.62 O HETATM 2314 O HOH 146 -1.998 -38.264 57.891 1.00 31.14 O HETATM 2315 O HOH 147 -22.912 -30.262 69.734 1.00 51.42 O HETATM 2316 O HOH 148 -19.443 -16.228 61.746 1.00 41.17 O HETATM 2317 O HOH 149 11.319 -30.942 50.359 1.00 33.94 O HETATM 2318 O HOH 150 -18.454 -43.937 64.878 1.00 50.68 O HETATM 2319 O HOH 151 -17.766 -22.777 55.810 1.00 30.56 O HETATM 2320 O HOH 152 -15.792 -12.623 47.921 1.00 49.82 O HETATM 2321 O HOH 153 13.096 -24.157 67.592 1.00 36.33 O HETATM 2322 O HOH 154 15.610 -26.096 55.851 1.00 46.12 O HETATM 2323 O HOH 155 -4.062 -21.317 40.356 1.00 48.23 O HETATM 2324 O HOH 156 -16.688 -40.035 73.067 1.00 36.21 O HETATM 2325 O HOH 157 0.173 -11.850 69.479 1.00 41.89 O HETATM 2326 O HOH 158 -25.259 -25.673 45.497 1.00 41.25 O HETATM 2327 O HOH 159 -25.192 -32.550 56.595 1.00 37.90 O HETATM 2328 O HOH 160 -22.246 -22.935 71.186 1.00 28.24 O HETATM 2329 O HOH 161 -16.180 -25.046 47.788 1.00 51.52 O HETATM 2330 O HOH 162 -5.849 -41.719 73.168 1.00 39.69 O HETATM 2331 O HOH 163 4.399 -19.959 74.883 1.00 33.32 O HETATM 2332 O HOH 164 -26.718 -16.448 60.574 1.00 36.52 O HETATM 2333 O HOH 165 -26.527 -29.849 55.591 1.00 45.27 O HETATM 2334 O HOH 166 -1.057 -35.165 47.948 1.00 48.35 O HETATM 2335 O HOH 167 -27.426 -29.878 69.316 1.00 53.29 O HETATM 2336 O HOH 168 -6.711 -2.205 59.535 1.00 31.56 O HETATM 2337 O HOH 169 -6.177 -27.632 77.234 1.00 25.89 O HETATM 2338 O HOH 170 -0.362 -25.667 48.509 1.00 40.43 O HETATM 2339 O HOH 171 -24.249 -17.453 64.116 1.00 39.61 O HETATM 2340 O HOH 172 0.702 -23.153 81.241 1.00 44.29 O HETATM 2341 O HOH 173 1.872 -39.139 54.661 1.00 52.59 O HETATM 2342 O HOH 174 2.628 -22.881 79.393 1.00 34.70 O HETATM 2343 O HOH 175 -15.868 -33.316 72.289 1.00 45.58 O HETATM 2344 O HOH 176 -7.728 -17.666 77.253 1.00 45.11 O HETATM 2345 O HOH 177 -3.583 -26.488 48.894 1.00 31.28 O HETATM 2346 O HOH 178 -21.350 -16.540 59.832 1.00 49.59 O HETATM 2347 O HOH 179 -0.550 -39.045 60.911 1.00 47.57 O HETATM 2348 O HOH 180 8.496 -22.078 73.682 1.00 58.26 O HETATM 2349 O HOH 181 -1.549 -39.432 74.119 1.00 37.54 O HETATM 2350 O HOH 182 -5.813 -17.995 79.155 1.00 55.19 O HETATM 2351 O HOH 183 1.794 -14.855 45.699 1.00 53.53 O HETATM 2352 O HOH 184 3.107 -24.737 77.092 1.00 25.27 O HETATM 2353 O HOH 185 -8.867 -30.357 45.439 1.00 52.70 O HETATM 2354 O HOH 186 -1.704 -15.162 69.565 1.00 33.98 O HETATM 2355 O HOH 187 4.927 -17.609 48.954 1.00 41.41 O HETATM 2356 O HOH 188 -16.694 -6.886 61.888 1.00 47.53 O HETATM 2357 O HOH 189 -5.575 -22.850 81.608 1.00 36.24 O HETATM 2358 O HOH 190 -3.740 -37.840 74.243 1.00 37.32 O HETATM 2359 O HOH 191 -12.112 -10.674 51.158 1.00 41.74 O HETATM 2360 O HOH 192 2.805 -2.485 64.272 1.00 33.62 O HETATM 2361 O HOH 193 0.163 -36.247 50.391 1.00 36.07 O HETATM 2362 O HOH 194 -10.132 -18.202 68.259 1.00 48.81 O HETATM 2363 O HOH 195 -7.897 -9.672 51.053 1.00 34.29 O HETATM 2364 O HOH 196 -7.923 -10.607 45.826 1.00 61.25 O HETATM 2365 O HOH 197 2.752 -17.852 75.325 1.00 43.42 O HETATM 2366 O HOH 198 5.552 -15.044 49.568 1.00 40.56 O HETATM 2367 O HOH 199 5.626 -4.714 69.768 1.00 65.15 O HETATM 2368 O HOH 200 2.794 -2.525 67.254 1.00 40.13 O HETATM 2369 O HOH 201 -10.386 -8.591 51.081 1.00 53.95 O HETATM 2370 O HOH 202 -14.469 -24.255 49.757 1.00 53.20 O HETATM 2371 O HOH 203 -32.847 -24.984 66.967 1.00 41.34 O HETATM 2372 O HOH 204 -1.659 -15.514 72.298 1.00 34.58 O HETATM 2373 O HOH 205 -20.819 -13.159 55.484 1.00 40.45 O HETATM 2374 O HOH 206 -13.818 -42.141 52.695 1.00 47.11 O HETATM 2375 O HOH 207 -18.071 -13.807 46.995 1.00 43.70 O HETATM 2376 O HOH 208 -2.051 -1.573 57.524 1.00 43.94 O HETATM 2377 O HOH 209 -10.133 -18.752 76.585 1.00 63.12 O HETATM 2378 O HOH 210 -1.403 -4.915 56.193 1.00 47.92 O HETATM 2379 O HOH 211 -12.238 -20.620 76.116 1.00 48.85 O HETATM 2380 O HOH 212 -2.997 -28.828 47.360 1.00 43.23 O HETATM 2381 O HOH 213 -5.264 0.107 59.774 1.00 34.85 O HETATM 2382 O HOH 214 0.830 -38.443 52.239 1.00 49.14 O HETATM 2383 O HOH 215 -11.857 -40.289 52.363 1.00 43.40 O HETATM 2384 O HOH 216 -16.877 -14.396 61.628 1.00 36.24 O HETATM 2385 O HOH 217 -0.522 -7.720 71.300 1.00 54.61 O HETATM 2386 O HOH 218 -11.972 -39.434 49.790 1.00 40.02 O HETATM 2387 O HOH 219 -18.080 -9.025 62.798 1.00 54.82 O HETATM 2388 O HOH 220 -9.544 -6.779 49.201 1.00 61.21 O HETATM 2389 O HOH 221 -18.951 -12.720 60.636 1.00 38.88 O HETATM 2390 C10 J A 8 -4.726 -16.796 68.572 1.00 0.14 C HETATM 2391 C09 J A 8 -5.369 -16.093 67.424 1.00 0.10 C HETATM 2392 N08 J A 8 -4.906 -16.613 66.148 1.00 -0.31 N HETATM 2393 C07 J A 8 -3.877 -16.046 65.424 1.00 0.03 C HETATM 2394 C21 J A 8 -3.137 -14.965 65.924 1.00 -0.02 C HETATM 2395 C22 J A 8 -2.150 -14.378 65.141 1.00 0.09 C HETATM 2396 C04 J A 8 -1.836 -14.899 63.868 1.00 0.04 C HETATM 2397 C02 J A 8 -0.831 -14.357 62.950 1.00 0.23 C HETATM 2398 N01 J A 8 -0.425 -13.068 63.022 1.00 -0.27 N HETATM 2399 H9 J A 8 -0.788 -12.454 63.765 1.00 0.32 H HETATM 2400 H10 J A 8 0.247 -12.701 62.334 1.00 0.32 H HETATM 2401 N03 J A 8 -0.352 -15.101 62.000 1.00 -0.27 N HETATM 2402 H11 J A 8 -0.643 -16.086 61.921 1.00 0.32 H HETATM 2403 H12 J A 8 0.319 -14.706 61.326 1.00 0.32 H HETATM 2404 C05 J A 8 -2.566 -16.003 63.412 1.00 -0.08 C HETATM 2405 C06 J A 8 -3.568 -16.567 64.176 1.00 -0.06 C HETATM 2406 H14 J A 8 -4.117 -17.422 63.798 1.00 0.04 H HETATM 2407 H13 J A 8 -2.340 -16.424 62.439 1.00 0.06 H HETATM 2408 O23 J A 8 -1.410 -13.289 65.532 1.00 -0.31 O HETATM 2409 C24 J A 8 -1.496 -12.781 66.868 1.00 0.11 C HETATM 2410 C25 J A 8 -2.730 -11.950 67.070 1.00 0.02 C HETATM 2411 C26 J A 8 -3.384 -11.914 68.298 1.00 -0.04 C HETATM 2412 C27 J A 8 -4.502 -11.112 68.462 1.00 -0.04 C HETATM 2413 C28 J A 8 -4.954 -10.388 67.379 1.00 0.00 C HETATM 2414 N29 J A 8 -4.375 -10.438 66.167 1.00 -0.30 N HETATM 2415 C30 J A 8 -3.270 -11.193 66.044 1.00 0.02 C HETATM 2416 H23 J A 8 -2.771 -11.210 65.082 1.00 0.08 H HETATM 2417 H8 J A 8 -5.818 -9.747 67.511 1.00 0.08 H HETATM 2418 H22 J A 8 -5.009 -11.055 69.418 1.00 0.07 H HETATM 2419 H7 J A 8 -3.019 -12.512 69.125 1.00 0.07 H HETATM 2420 H5 J A 8 -0.611 -12.160 67.070 1.00 0.08 H HETATM 2421 H6 J A 8 -1.518 -13.627 67.570 1.00 0.08 H HETATM 2422 H4 J A 8 -3.335 -14.587 66.921 1.00 0.04 H HETATM 2423 H15 J A 8 -5.370 -17.448 65.764 1.00 0.18 H HETATM 2424 H16 J A 8 -5.127 -15.021 67.481 1.00 0.08 H HETATM 2425 H17 J A 8 -6.459 -16.227 67.489 1.00 0.08 H HETATM 2426 N11 J A 8 -5.141 -16.668 69.851 1.00 -0.33 N HETATM 2427 C12 J A 8 -4.347 -17.497 70.590 1.00 0.01 C HETATM 2428 C13 J A 8 -3.516 -18.152 69.713 1.00 0.04 C HETATM 2429 N14 J A 8 -3.758 -17.695 68.440 1.00 -0.26 N HETATM 2430 H18 J A 8 -3.289 -17.987 67.570 1.00 0.24 H HETATM 2431 H1 J A 8 -2.784 -18.911 69.984 1.00 0.09 H HETATM 2432 C15 J A 8 -4.495 -17.676 72.047 1.00 -0.03 C HETATM 2433 C20 J A 8 -3.669 -18.562 72.739 1.00 -0.06 C HETATM 2434 C19 J A 8 -3.839 -18.763 74.104 1.00 -0.07 C HETATM 2435 C18 J A 8 -4.818 -18.069 74.796 1.00 -0.07 C HETATM 2436 C17 J A 8 -5.671 -17.222 74.114 1.00 -0.07 C HETATM 2437 C16 J A 8 -5.501 -17.008 72.751 1.00 -0.06 C HETATM 2438 H19 J A 8 -6.154 -16.317 72.230 1.00 0.06 H HETATM 2439 H2 J A 8 -6.475 -16.723 74.643 1.00 0.06 H HETATM 2440 H20 J A 8 -4.915 -18.190 75.869 1.00 0.06 H HETATM 2441 H21 J A 8 -3.203 -19.466 74.629 1.00 0.06 H HETATM 2442 H3 J A 8 -2.889 -19.097 72.209 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 35 34 2169 CONECT 59 58 1346 CONECT 260 259 399 CONECT 399 260 398 CONECT 1095 1094 2016 CONECT 1150 1149 1755 CONECT 1346 59 1345 CONECT 1457 1456 1596 CONECT 1596 1457 1595 CONECT 1681 1680 1888 CONECT 1755 1150 1754 CONECT 1888 1681 1887 CONECT 2016 1095 2015 CONECT 2169 35 CONECT 2390 2391 2426 2429 CONECT 2391 2390 2392 2424 2425 CONECT 2392 2391 2393 2423 CONECT 2393 2392 2394 2405 CONECT 2394 2393 2395 2422 CONECT 2395 2394 2396 2408 CONECT 2396 2395 2397 2404 CONECT 2397 2396 2398 2401 CONECT 2398 2397 2399 2400 CONECT 2399 2398 CONECT 2400 2398 CONECT 2401 2397 2402 2403 CONECT 2402 2401 CONECT 2403 2401 CONECT 2404 2396 2405 2407 CONECT 2405 2393 2404 2406 CONECT 2406 2405 CONECT 2407 2404 CONECT 2408 2395 2409 CONECT 2409 2408 2410 2420 2421 CONECT 2410 2409 2411 2415 CONECT 2411 2410 2412 2419 CONECT 2412 2411 2413 2418 CONECT 2413 2412 2414 2417 CONECT 2414 2413 2415 CONECT 2415 2410 2414 2416 CONECT 2416 2415 CONECT 2417 2413 CONECT 2418 2412 CONECT 2419 2411 CONECT 2420 2409 CONECT 2421 2409 CONECT 2422 2394 CONECT 2423 2392 CONECT 2424 2391 CONECT 2425 2391 CONECT 2426 2390 2427 CONECT 2427 2426 2428 2432 CONECT 2428 2427 2429 2431 CONECT 2429 2390 2428 2430 CONECT 2430 2429 CONECT 2431 2428 CONECT 2432 2427 2433 2437 CONECT 2433 2432 2434 2442 CONECT 2434 2433 2435 2441 CONECT 2435 2434 2436 2440 CONECT 2436 2435 2437 2439 CONECT 2437 2432 2436 2438 CONECT 2438 2437 CONECT 2439 2436 CONECT 2440 2435 CONECT 2441 2434 CONECT 2442 2433 MASTER 0 0 0 0 0 0 0 0 2441 1 71 18 END
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Structure:
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Related entries of code: 6qfe
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2psx
RCSB PDB
PDBbind
227aa, >2PSX_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
6qfh
RCSB PDB
PDBbind
J08
6qfg
RCSB PDB
PDBbind
J08
6qff
RCSB PDB
PDBbind
J08
Entry Information
PDB ID
6qfe
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Human Kallikrein 5
Ligand Name
J08
EC.Number
E.C.3.4.21
Resolution
1.67(Å)
Affinity (Kd/Ki/IC50)
IC50=0.08uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Acta Crystallogr.,Sect.F Vol. 75: pp. 385-391
Ligand Properties
Formula
C
2
3
H
2
3
N
6
O
Molecular Weight
399.468
Exact Mass
399.193
No. of atoms
53
No. of bonds
56
Polar Surface Area
114.44
LOGP Value
4.42 (
Computed with XLOGP3
)
2.90 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 4
Canonical SMILES
NC(=[NH2+])c1ccc(cc1OCc1cccnc1)NCc1[nH]cc(n1)c1ccccc1
InChI String
InChI=1S/C23H22N6O/c24-23(25)19-9-8-18(11-21(19)30-15-16-5-4-10-26-12-16)27-14-22-28-13-20(29-22)17-6-2-1-3-7-17/h1-13,27H,14-15H2,(H3,24,25)(H,28,29)/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):
Q9Y337
Entrez Gene ID
NCBI Entrez Gene ID:
25818
ASD
Information of known allosteric effects of PDB entries
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