Browse entries in the PDBbind-CN Database
HEADER 5JSG_COMPLEX COMPND 5JSG_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 148 HIS GLY SER ARG ARG ASN ILE VAL GLY CYS ARG ILE GLN SEQRES 2 A 148 HIS GLY TRP LYS GLU GLY ASN GLY PRO VAL THR GLN TRP SEQRES 3 A 148 LYS GLY THR VAL LEU ASP GLN VAL PRO VAL ASN PRO SER SEQRES 4 A 148 LEU TYR LEU ILE LYS TYR ASP GLY PHE ASP CYS VAL TYR SEQRES 5 A 148 GLY LEU GLU LEU ASN LYS ASP GLU ARG VAL SER ALA LEU SEQRES 6 A 148 GLU VAL LEU PRO ASP ARG VAL ALA THR SER ARG ILE SER SEQRES 7 A 148 ASP ALA HIS LEU ALA ASP THR MET ILE GLY LYS ALA VAL SEQRES 8 A 148 GLU HIS MET PHE GLU THR GLU ASP GLY SER LYS ASP GLU SEQRES 9 A 148 TRP ARG GLY MET VAL LEU ALA ARG ALA PRO VAL MET ASN SEQRES 10 A 148 THR TRP PHE TYR ILE THR TYR GLU LYS ASP PRO VAL LEU SEQRES 11 A 148 TYR MET TYR GLN LEU LEU ASP ASP TYR LYS GLU GLY ASP SEQRES 12 A 148 LEU ARG ILE MET PRO SEQRES 1 A 12 ASP SER LEU VAL GLY LYS GLN VAL GLU TYR ALA LYS SEQRES 1 A 32 ARG THR GLY MET VAL ILE HIS GLN VAL GLU ALA LYS PRO SEQRES 2 A 32 SER VAL TYR PHE ILE LYS PHE ASP ASP ASP PHE HIS ILE SEQRES 3 A 32 TYR VAL TYR ASP LEU VAL HET MG A 1 1 HET UNN A 246 96 ATOM 1 N HIS A 47 25.981 68.021 -2.333 1.00 65.21 N ATOM 2 CA HIS A 47 24.601 67.979 -1.862 1.00 75.14 C ATOM 3 C HIS A 47 24.510 67.334 -0.482 1.00 70.43 C ATOM 4 O HIS A 47 23.416 67.131 0.044 1.00 72.37 O ATOM 5 CB HIS A 47 23.722 67.231 -2.855 1.00 71.94 C ATOM 6 HN3 HIS A 47 26.355 67.053 -2.393 1.00 0.00 H ATOM 7 HN2 HIS A 47 26.556 68.576 -1.668 1.00 0.00 H ATOM 8 HN1 HIS A 47 26.012 68.465 -3.273 1.00 0.00 H ATOM 9 N GLY A 48 25.663 67.014 0.099 1.00 62.97 N ATOM 10 CA GLY A 48 25.701 66.407 1.415 1.00 53.74 C ATOM 11 C GLY A 48 26.331 65.030 1.423 1.00 65.21 C ATOM 12 O GLY A 48 25.797 64.093 0.821 1.00 62.15 O ATOM 13 H GLY A 48 26.555 67.203 -0.401 1.00 0.00 H ATOM 14 N SER A 49 27.470 64.894 2.101 1.00 58.46 N ATOM 15 CA SER A 49 28.164 63.620 2.221 1.00 49.40 C ATOM 16 C SER A 49 28.399 63.314 3.692 1.00 56.85 C ATOM 17 O SER A 49 28.869 64.175 4.443 1.00 58.82 O ATOM 18 CB SER A 49 29.496 63.631 1.466 1.00 59.75 C ATOM 19 OG SER A 49 30.507 64.260 2.231 1.00 63.64 O ATOM 20 HG SER A 49 30.628 63.770 3.083 1.00 0.00 H ATOM 21 H SER A 49 27.879 65.731 2.563 1.00 0.00 H ATOM 22 N ARG A 50 28.073 62.090 4.100 1.00 57.17 N ATOM 23 CA ARG A 50 28.262 61.642 5.470 1.00 42.40 C ATOM 24 C ARG A 50 28.990 60.308 5.467 1.00 43.02 C ATOM 25 O ARG A 50 29.089 59.633 4.440 1.00 43.75 O ATOM 26 CB ARG A 50 26.925 61.505 6.209 1.00 46.29 C ATOM 27 CG ARG A 50 25.893 60.687 5.456 1.00 51.50 C ATOM 28 CD ARG A 50 24.665 60.408 6.308 1.00 58.77 C ATOM 29 NE ARG A 50 23.680 59.607 5.586 1.00 65.81 N ATOM 30 CZ ARG A 50 22.690 60.117 4.860 1.00 63.21 C ATOM 31 NH1 ARG A 50 21.840 59.313 4.234 1.00 51.96 N ATOM 32 NH2 ARG A 50 22.549 61.433 4.761 1.00 67.07 N ATOM 33 HE ARG A 50 23.758 58.572 5.644 1.00 0.00 H ATOM 34 HH12 ARG A 50 21.066 59.714 3.667 1.00 0.00 H ATOM 35 HH11 ARG A 50 21.947 58.281 4.311 1.00 0.00 H ATOM 36 HH22 ARG A 50 21.774 61.832 4.193 1.00 0.00 H ATOM 37 HH21 ARG A 50 23.213 62.065 5.251 1.00 0.00 H ATOM 38 H ARG A 50 27.666 61.426 3.410 1.00 0.00 H ATOM 39 N ARG A 51 29.499 59.930 6.635 1.00 43.75 N ATOM 40 CA ARG A 51 30.182 58.652 6.763 1.00 44.07 C ATOM 41 C ARG A 51 29.182 57.501 6.745 1.00 44.95 C ATOM 42 O ARG A 51 28.004 57.662 7.076 1.00 39.46 O ATOM 43 CB ARG A 51 31.008 58.603 8.049 1.00 46.80 C ATOM 44 CG ARG A 51 32.311 59.399 8.010 1.00 65.31 C ATOM 45 CD ARG A 51 32.078 60.880 8.276 1.00 79.14 C ATOM 46 NE ARG A 51 33.330 61.619 8.420 1.00 73.51 N ATOM 47 CZ ARG A 51 33.404 62.908 8.734 1.00 77.52 C ATOM 48 NH1 ARG A 51 32.294 63.605 8.939 1.00 76.65 N ATOM 49 NH2 ARG A 51 34.586 63.501 8.845 1.00 68.66 N ATOM 50 HE ARG A 51 34.220 61.103 8.267 1.00 0.00 H ATOM 51 HH12 ARG A 51 32.351 64.614 9.185 1.00 0.00 H ATOM 52 HH11 ARG A 51 31.366 63.143 8.854 1.00 0.00 H ATOM 53 HH22 ARG A 51 34.641 64.510 9.091 1.00 0.00 H ATOM 54 HH21 ARG A 51 35.458 62.957 8.686 1.00 0.00 H ATOM 55 H ARG A 51 29.408 60.552 7.463 1.00 0.00 H ATOM 56 N ASN A 52 29.668 56.332 6.342 1.00 45.11 N ATOM 57 CA ASN A 52 28.860 55.124 6.342 1.00 39.11 C ATOM 58 C ASN A 52 28.784 54.549 7.753 1.00 46.41 C ATOM 59 O ASN A 52 29.731 54.650 8.538 1.00 47.09 O ATOM 60 CB ASN A 52 29.452 54.093 5.381 1.00 52.41 C ATOM 61 CG ASN A 52 28.460 53.017 4.993 1.00 56.66 C ATOM 62 OD1 ASN A 52 27.303 53.305 4.689 1.00 52.59 O ATOM 63 ND2 ASN A 52 28.907 51.765 5.010 1.00 43.32 N ATOM 64 HD22 ASN A 52 29.894 51.569 5.274 1.00 0.00 H ATOM 65 HD21 ASN A 52 28.270 50.982 4.760 1.00 0.00 H ATOM 66 H ASN A 52 30.655 56.280 6.017 1.00 0.00 H ATOM 67 N ILE A 53 27.645 53.937 8.071 1.00 42.30 N ATOM 68 CA ILE A 53 27.373 53.454 9.420 1.00 37.63 C ATOM 69 C ILE A 53 27.461 51.943 9.534 1.00 32.84 C ATOM 70 O ILE A 53 27.202 51.405 10.619 1.00 34.93 O ATOM 71 CB ILE A 53 26.007 53.947 9.931 1.00 31.65 C ATOM 72 CG1 ILE A 53 24.896 53.552 8.960 1.00 39.43 C ATOM 73 CG2 ILE A 53 26.023 55.453 10.117 1.00 34.67 C ATOM 74 CD1 ILE A 53 23.525 54.024 9.389 1.00 31.61 C ATOM 75 H ILE A 53 26.925 53.799 7.333 1.00 0.00 H ATOM 76 N VAL A 54 27.828 51.238 8.464 1.00 32.32 N ATOM 77 CA VAL A 54 27.942 49.786 8.542 1.00 33.99 C ATOM 78 C VAL A 54 29.119 49.418 9.436 1.00 27.90 C ATOM 79 O VAL A 54 30.235 49.926 9.267 1.00 31.27 O ATOM 80 CB VAL A 54 28.081 49.177 7.140 1.00 26.56 C ATOM 81 CG1 VAL A 54 28.272 47.667 7.238 1.00 28.25 C ATOM 82 CG2 VAL A 54 26.852 49.501 6.305 1.00 25.88 C ATOM 83 H VAL A 54 28.034 51.726 7.569 1.00 0.00 H ATOM 84 N GLY A 55 28.872 48.530 10.398 1.00 28.04 N ATOM 85 CA GLY A 55 29.866 48.159 11.376 1.00 19.48 C ATOM 86 C GLY A 55 29.881 49.021 12.617 1.00 23.91 C ATOM 87 O GLY A 55 30.574 48.678 13.584 1.00 27.81 O ATOM 88 H GLY A 55 27.931 48.089 10.446 1.00 0.00 H ATOM 89 N CYS A 56 29.139 50.122 12.627 1.00 19.38 N ATOM 90 CA CYS A 56 29.081 51.014 13.772 1.00 29.29 C ATOM 91 C CYS A 56 27.881 50.685 14.653 1.00 31.98 C ATOM 92 O CYS A 56 26.840 50.222 14.178 1.00 32.26 O ATOM 93 CB CYS A 56 28.996 52.476 13.321 1.00 38.74 C ATOM 94 SG CYS A 56 30.317 53.019 12.205 1.00 37.97 S ATOM 95 H CYS A 56 28.578 50.355 11.783 1.00 0.00 H ATOM 96 N ARG A 57 28.041 50.935 15.947 1.00 27.33 N ATOM 97 CA ARG A 57 26.929 50.900 16.884 1.00 27.99 C ATOM 98 C ARG A 57 26.236 52.257 16.920 1.00 29.20 C ATOM 99 O ARG A 57 26.891 53.304 16.944 1.00 30.65 O ATOM 100 CB ARG A 57 27.417 50.510 18.278 1.00 27.93 C ATOM 101 CG ARG A 57 27.892 49.069 18.356 1.00 30.05 C ATOM 102 CD ARG A 57 28.284 48.675 19.767 1.00 30.97 C ATOM 103 NE ARG A 57 27.366 49.181 20.785 1.00 26.17 N ATOM 104 CZ ARG A 57 26.130 48.729 20.978 1.00 29.11 C ATOM 105 NH1 ARG A 57 25.639 47.768 20.207 1.00 33.07 N ATOM 106 NH2 ARG A 57 25.376 49.248 21.935 1.00 32.11 N ATOM 107 HE ARG A 57 27.702 49.948 21.402 1.00 0.00 H ATOM 108 HH12 ARG A 57 24.672 47.419 20.363 1.00 0.00 H ATOM 109 HH11 ARG A 57 26.221 47.363 19.446 1.00 0.00 H ATOM 110 HH22 ARG A 57 24.410 48.894 22.085 1.00 0.00 H ATOM 111 HH21 ARG A 57 25.750 50.010 22.536 1.00 0.00 H ATOM 112 H ARG A 57 28.992 51.163 16.302 1.00 0.00 H ATOM 113 N ILE A 58 24.903 52.236 16.913 1.00 29.78 N ATOM 114 CA ILE A 58 24.111 53.455 16.833 1.00 26.94 C ATOM 115 C ILE A 58 23.083 53.472 17.955 1.00 30.75 C ATOM 116 O ILE A 58 22.793 52.453 18.586 1.00 32.25 O ATOM 117 CB ILE A 58 23.393 53.604 15.475 1.00 23.87 C ATOM 118 CG1 ILE A 58 22.312 52.530 15.336 1.00 22.03 C ATOM 119 CG2 ILE A 58 24.387 53.531 14.326 1.00 25.81 C ATOM 120 CD1 ILE A 58 21.450 52.689 14.112 1.00 25.27 C ATOM 121 H ILE A 58 24.413 51.320 16.966 1.00 0.00 H ATOM 122 N GLN A 59 22.529 54.659 18.188 1.00 25.55 N ATOM 123 CA GLN A 59 21.369 54.830 19.048 1.00 30.99 C ATOM 124 C GLN A 59 20.428 55.835 18.397 1.00 31.60 C ATOM 125 O GLN A 59 20.865 56.750 17.693 1.00 30.19 O ATOM 126 CB GLN A 59 21.752 55.294 20.462 1.00 34.06 C ATOM 127 CG GLN A 59 22.109 56.765 20.575 1.00 40.86 C ATOM 128 CD GLN A 59 22.325 57.202 22.012 1.00 55.02 C ATOM 129 OE1 GLN A 59 22.609 56.381 22.887 1.00 53.94 O ATOM 130 NE2 GLN A 59 22.185 58.501 22.265 1.00 51.81 N ATOM 131 HE22 GLN A 59 21.945 59.158 21.495 1.00 0.00 H ATOM 132 HE21 GLN A 59 22.316 58.859 23.232 1.00 0.00 H ATOM 133 H GLN A 59 22.943 55.499 17.736 1.00 0.00 H ATOM 134 N HIS A 60 19.130 55.650 18.625 1.00 29.31 N ATOM 135 CA HIS A 60 18.138 56.530 18.023 1.00 28.43 C ATOM 136 C HIS A 60 16.823 56.414 18.778 1.00 35.69 C ATOM 137 O HIS A 60 16.592 55.460 19.526 1.00 29.26 O ATOM 138 CB HIS A 60 17.927 56.204 16.541 1.00 24.76 C ATOM 139 CG HIS A 60 17.337 54.850 16.299 1.00 30.49 C ATOM 140 ND1 HIS A 60 15.986 54.596 16.400 1.00 27.99 N ATOM 141 CD2 HIS A 60 17.916 53.673 15.961 1.00 24.53 C ATOM 142 CE1 HIS A 60 15.757 53.323 16.133 1.00 24.87 C ATOM 143 NE2 HIS A 60 16.911 52.740 15.863 1.00 28.03 N ATOM 144 H HIS A 60 18.821 54.869 19.239 1.00 0.00 H ATOM 145 N GLY A 61 15.963 57.405 18.561 1.00 31.01 N ATOM 146 CA GLY A 61 14.627 57.386 19.115 1.00 21.96 C ATOM 147 C GLY A 61 13.620 56.816 18.133 1.00 27.69 C ATOM 148 O GLY A 61 13.800 56.881 16.917 1.00 24.38 O ATOM 149 H GLY A 61 16.259 58.214 17.978 1.00 0.00 H ATOM 150 N TRP A 62 12.545 56.254 18.681 1.00 21.48 N ATOM 151 CA TRP A 62 11.547 55.551 17.887 1.00 24.57 C ATOM 152 C TRP A 62 10.156 55.959 18.343 1.00 25.14 C ATOM 153 O TRP A 62 9.871 55.972 19.545 1.00 23.97 O ATOM 154 CB TRP A 62 11.726 54.034 18.011 1.00 25.83 C ATOM 155 CG TRP A 62 10.813 53.230 17.142 1.00 26.93 C ATOM 156 CD1 TRP A 62 9.742 52.487 17.546 1.00 32.18 C ATOM 157 CD2 TRP A 62 10.891 53.081 15.719 1.00 34.10 C ATOM 158 NE1 TRP A 62 9.152 51.878 16.463 1.00 38.51 N ATOM 159 CE2 TRP A 62 9.838 52.226 15.330 1.00 33.74 C ATOM 160 CE3 TRP A 62 11.752 53.583 14.737 1.00 37.00 C ATOM 161 CZ2 TRP A 62 9.620 51.866 14.001 1.00 29.02 C ATOM 162 CZ3 TRP A 62 11.535 53.223 13.416 1.00 38.54 C ATOM 163 CH2 TRP A 62 10.476 52.374 13.061 1.00 37.82 C ATOM 164 HE1 TRP A 62 8.320 51.255 16.499 1.00 0.00 H ATOM 165 H TRP A 62 12.413 56.319 19.711 1.00 0.00 H ATOM 166 N LYS A 63 9.295 56.287 17.384 1.00 27.14 N ATOM 167 CA LYS A 63 7.943 56.746 17.677 1.00 30.45 C ATOM 168 C LYS A 63 7.005 56.191 16.619 1.00 34.92 C ATOM 169 O LYS A 63 7.181 56.466 15.429 1.00 36.94 O ATOM 170 CB LYS A 63 7.873 58.274 17.709 1.00 27.14 C ATOM 171 CG LYS A 63 6.558 58.820 18.233 1.00 33.35 C ATOM 172 CD LYS A 63 6.565 60.341 18.259 1.00 39.59 C ATOM 173 CE LYS A 63 5.322 60.878 18.946 1.00 37.17 C ATOM 174 NZ LYS A 63 4.075 60.352 18.324 1.00 39.35 N ATOM 175 HZ1 LYS A 63 4.043 60.633 17.323 1.00 0.00 H ATOM 176 HZ2 LYS A 63 4.065 59.314 18.394 1.00 0.00 H ATOM 177 HZ3 LYS A 63 3.249 60.742 18.822 1.00 0.00 H ATOM 178 H LYS A 63 9.597 56.214 16.391 1.00 0.00 H ATOM 179 N GLU A 64 6.016 55.414 17.052 1.00 40.13 N ATOM 180 CA GLU A 64 5.034 54.807 16.162 1.00 44.07 C ATOM 181 C GLU A 64 3.642 55.240 16.599 1.00 41.08 C ATOM 182 O GLU A 64 3.244 54.992 17.743 1.00 45.71 O ATOM 183 CB GLU A 64 5.147 53.281 16.174 1.00 35.05 C ATOM 184 CG GLU A 64 4.018 52.582 15.436 1.00 40.79 C ATOM 185 CD GLU A 64 4.463 51.981 14.119 1.00 51.29 C ATOM 186 OE1 GLU A 64 5.230 50.996 14.150 1.00 62.93 O ATOM 187 OE2 GLU A 64 4.051 52.492 13.055 1.00 42.40 O ATOM 188 H GLU A 64 5.940 55.231 18.073 1.00 0.00 H ATOM 189 N GLY A 65 2.906 55.876 15.691 1.00 42.92 N ATOM 190 CA GLY A 65 1.556 56.304 16.012 1.00 43.01 C ATOM 191 C GLY A 65 1.553 57.356 17.102 1.00 45.82 C ATOM 192 O GLY A 65 2.422 58.233 17.157 1.00 40.11 O ATOM 193 H GLY A 65 3.299 56.067 14.747 1.00 0.00 H ATOM 194 N ASN A 66 0.565 57.266 17.990 1.00 42.61 N ATOM 195 CA ASN A 66 0.443 58.171 19.125 1.00 43.71 C ATOM 196 C ASN A 66 1.258 57.720 20.333 1.00 45.96 C ATOM 197 O ASN A 66 1.029 58.215 21.442 1.00 38.85 O ATOM 198 CB ASN A 66 -1.029 58.323 19.517 1.00 42.40 C ATOM 199 CG ASN A 66 -1.719 56.985 19.720 1.00 57.26 C ATOM 200 OD1 ASN A 66 -1.084 55.930 19.656 1.00 54.85 O ATOM 201 ND2 ASN A 66 -3.023 57.023 19.972 1.00 55.20 N ATOM 202 HD22 ASN A 66 -3.518 57.937 20.017 1.00 0.00 H ATOM 203 HD21 ASN A 66 -3.549 56.139 20.125 1.00 0.00 H ATOM 204 H ASN A 66 -0.149 56.519 17.868 1.00 0.00 H ATOM 205 N GLY A 67 2.201 56.800 20.144 1.00 40.17 N ATOM 206 CA GLY A 67 3.014 56.311 21.230 1.00 36.03 C ATOM 207 C GLY A 67 4.147 57.259 21.556 1.00 32.28 C ATOM 208 O GLY A 67 4.490 58.146 20.770 1.00 38.69 O ATOM 209 H GLY A 67 2.356 56.423 19.187 1.00 0.00 H ATOM 210 N PRO A 68 4.743 57.098 22.733 1.00 30.77 N ATOM 211 CA PRO A 68 5.874 57.952 23.113 1.00 29.87 C ATOM 212 C PRO A 68 7.142 57.552 22.375 1.00 32.55 C ATOM 213 O PRO A 68 7.230 56.502 21.735 1.00 27.29 O ATOM 214 CB PRO A 68 6.008 57.717 24.619 1.00 29.21 C ATOM 215 CG PRO A 68 5.465 56.335 24.824 1.00 29.12 C ATOM 216 CD PRO A 68 4.357 56.172 23.813 1.00 28.45 C ATOM 217 N VAL A 69 8.142 58.422 22.477 1.00 30.07 N ATOM 218 CA VAL A 69 9.449 58.160 21.885 1.00 28.15 C ATOM 219 C VAL A 69 10.217 57.212 22.798 1.00 32.79 C ATOM 220 O VAL A 69 10.407 57.492 23.986 1.00 31.15 O ATOM 221 CB VAL A 69 10.228 59.464 21.659 1.00 33.23 C ATOM 222 CG1 VAL A 69 11.646 59.157 21.208 1.00 29.23 C ATOM 223 CG2 VAL A 69 9.515 60.338 20.635 1.00 33.01 C ATOM 224 H VAL A 69 7.988 59.312 22.992 1.00 0.00 H ATOM 225 N THR A 70 10.650 56.085 22.247 1.00 32.47 N ATOM 226 CA THR A 70 11.451 55.115 22.975 1.00 26.54 C ATOM 227 C THR A 70 12.886 55.139 22.458 1.00 30.03 C ATOM 228 O THR A 70 13.144 55.493 21.304 1.00 27.84 O ATOM 229 CB THR A 70 10.853 53.709 22.850 1.00 29.85 C ATOM 230 OG1 THR A 70 10.714 53.367 21.467 1.00 28.57 O ATOM 231 CG2 THR A 70 9.479 53.664 23.503 1.00 31.57 C ATOM 232 HG1 THR A 70 10.115 54.020 21.025 1.00 0.00 H ATOM 233 H THR A 70 10.407 55.888 21.255 1.00 0.00 H ATOM 234 N GLN A 71 13.819 54.774 23.335 1.00 35.95 N ATOM 235 CA GLN A 71 15.247 54.838 23.055 1.00 32.77 C ATOM 236 C GLN A 71 15.780 53.445 22.750 1.00 30.16 C ATOM 237 O GLN A 71 15.383 52.468 23.390 1.00 32.70 O ATOM 238 CB GLN A 71 16.000 55.439 24.244 1.00 28.06 C ATOM 239 CG GLN A 71 17.500 55.563 24.042 1.00 36.51 C ATOM 240 CD GLN A 71 17.869 56.660 23.061 1.00 51.56 C ATOM 241 OE1 GLN A 71 17.047 57.518 22.734 1.00 50.38 O ATOM 242 NE2 GLN A 71 19.114 56.641 22.589 1.00 49.32 N ATOM 243 HE22 GLN A 71 19.774 55.897 22.893 1.00 0.00 H ATOM 244 HE21 GLN A 71 19.426 57.370 21.916 1.00 0.00 H ATOM 245 H GLN A 71 13.513 54.426 24.266 1.00 0.00 H ATOM 246 N TRP A 72 16.686 53.359 21.772 1.00 32.80 N ATOM 247 CA TRP A 72 17.207 52.081 21.301 1.00 26.43 C ATOM 248 C TRP A 72 18.689 52.191 20.975 1.00 24.85 C ATOM 249 O TRP A 72 19.139 53.199 20.430 1.00 30.79 O ATOM 250 CB TRP A 72 16.453 51.596 20.055 1.00 21.23 C ATOM 251 CG TRP A 72 14.991 51.379 20.286 1.00 28.14 C ATOM 252 CD1 TRP A 72 13.997 52.306 20.181 1.00 25.63 C ATOM 253 CD2 TRP A 72 14.356 50.152 20.664 1.00 29.02 C ATOM 254 NE1 TRP A 72 12.782 51.734 20.471 1.00 25.99 N ATOM 255 CE2 TRP A 72 12.975 50.411 20.770 1.00 30.92 C ATOM 256 CE3 TRP A 72 14.821 48.860 20.920 1.00 25.11 C ATOM 257 CZ2 TRP A 72 12.057 49.425 21.123 1.00 31.91 C ATOM 258 CZ3 TRP A 72 13.909 47.886 21.274 1.00 26.49 C ATOM 259 CH2 TRP A 72 12.544 48.173 21.371 1.00 29.82 C ATOM 260 HE1 TRP A 72 11.865 52.225 20.465 1.00 0.00 H ATOM 261 H TRP A 72 17.032 54.235 21.331 1.00 0.00 H ATOM 262 N LYS A 73 19.439 51.143 21.308 1.00 25.25 N ATOM 263 CA LYS A 73 20.820 50.978 20.882 1.00 25.96 C ATOM 264 C LYS A 73 20.918 49.745 19.994 1.00 26.03 C ATOM 265 O LYS A 73 20.188 48.769 20.188 1.00 29.89 O ATOM 266 CB LYS A 73 21.771 50.826 22.077 1.00 28.02 C ATOM 267 CG LYS A 73 22.182 52.120 22.760 1.00 33.80 C ATOM 268 CD LYS A 73 23.182 51.832 23.881 1.00 34.62 C ATOM 269 CE LYS A 73 23.897 53.088 24.360 1.00 40.32 C ATOM 270 NZ LYS A 73 23.026 53.971 25.179 1.00 54.26 N ATOM 271 HZ1 LYS A 73 22.206 54.268 24.613 1.00 0.00 H ATOM 272 HZ2 LYS A 73 22.699 53.451 26.019 1.00 0.00 H ATOM 273 HZ3 LYS A 73 23.566 54.809 25.477 1.00 0.00 H ATOM 274 H LYS A 73 19.015 50.403 21.904 1.00 0.00 H ATOM 275 N GLY A 74 21.825 49.786 19.023 1.00 28.01 N ATOM 276 CA GLY A 74 21.949 48.666 18.105 1.00 26.83 C ATOM 277 C GLY A 74 23.253 48.702 17.338 1.00 26.56 C ATOM 278 O GLY A 74 24.011 49.675 17.393 1.00 26.64 O ATOM 279 H GLY A 74 22.443 50.616 18.921 1.00 0.00 H ATOM 280 N THR A 75 23.494 47.612 16.611 1.00 27.10 N ATOM 281 CA THR A 75 24.678 47.432 15.781 1.00 23.89 C ATOM 282 C THR A 75 24.256 47.252 14.331 1.00 21.48 C ATOM 283 O THR A 75 23.459 46.359 14.022 1.00 26.93 O ATOM 284 CB THR A 75 25.494 46.211 16.225 1.00 29.19 C ATOM 285 OG1 THR A 75 25.877 46.350 17.600 1.00 35.06 O ATOM 286 CG2 THR A 75 26.742 46.062 15.359 1.00 27.87 C ATOM 287 HG1 THR A 75 25.065 46.421 18.162 1.00 0.00 H ATOM 288 H THR A 75 22.795 46.843 16.637 1.00 0.00 H ATOM 289 N VAL A 76 24.800 48.082 13.446 1.00 21.93 N ATOM 290 CA VAL A 76 24.501 47.988 12.019 1.00 21.99 C ATOM 291 C VAL A 76 25.343 46.869 11.417 1.00 28.76 C ATOM 292 O VAL A 76 26.577 46.945 11.399 1.00 24.66 O ATOM 293 CB VAL A 76 24.761 49.324 11.307 1.00 20.71 C ATOM 294 CG1 VAL A 76 24.417 49.218 9.826 1.00 14.59 C ATOM 295 CG2 VAL A 76 23.966 50.439 11.962 1.00 19.53 C ATOM 296 H VAL A 76 25.456 48.818 13.778 1.00 0.00 H ATOM 297 N LEU A 77 24.675 45.828 10.920 1.00 26.98 N ATOM 298 CA LEU A 77 25.356 44.640 10.423 1.00 21.64 C ATOM 299 C LEU A 77 25.765 44.774 8.961 1.00 26.87 C ATOM 300 O LEU A 77 26.889 44.417 8.597 1.00 29.86 O ATOM 301 CB LEU A 77 24.460 43.413 10.596 1.00 24.34 C ATOM 302 CG LEU A 77 24.072 43.047 12.028 1.00 32.18 C ATOM 303 CD1 LEU A 77 22.927 42.053 12.010 1.00 20.30 C ATOM 304 CD2 LEU A 77 25.266 42.484 12.782 1.00 30.03 C ATOM 305 H LEU A 77 23.636 45.865 10.886 1.00 0.00 H ATOM 306 N ASP A 78 24.865 45.260 8.111 1.00 32.54 N ATOM 307 CA ASP A 78 25.128 45.294 6.679 1.00 31.86 C ATOM 308 C ASP A 78 24.194 46.303 6.025 1.00 30.51 C ATOM 309 O ASP A 78 23.264 46.820 6.649 1.00 27.06 O ATOM 310 CB ASP A 78 24.966 43.902 6.054 1.00 34.97 C ATOM 311 CG ASP A 78 25.568 43.807 4.662 1.00 44.97 C ATOM 312 OD1 ASP A 78 26.424 44.652 4.318 1.00 41.58 O ATOM 313 OD2 ASP A 78 25.184 42.886 3.912 1.00 55.74 O ATOM 314 H ASP A 78 23.960 45.621 8.474 1.00 0.00 H ATOM 315 N GLN A 79 24.463 46.574 4.751 1.00 31.10 N ATOM 316 CA GLN A 79 23.672 47.474 3.924 1.00 36.81 C ATOM 317 C GLN A 79 23.230 46.716 2.680 1.00 37.10 C ATOM 318 O GLN A 79 24.052 46.075 2.016 1.00 35.74 O ATOM 319 CB GLN A 79 24.486 48.714 3.545 1.00 33.07 C ATOM 320 CG GLN A 79 23.718 49.787 2.800 1.00 40.82 C ATOM 321 CD GLN A 79 24.581 50.997 2.504 1.00 41.55 C ATOM 322 OE1 GLN A 79 25.803 50.945 2.644 1.00 39.88 O ATOM 323 NE2 GLN A 79 23.951 52.095 2.100 1.00 45.60 N ATOM 324 HE22 GLN A 79 22.916 52.092 1.996 1.00 0.00 H ATOM 325 HE21 GLN A 79 24.493 52.957 1.888 1.00 0.00 H ATOM 326 H GLN A 79 25.290 46.114 4.319 1.00 0.00 H ATOM 327 N VAL A 80 21.939 46.780 2.373 1.00 30.32 N ATOM 328 CA VAL A 80 21.365 45.980 1.294 1.00 41.29 C ATOM 329 C VAL A 80 21.781 46.547 -0.057 1.00 40.31 C ATOM 330 O VAL A 80 21.539 47.730 -0.335 1.00 37.98 O ATOM 331 CB VAL A 80 19.836 45.907 1.412 1.00 36.30 C ATOM 332 CG1 VAL A 80 19.259 45.117 0.249 1.00 32.56 C ATOM 333 CG2 VAL A 80 19.447 45.280 2.741 1.00 33.34 C ATOM 334 H VAL A 80 21.321 47.417 2.915 1.00 0.00 H ATOM 335 N PRO A 81 22.402 45.743 -0.923 1.00 44.44 N ATOM 336 CA PRO A 81 22.819 46.269 -2.238 1.00 36.13 C ATOM 337 C PRO A 81 21.665 46.761 -3.098 1.00 38.15 C ATOM 338 O PRO A 81 21.741 47.863 -3.657 1.00 50.89 O ATOM 339 CB PRO A 81 23.541 45.071 -2.872 1.00 35.14 C ATOM 340 CG PRO A 81 23.999 44.247 -1.703 1.00 37.20 C ATOM 341 CD PRO A 81 22.910 44.382 -0.680 1.00 41.42 C ATOM 342 N VAL A 82 20.588 45.985 -3.213 1.00 41.69 N ATOM 343 CA VAL A 82 19.499 46.321 -4.125 1.00 43.62 C ATOM 344 C VAL A 82 18.600 47.391 -3.521 1.00 37.02 C ATOM 345 O VAL A 82 17.527 47.686 -4.059 1.00 47.33 O ATOM 346 CB VAL A 82 18.679 45.075 -4.504 1.00 43.19 C ATOM 347 CG1 VAL A 82 19.556 44.081 -5.235 1.00 38.71 C ATOM 348 CG2 VAL A 82 18.052 44.448 -3.269 1.00 37.60 C ATOM 349 H VAL A 82 20.522 45.120 -2.640 1.00 0.00 H ATOM 350 N ASN A 83 19.028 47.970 -2.404 1.00 35.14 N ATOM 351 CA ASN A 83 18.336 49.088 -1.777 1.00 33.70 C ATOM 352 C ASN A 83 19.220 49.655 -0.677 1.00 37.78 C ATOM 353 O ASN A 83 19.055 49.300 0.498 1.00 32.58 O ATOM 354 CB ASN A 83 16.983 48.660 -1.211 1.00 34.48 C ATOM 355 CG ASN A 83 16.229 49.813 -0.595 1.00 38.12 C ATOM 356 OD1 ASN A 83 16.619 50.973 -0.743 1.00 43.26 O ATOM 357 ND2 ASN A 83 15.143 49.507 0.101 1.00 25.83 N ATOM 358 HD22 ASN A 83 14.851 48.514 0.200 1.00 0.00 H ATOM 359 HD21 ASN A 83 14.583 50.260 0.549 1.00 0.00 H ATOM 360 H ASN A 83 19.895 47.609 -1.958 1.00 0.00 H ATOM 361 N PRO A 84 20.159 50.545 -1.013 1.00 39.93 N ATOM 362 CA PRO A 84 21.150 50.987 -0.019 1.00 31.83 C ATOM 363 C PRO A 84 20.558 51.781 1.134 1.00 33.72 C ATOM 364 O PRO A 84 21.272 52.029 2.113 1.00 34.72 O ATOM 365 CB PRO A 84 22.116 51.849 -0.845 1.00 39.71 C ATOM 366 CG PRO A 84 21.847 51.488 -2.273 1.00 27.34 C ATOM 367 CD PRO A 84 20.395 51.157 -2.329 1.00 31.48 C ATOM 368 N SER A 85 19.290 52.189 1.056 1.00 31.73 N ATOM 369 CA SER A 85 18.663 52.858 2.189 1.00 30.83 C ATOM 370 C SER A 85 18.321 51.889 3.312 1.00 29.64 C ATOM 371 O SER A 85 18.085 52.328 4.441 1.00 32.06 O ATOM 372 CB SER A 85 17.407 53.596 1.730 1.00 35.21 C ATOM 373 OG SER A 85 17.744 54.631 0.821 1.00 57.67 O ATOM 374 HG SER A 85 18.351 55.274 1.265 1.00 0.00 H ATOM 375 H SER A 85 18.747 52.029 0.184 1.00 0.00 H ATOM 376 N LEU A 86 18.302 50.588 3.032 1.00 36.15 N ATOM 377 CA LEU A 86 17.890 49.573 3.992 1.00 32.83 C ATOM 378 C LEU A 86 19.116 48.999 4.694 1.00 30.18 C ATOM 379 O LEU A 86 20.037 48.500 4.037 1.00 29.01 O ATOM 380 CB LEU A 86 17.102 48.466 3.292 1.00 26.79 C ATOM 381 CG LEU A 86 16.592 47.318 4.160 1.00 25.17 C ATOM 382 CD1 LEU A 86 15.715 47.842 5.275 1.00 24.64 C ATOM 383 CD2 LEU A 86 15.836 46.314 3.309 1.00 28.84 C ATOM 384 H LEU A 86 18.595 50.281 2.082 1.00 0.00 H ATOM 385 N TYR A 87 19.122 49.068 6.021 1.00 27.40 N ATOM 386 CA TYR A 87 20.184 48.506 6.840 1.00 26.38 C ATOM 387 C TYR A 87 19.655 47.327 7.646 1.00 30.14 C ATOM 388 O TYR A 87 18.476 47.276 8.006 1.00 22.01 O ATOM 389 CB TYR A 87 20.760 49.553 7.797 1.00 26.86 C ATOM 390 CG TYR A 87 21.394 50.745 7.118 1.00 34.88 C ATOM 391 CD1 TYR A 87 20.626 51.830 6.712 1.00 28.85 C ATOM 392 CD2 TYR A 87 22.766 50.794 6.895 1.00 36.55 C ATOM 393 CE1 TYR A 87 21.205 52.924 6.096 1.00 36.03 C ATOM 394 CE2 TYR A 87 23.353 51.885 6.281 1.00 42.02 C ATOM 395 CZ TYR A 87 22.568 52.946 5.884 1.00 40.71 C ATOM 396 OH TYR A 87 23.146 54.032 5.275 1.00 46.10 O ATOM 397 HH TYR A 87 22.446 54.697 5.056 1.00 0.00 H ATOM 398 H TYR A 87 18.330 49.546 6.496 1.00 0.00 H ATOM 399 N LEU A 88 20.542 46.377 7.922 1.00 27.85 N ATOM 400 CA LEU A 88 20.258 45.283 8.840 1.00 23.91 C ATOM 401 C LEU A 88 20.873 45.626 10.189 1.00 23.54 C ATOM 402 O LEU A 88 22.088 45.825 10.287 1.00 24.87 O ATOM 403 CB LEU A 88 20.811 43.959 8.316 1.00 22.80 C ATOM 404 CG LEU A 88 20.307 43.511 6.946 1.00 26.21 C ATOM 405 CD1 LEU A 88 20.706 42.066 6.701 1.00 17.82 C ATOM 406 CD2 LEU A 88 18.799 43.694 6.829 1.00 19.98 C ATOM 407 H LEU A 88 21.475 46.416 7.465 1.00 0.00 H ATOM 408 N ILE A 89 20.036 45.694 11.220 1.00 18.83 N ATOM 409 CA ILE A 89 20.450 46.120 12.550 1.00 21.39 C ATOM 410 C ILE A 89 20.141 45.007 13.539 1.00 21.99 C ATOM 411 O ILE A 89 19.087 44.366 13.460 1.00 25.22 O ATOM 412 CB ILE A 89 19.746 47.430 12.973 1.00 24.87 C ATOM 413 CG1 ILE A 89 19.988 48.538 11.945 1.00 29.43 C ATOM 414 CG2 ILE A 89 20.215 47.884 14.349 1.00 24.74 C ATOM 415 CD1 ILE A 89 18.868 48.699 10.936 1.00 35.81 C ATOM 416 H ILE A 89 19.041 45.431 11.070 1.00 0.00 H ATOM 417 N LYS A 90 21.061 44.778 14.468 1.00 20.78 N ATOM 418 CA LYS A 90 20.811 43.947 15.638 1.00 25.59 C ATOM 419 C LYS A 90 20.694 44.875 16.843 1.00 26.76 C ATOM 420 O LYS A 90 21.687 45.473 17.272 1.00 24.31 O ATOM 421 CB LYS A 90 21.921 42.919 15.838 1.00 26.59 C ATOM 422 CG LYS A 90 21.597 41.881 16.897 1.00 23.60 C ATOM 423 CD LYS A 90 22.838 41.423 17.638 1.00 27.84 C ATOM 424 CE LYS A 90 22.493 40.307 18.609 1.00 38.78 C ATOM 425 NZ LYS A 90 21.321 40.658 19.459 1.00 38.02 N ATOM 426 HZ1 LYS A 90 21.536 41.515 20.008 1.00 0.00 H ATOM 427 HZ2 LYS A 90 20.494 40.832 18.853 1.00 0.00 H ATOM 428 HZ3 LYS A 90 21.117 39.871 20.108 1.00 0.00 H ATOM 429 H LYS A 90 22.000 45.210 14.356 1.00 0.00 H ATOM 430 N TYR A 91 19.486 45.002 17.381 1.00 25.56 N ATOM 431 CA TYR A 91 19.259 45.881 18.520 1.00 26.02 C ATOM 432 C TYR A 91 19.690 45.205 19.814 1.00 27.81 C ATOM 433 O TYR A 91 19.538 43.992 19.979 1.00 30.05 O ATOM 434 CB TYR A 91 17.789 46.288 18.595 1.00 20.97 C ATOM 435 CG TYR A 91 17.416 47.305 17.543 1.00 26.82 C ATOM 436 CD1 TYR A 91 17.696 48.654 17.730 1.00 25.82 C ATOM 437 CD2 TYR A 91 16.793 46.921 16.361 1.00 22.39 C ATOM 438 CE1 TYR A 91 17.365 49.592 16.772 1.00 23.56 C ATOM 439 CE2 TYR A 91 16.455 47.853 15.397 1.00 26.19 C ATOM 440 CZ TYR A 91 16.747 49.186 15.609 1.00 26.88 C ATOM 441 OH TYR A 91 16.418 50.115 14.657 1.00 23.64 O ATOM 442 HH TYR A 91 16.695 51.014 14.965 1.00 0.00 H ATOM 443 H TYR A 91 18.689 44.465 16.982 1.00 0.00 H ATOM 444 N ASP A 92 20.242 46.003 20.727 1.00 39.02 N ATOM 445 CA ASP A 92 20.754 45.485 21.991 1.00 37.22 C ATOM 446 C ASP A 92 19.652 44.774 22.764 1.00 37.27 C ATOM 447 O ASP A 92 18.600 45.358 23.043 1.00 36.53 O ATOM 448 CB ASP A 92 21.335 46.626 22.826 1.00 39.64 C ATOM 449 CG ASP A 92 22.663 47.132 22.290 1.00 40.63 C ATOM 450 OD1 ASP A 92 23.003 46.824 21.128 1.00 39.08 O ATOM 451 OD2 ASP A 92 23.368 47.845 23.035 1.00 37.28 O ATOM 452 H ASP A 92 20.310 47.023 20.533 1.00 0.00 H ATOM 453 N GLY A 93 19.893 43.511 23.102 1.00 34.59 N ATOM 454 CA GLY A 93 18.971 42.748 23.913 1.00 34.82 C ATOM 455 C GLY A 93 17.956 41.922 23.161 1.00 34.59 C ATOM 456 O GLY A 93 17.058 41.356 23.793 1.00 39.20 O ATOM 457 H GLY A 93 20.770 43.059 22.774 1.00 0.00 H ATOM 458 N PHE A 94 18.058 41.836 21.838 1.00 30.17 N ATOM 459 CA PHE A 94 17.132 41.048 21.040 1.00 31.71 C ATOM 460 C PHE A 94 17.914 40.381 19.921 1.00 32.04 C ATOM 461 O PHE A 94 18.930 40.906 19.460 1.00 34.02 O ATOM 462 CB PHE A 94 15.996 41.913 20.477 1.00 32.28 C ATOM 463 CG PHE A 94 15.440 42.893 21.472 1.00 35.54 C ATOM 464 CD1 PHE A 94 14.406 42.530 22.320 1.00 36.42 C ATOM 465 CD2 PHE A 94 15.965 44.173 21.573 1.00 36.80 C ATOM 466 CE1 PHE A 94 13.900 43.427 23.241 1.00 32.41 C ATOM 467 CE2 PHE A 94 15.465 45.073 22.493 1.00 37.45 C ATOM 468 CZ PHE A 94 14.431 44.700 23.328 1.00 36.80 C ATOM 469 H PHE A 94 18.825 42.349 21.358 1.00 0.00 H ATOM 470 N ASP A 95 17.439 39.216 19.486 1.00 33.84 N ATOM 471 CA ASP A 95 18.213 38.374 18.584 1.00 31.74 C ATOM 472 C ASP A 95 17.631 38.284 17.178 1.00 30.42 C ATOM 473 O ASP A 95 18.153 37.523 16.359 1.00 34.72 O ATOM 474 CB ASP A 95 18.374 36.977 19.181 1.00 37.27 C ATOM 475 CG ASP A 95 19.139 36.994 20.491 1.00 49.10 C ATOM 476 OD1 ASP A 95 20.343 37.339 20.473 1.00 40.74 O ATOM 477 OD2 ASP A 95 18.536 36.664 21.535 1.00 46.55 O ATOM 478 H ASP A 95 16.498 38.901 19.796 1.00 0.00 H ATOM 479 N CYS A 96 16.578 39.037 16.871 1.00 30.09 N ATOM 480 CA CYS A 96 16.135 39.158 15.489 1.00 27.87 C ATOM 481 C CYS A 96 16.967 40.205 14.766 1.00 27.42 C ATOM 482 O CYS A 96 17.387 41.206 15.357 1.00 27.16 O ATOM 483 CB CYS A 96 14.657 39.545 15.411 1.00 29.08 C ATOM 484 SG CYS A 96 13.488 38.314 16.008 1.00 51.02 S ATOM 485 H CYS A 96 16.068 39.543 17.623 1.00 0.00 H ATOM 486 N VAL A 97 17.206 39.971 13.486 1.00 26.76 N ATOM 487 CA VAL A 97 17.810 40.974 12.622 1.00 26.67 C ATOM 488 C VAL A 97 16.687 41.764 11.969 1.00 24.99 C ATOM 489 O VAL A 97 15.756 41.184 11.399 1.00 27.16 O ATOM 490 CB VAL A 97 18.723 40.324 11.573 1.00 22.99 C ATOM 491 CG1 VAL A 97 19.283 41.377 10.636 1.00 23.40 C ATOM 492 CG2 VAL A 97 19.840 39.564 12.260 1.00 22.82 C ATOM 493 H VAL A 97 16.955 39.044 13.086 1.00 0.00 H ATOM 494 N TYR A 98 16.760 43.085 12.067 1.00 27.08 N ATOM 495 CA TYR A 98 15.697 43.948 11.585 1.00 26.10 C ATOM 496 C TYR A 98 16.177 44.786 10.409 1.00 25.90 C ATOM 497 O TYR A 98 17.368 45.089 10.279 1.00 25.68 O ATOM 498 CB TYR A 98 15.178 44.856 12.705 1.00 23.90 C ATOM 499 CG TYR A 98 14.566 44.086 13.851 1.00 22.63 C ATOM 500 CD1 TYR A 98 13.247 43.659 13.798 1.00 25.16 C ATOM 501 CD2 TYR A 98 15.313 43.769 14.978 1.00 25.80 C ATOM 502 CE1 TYR A 98 12.685 42.944 14.840 1.00 26.59 C ATOM 503 CE2 TYR A 98 14.760 43.054 16.026 1.00 26.36 C ATOM 504 CZ TYR A 98 13.446 42.644 15.950 1.00 25.70 C ATOM 505 OH TYR A 98 12.888 41.935 16.988 1.00 26.96 O ATOM 506 HH TYR A 98 11.946 41.722 16.772 1.00 0.00 H ATOM 507 H TYR A 98 17.602 43.514 12.501 1.00 0.00 H ATOM 508 N GLY A 99 15.231 45.138 9.545 1.00 25.50 N ATOM 509 CA GLY A 99 15.502 46.010 8.424 1.00 25.61 C ATOM 510 C GLY A 99 14.801 47.344 8.572 1.00 28.91 C ATOM 511 O GLY A 99 13.570 47.402 8.652 1.00 28.69 O ATOM 512 H GLY A 99 14.266 44.775 9.679 1.00 0.00 H ATOM 513 N LEU A 100 15.578 48.422 8.621 1.00 23.95 N ATOM 514 CA LEU A 100 15.035 49.767 8.719 1.00 31.21 C ATOM 515 C LEU A 100 15.781 50.687 7.767 1.00 29.93 C ATOM 516 O LEU A 100 16.974 50.508 7.508 1.00 29.68 O ATOM 517 CB LEU A 100 15.133 50.330 10.142 1.00 29.50 C ATOM 518 CG LEU A 100 14.374 49.621 11.262 1.00 36.25 C ATOM 519 CD1 LEU A 100 15.239 48.551 11.915 1.00 34.06 C ATOM 520 CD2 LEU A 100 13.895 50.632 12.286 1.00 35.04 C ATOM 521 H LEU A 100 16.610 48.299 8.588 1.00 0.00 H ATOM 522 N GLU A 101 15.060 51.679 7.247 1.00 32.72 N ATOM 523 CA GLU A 101 15.679 52.761 6.485 1.00 32.57 C ATOM 524 C GLU A 101 15.973 53.895 7.463 1.00 25.02 C ATOM 525 O GLU A 101 15.209 54.848 7.619 1.00 34.51 O ATOM 526 CB GLU A 101 14.780 53.195 5.337 1.00 28.88 C ATOM 527 CG GLU A 101 14.331 52.030 4.467 1.00 26.69 C ATOM 528 CD GLU A 101 14.040 52.440 3.038 1.00 39.17 C ATOM 529 OE1 GLU A 101 14.314 51.633 2.122 1.00 42.42 O ATOM 530 OE2 GLU A 101 13.548 53.571 2.829 1.00 56.29 O ATOM 531 H GLU A 101 14.029 51.683 7.387 1.00 0.00 H ATOM 532 N LEU A 102 17.122 53.772 8.133 1.00 26.12 N ATOM 533 CA LEU A 102 17.468 54.624 9.265 1.00 29.12 C ATOM 534 C LEU A 102 17.602 56.096 8.899 1.00 34.13 C ATOM 535 O LEU A 102 17.606 56.938 9.804 1.00 39.24 O ATOM 536 CB LEU A 102 18.771 54.131 9.898 1.00 35.96 C ATOM 537 CG LEU A 102 18.738 52.741 10.533 1.00 27.57 C ATOM 538 CD1 LEU A 102 20.150 52.224 10.752 1.00 34.66 C ATOM 539 CD2 LEU A 102 17.969 52.774 11.843 1.00 25.50 C ATOM 540 H LEU A 102 17.797 53.039 7.835 1.00 0.00 H ATOM 541 N ASN A 103 17.715 56.432 7.615 1.00 37.80 N ATOM 542 CA ASN A 103 17.854 57.819 7.197 1.00 34.24 C ATOM 543 C ASN A 103 16.597 58.389 6.553 1.00 36.06 C ATOM 544 O ASN A 103 16.493 59.613 6.426 1.00 41.04 O ATOM 545 CB ASN A 103 19.035 57.967 6.224 1.00 35.36 C ATOM 546 CG ASN A 103 20.379 57.776 6.903 1.00 34.46 C ATOM 547 OD1 ASN A 103 20.597 58.251 8.017 1.00 41.62 O ATOM 548 ND2 ASN A 103 21.285 57.072 6.234 1.00 38.28 N ATOM 549 HD22 ASN A 103 21.056 56.689 5.294 1.00 0.00 H ATOM 550 HD21 ASN A 103 22.223 56.903 6.650 1.00 0.00 H ATOM 551 H ASN A 103 17.704 55.684 6.893 1.00 0.00 H ATOM 552 N LYS A 104 15.641 57.547 6.153 1.00 34.67 N ATOM 553 CA LYS A 104 14.413 58.016 5.527 1.00 34.33 C ATOM 554 C LYS A 104 13.159 57.781 6.357 1.00 38.02 C ATOM 555 O LYS A 104 12.164 58.482 6.150 1.00 31.82 O ATOM 556 CB LYS A 104 14.219 57.342 4.162 1.00 33.77 C ATOM 557 CG LYS A 104 15.322 57.624 3.170 1.00 44.07 C ATOM 558 CD LYS A 104 15.046 56.925 1.855 1.00 44.19 C ATOM 559 CE LYS A 104 16.051 57.335 0.802 1.00 46.20 C ATOM 560 NZ LYS A 104 15.804 56.638 -0.490 1.00 76.32 N ATOM 561 HZ1 LYS A 104 15.877 55.610 -0.348 1.00 0.00 H ATOM 562 HZ2 LYS A 104 14.851 56.875 -0.834 1.00 0.00 H ATOM 563 HZ3 LYS A 104 16.512 56.943 -1.188 1.00 0.00 H ATOM 564 H LYS A 104 15.778 56.526 6.293 1.00 0.00 H ATOM 565 N ASP A 105 13.174 56.817 7.274 1.00 35.87 N ATOM 566 CA ASP A 105 11.990 56.499 8.064 1.00 35.95 C ATOM 567 C ASP A 105 11.717 57.622 9.058 1.00 31.62 C ATOM 568 O ASP A 105 12.528 57.879 9.954 1.00 34.53 O ATOM 569 CB ASP A 105 12.187 55.169 8.788 1.00 38.44 C ATOM 570 CG ASP A 105 10.879 54.538 9.226 1.00 38.78 C ATOM 571 OD1 ASP A 105 9.962 55.275 9.647 1.00 38.71 O ATOM 572 OD2 ASP A 105 10.769 53.296 9.147 1.00 46.33 O ATOM 573 H ASP A 105 14.050 56.278 7.431 1.00 0.00 H ATOM 574 N GLU A 106 10.570 58.286 8.903 1.00 31.96 N ATOM 575 CA GLU A 106 10.241 59.426 9.751 1.00 39.64 C ATOM 576 C GLU A 106 9.956 59.029 11.193 1.00 31.97 C ATOM 577 O GLU A 106 9.913 59.907 12.061 1.00 37.91 O ATOM 578 CB GLU A 106 9.046 60.185 9.171 1.00 38.82 C ATOM 579 CG GLU A 106 8.988 61.647 9.595 1.00 72.99 C ATOM 580 CD GLU A 106 7.926 62.437 8.853 1.00 80.12 C ATOM 581 OE1 GLU A 106 7.005 61.813 8.283 1.00 92.19 O ATOM 582 OE2 GLU A 106 8.017 63.684 8.835 1.00 79.22 O ATOM 583 H GLU A 106 9.900 57.986 8.166 1.00 0.00 H ATOM 584 N ARG A 107 9.771 57.738 11.473 1.00 36.91 N ATOM 585 CA ARG A 107 9.611 57.297 12.852 1.00 27.82 C ATOM 586 C ARG A 107 10.923 57.343 13.624 1.00 30.87 C ATOM 587 O ARG A 107 10.906 57.256 14.856 1.00 34.16 O ATOM 588 CB ARG A 107 9.030 55.883 12.883 1.00 36.82 C ATOM 589 CG ARG A 107 7.625 55.781 12.310 1.00 32.70 C ATOM 590 CD ARG A 107 7.184 54.332 12.146 1.00 36.61 C ATOM 591 NE ARG A 107 8.073 53.599 11.250 1.00 33.43 N ATOM 592 CZ ARG A 107 7.871 52.349 10.850 1.00 34.21 C ATOM 593 NH1 ARG A 107 6.802 51.685 11.264 1.00 32.74 N ATOM 594 NH2 ARG A 107 8.740 51.764 10.036 1.00 27.45 N ATOM 595 HE ARG A 107 8.922 54.089 10.901 1.00 0.00 H ATOM 596 HH12 ARG A 107 6.644 50.706 10.950 1.00 0.00 H ATOM 597 HH11 ARG A 107 6.121 52.143 11.903 1.00 0.00 H ATOM 598 HH22 ARG A 107 8.582 50.785 9.723 1.00 0.00 H ATOM 599 HH21 ARG A 107 9.580 52.284 9.711 1.00 0.00 H ATOM 600 H ARG A 107 9.741 57.041 10.701 1.00 0.00 H ATOM 601 N VAL A 108 12.057 57.478 12.932 1.00 32.64 N ATOM 602 CA VAL A 108 13.371 57.524 13.565 1.00 26.55 C ATOM 603 C VAL A 108 13.696 58.964 13.925 1.00 27.72 C ATOM 604 O VAL A 108 13.408 59.891 13.159 1.00 36.71 O ATOM 605 CB VAL A 108 14.446 56.927 12.636 1.00 27.48 C ATOM 606 CG1 VAL A 108 15.826 57.047 13.263 1.00 22.71 C ATOM 607 CG2 VAL A 108 14.127 55.481 12.319 1.00 22.95 C ATOM 608 H VAL A 108 12.001 57.554 11.896 1.00 0.00 H ATOM 609 N SER A 109 14.299 59.158 15.094 1.00 25.84 N ATOM 610 CA SER A 109 14.704 60.483 15.532 1.00 27.32 C ATOM 611 C SER A 109 16.023 60.389 16.284 1.00 33.69 C ATOM 612 O SER A 109 16.318 59.381 16.934 1.00 29.31 O ATOM 613 CB SER A 109 13.633 61.140 16.420 1.00 33.30 C ATOM 614 OG SER A 109 13.397 60.380 17.596 1.00 31.62 O ATOM 615 HG SER A 109 14.237 60.309 18.116 1.00 0.00 H ATOM 616 H SER A 109 14.485 58.341 15.710 1.00 0.00 H ATOM 617 N ALA A 110 16.820 61.452 16.167 1.00 32.90 N ATOM 618 CA ALA A 110 18.045 61.622 16.948 1.00 31.96 C ATOM 619 C ALA A 110 19.029 60.477 16.714 1.00 28.05 C ATOM 620 O ALA A 110 19.599 59.918 17.652 1.00 30.03 O ATOM 621 CB ALA A 110 17.724 61.772 18.437 1.00 26.27 C ATOM 622 H ALA A 110 16.558 62.195 15.488 1.00 0.00 H ATOM 623 N LEU A 111 19.234 60.136 15.444 1.00 21.66 N ATOM 624 CA LEU A 111 20.166 59.070 15.093 1.00 30.35 C ATOM 625 C LEU A 111 21.597 59.515 15.372 1.00 32.55 C ATOM 626 O LEU A 111 22.055 60.529 14.836 1.00 32.14 O ATOM 627 CB LEU A 111 20.001 58.681 13.626 1.00 21.58 C ATOM 628 CG LEU A 111 20.913 57.550 13.150 1.00 36.81 C ATOM 629 CD1 LEU A 111 20.677 56.295 13.976 1.00 23.02 C ATOM 630 CD2 LEU A 111 20.707 57.268 11.668 1.00 37.39 C ATOM 631 H LEU A 111 18.722 60.637 14.690 1.00 0.00 H ATOM 632 N GLU A 112 22.304 58.756 16.209 1.00 32.27 N ATOM 633 CA GLU A 112 23.681 59.057 16.571 1.00 30.66 C ATOM 634 C GLU A 112 24.534 57.804 16.435 1.00 32.50 C ATOM 635 O GLU A 112 24.049 56.682 16.610 1.00 26.47 O ATOM 636 CB GLU A 112 23.793 59.586 18.009 1.00 30.65 C ATOM 637 CG GLU A 112 22.821 60.695 18.362 1.00 48.42 C ATOM 638 CD GLU A 112 22.831 61.017 19.846 1.00 59.44 C ATOM 639 OE1 GLU A 112 23.588 60.359 20.594 1.00 51.24 O ATOM 640 OE2 GLU A 112 22.084 61.928 20.265 1.00 70.05 O ATOM 641 H GLU A 112 21.853 57.914 16.620 1.00 0.00 H ATOM 642 N VAL A 113 25.814 58.006 16.134 1.00 25.61 N ATOM 643 CA VAL A 113 26.787 56.925 16.049 1.00 24.00 C ATOM 644 C VAL A 113 27.618 56.926 17.323 1.00 28.07 C ATOM 645 O VAL A 113 28.172 57.961 17.714 1.00 34.18 O ATOM 646 CB VAL A 113 27.678 57.075 14.805 1.00 23.03 C ATOM 647 CG1 VAL A 113 28.631 55.893 14.689 1.00 28.05 C ATOM 648 CG2 VAL A 113 26.820 57.198 13.559 1.00 32.21 C ATOM 649 H VAL A 113 26.134 58.978 15.951 1.00 0.00 H ATOM 650 N LEU A 114 27.699 55.772 17.974 1.00 27.21 N ATOM 651 CA LEU A 114 28.461 55.640 19.203 1.00 37.29 C ATOM 652 C LEU A 114 29.944 55.446 18.900 1.00 30.29 C ATOM 653 O LEU A 114 30.314 55.011 17.807 1.00 29.82 O ATOM 654 CB LEU A 114 27.938 54.462 20.017 1.00 34.28 C ATOM 655 CG LEU A 114 26.420 54.381 20.181 1.00 33.22 C ATOM 656 CD1 LEU A 114 26.030 53.136 20.966 1.00 31.50 C ATOM 657 CD2 LEU A 114 25.881 55.633 20.852 1.00 31.73 C ATOM 658 H LEU A 114 27.204 54.940 17.594 1.00 0.00 H ATOM 659 N PRO A 115 30.819 55.780 19.851 1.00 35.83 N ATOM 660 CA PRO A 115 32.245 55.466 19.696 1.00 40.33 C ATOM 661 C PRO A 115 32.595 54.016 19.988 1.00 35.53 C ATOM 662 O PRO A 115 33.782 53.670 19.971 1.00 49.36 O ATOM 663 CB PRO A 115 32.909 56.402 20.715 1.00 37.26 C ATOM 664 CG PRO A 115 31.876 56.577 21.770 1.00 44.88 C ATOM 665 CD PRO A 115 30.561 56.606 21.043 1.00 44.20 C ATOM 666 N ASP A 116 31.602 53.172 20.255 1.00 37.58 N ATOM 667 CA ASP A 116 31.852 51.773 20.566 1.00 39.20 C ATOM 668 C ASP A 116 32.429 51.042 19.362 1.00 40.49 C ATOM 669 O ASP A 116 32.041 51.291 18.217 1.00 45.36 O ATOM 670 CB ASP A 116 30.557 51.092 21.006 1.00 47.47 C ATOM 671 CG ASP A 116 29.918 51.764 22.202 1.00 41.27 C ATOM 672 OD1 ASP A 116 30.271 52.927 22.494 1.00 45.36 O ATOM 673 OD2 ASP A 116 29.056 51.128 22.845 1.00 49.68 O ATOM 674 H ASP A 116 30.622 53.521 20.241 1.00 0.00 H ATOM 675 N ARG A 117 33.359 50.128 19.629 1.00 41.04 N ATOM 676 CA ARG A 117 33.975 49.287 18.608 1.00 40.01 C ATOM 677 C ARG A 117 33.615 47.839 18.911 1.00 37.48 C ATOM 678 O ARG A 117 34.046 47.292 19.931 1.00 25.97 O ATOM 679 CB ARG A 117 35.491 49.472 18.582 1.00 38.50 C ATOM 680 CG ARG A 117 35.958 50.907 18.417 1.00 58.91 C ATOM 681 CD ARG A 117 37.474 50.979 18.517 1.00 71.92 C ATOM 682 NE ARG A 117 37.998 52.299 18.177 1.00 81.87 N ATOM 683 CZ ARG A 117 39.293 52.586 18.085 1.00 84.36 C ATOM 684 NH1 ARG A 117 39.681 53.814 17.768 1.00 80.05 N ATOM 685 NH2 ARG A 117 40.200 51.643 18.308 1.00 75.62 N ATOM 686 HE ARG A 117 37.315 53.062 17.995 1.00 0.00 H ATOM 687 HH12 ARG A 117 40.694 54.037 17.696 1.00 0.00 H ATOM 688 HH11 ARG A 117 38.972 54.554 17.591 1.00 0.00 H ATOM 689 HH22 ARG A 117 41.213 51.868 18.236 1.00 0.00 H ATOM 690 HH21 ARG A 117 39.898 50.679 18.555 1.00 0.00 H ATOM 691 H ARG A 117 33.662 50.007 20.616 1.00 0.00 H ATOM 692 N VAL A 118 32.830 47.216 18.027 1.00 39.75 N ATOM 693 CA VAL A 118 32.474 45.814 18.210 1.00 42.61 C ATOM 694 C VAL A 118 33.740 44.969 18.222 1.00 45.03 C ATOM 695 O VAL A 118 34.603 45.096 17.343 1.00 41.21 O ATOM 696 CB VAL A 118 31.498 45.360 17.114 1.00 37.75 C ATOM 697 CG1 VAL A 118 31.344 43.848 17.132 1.00 42.75 C ATOM 698 CG2 VAL A 118 30.145 46.029 17.301 1.00 44.21 C ATOM 699 H VAL A 118 32.470 47.736 17.201 1.00 0.00 H ATOM 700 N ALA A 119 33.863 44.111 19.232 1.00 39.19 N ATOM 701 CA ALA A 119 35.068 43.310 19.398 1.00 56.52 C ATOM 702 C ALA A 119 35.180 42.262 18.297 1.00 54.45 C ATOM 703 O ALA A 119 34.187 41.653 17.890 1.00 48.85 O ATOM 704 CB ALA A 119 35.072 42.635 20.770 1.00 43.31 C ATOM 705 H ALA A 119 33.085 44.011 19.915 1.00 0.00 H ATOM 706 N THR A 120 36.406 42.060 17.812 1.00 56.73 N ATOM 707 CA THR A 120 36.691 41.063 16.781 1.00 66.34 C ATOM 708 C THR A 120 37.307 39.843 17.464 1.00 65.41 C ATOM 709 O THR A 120 38.521 39.636 17.468 1.00 59.09 O ATOM 710 CB THR A 120 37.608 41.643 15.706 1.00 66.50 C ATOM 711 OG1 THR A 120 37.044 42.862 15.205 1.00 65.08 O ATOM 712 CG2 THR A 120 37.770 40.662 14.551 1.00 65.78 C ATOM 713 HG1 THR A 120 37.639 43.238 14.508 1.00 0.00 H ATOM 714 H THR A 120 37.190 42.634 18.182 1.00 0.00 H ATOM 715 N SER A 121 36.439 39.026 18.055 1.00 66.85 N ATOM 716 CA SER A 121 36.883 37.838 18.766 1.00 74.15 C ATOM 717 C SER A 121 37.373 36.778 17.779 1.00 72.62 C ATOM 718 O SER A 121 37.275 36.926 16.558 1.00 66.33 O ATOM 719 CB SER A 121 35.751 37.277 19.626 1.00 67.82 C ATOM 720 OG SER A 121 35.069 38.310 20.316 1.00 66.41 O ATOM 721 HG SER A 121 34.344 37.917 20.863 1.00 0.00 H ATOM 722 H SER A 121 35.423 39.241 18.007 1.00 0.00 H ATOM 723 N ARG A 122 37.910 35.693 18.327 1.00 80.64 N ATOM 724 CA ARG A 122 38.349 34.553 17.538 1.00 86.52 C ATOM 725 C ARG A 122 37.412 33.377 17.771 1.00 80.43 C ATOM 726 O ARG A 122 36.996 33.116 18.905 1.00 73.39 O ATOM 727 CB ARG A 122 39.788 34.158 17.885 1.00 88.99 C ATOM 728 CG ARG A 122 40.828 35.189 17.479 1.00 97.23 C ATOM 729 CD ARG A 122 42.238 34.626 17.584 1.00112.53 C ATOM 730 NE ARG A 122 42.592 34.276 18.957 1.00120.05 N ATOM 731 CZ ARG A 122 43.246 35.081 19.790 1.00118.33 C ATOM 732 NH1 ARG A 122 43.623 36.288 19.389 1.00108.97 N ATOM 733 NH2 ARG A 122 43.526 34.676 21.023 1.00115.76 N ATOM 734 HE ARG A 122 42.315 33.336 19.306 1.00 0.00 H ATOM 735 HH12 ARG A 122 44.134 36.916 20.041 1.00 0.00 H ATOM 736 HH11 ARG A 122 43.407 36.606 18.423 1.00 0.00 H ATOM 737 HH22 ARG A 122 44.037 35.306 21.674 1.00 0.00 H ATOM 738 HH21 ARG A 122 43.234 33.729 21.338 1.00 0.00 H ATOM 739 H ARG A 122 38.021 35.658 19.360 1.00 0.00 H ATOM 740 N ILE A 123 37.076 32.678 16.687 1.00 76.94 N ATOM 741 CA ILE A 123 36.181 31.531 16.779 1.00 66.98 C ATOM 742 C ILE A 123 36.903 30.383 17.469 1.00 66.45 C ATOM 743 O ILE A 123 38.002 29.983 17.059 1.00 67.41 O ATOM 744 CB ILE A 123 35.679 31.131 15.384 1.00 61.53 C ATOM 745 CG1 ILE A 123 34.505 32.020 14.969 1.00 61.71 C ATOM 746 CG2 ILE A 123 35.273 29.669 15.353 1.00 55.64 C ATOM 747 CD1 ILE A 123 33.321 31.931 15.911 1.00 57.50 C ATOM 748 H ILE A 123 37.459 32.955 15.761 1.00 0.00 H ATOM 749 N SER A 124 36.288 29.851 18.529 1.00 65.08 N ATOM 750 CA SER A 124 36.901 28.795 19.327 1.00 70.54 C ATOM 751 C SER A 124 36.993 27.471 18.586 1.00 77.16 C ATOM 752 O SER A 124 37.669 26.556 19.070 1.00 70.41 O ATOM 753 CB SER A 124 36.114 28.588 20.624 1.00 67.58 C ATOM 754 OG SER A 124 34.808 28.108 20.354 1.00 63.64 O ATOM 755 HG SER A 124 34.321 27.983 21.207 1.00 0.00 H ATOM 756 H SER A 124 35.345 30.200 18.793 1.00 0.00 H ATOM 757 N ASP A 125 36.348 27.350 17.424 1.00 68.73 N ATOM 758 CA ASP A 125 36.224 26.049 16.760 1.00 52.49 C ATOM 759 C ASP A 125 35.885 26.311 15.293 1.00 52.27 C ATOM 760 O ASP A 125 34.711 26.309 14.910 1.00 50.80 O ATOM 761 CB ASP A 125 35.174 25.195 17.444 1.00 49.12 C ATOM 762 CG ASP A 125 35.311 23.728 17.114 1.00 64.96 C ATOM 763 OD1 ASP A 125 35.797 23.396 16.013 1.00 53.29 O ATOM 764 OD2 ASP A 125 34.917 22.903 17.961 1.00 57.88 O ATOM 765 H ASP A 125 35.927 28.192 16.983 1.00 0.00 H ATOM 766 N ALA A 126 36.922 26.505 14.473 1.00 45.45 N ATOM 767 CA ALA A 126 36.706 26.858 13.076 1.00 46.80 C ATOM 768 C ALA A 126 36.061 25.716 12.295 1.00 45.98 C ATOM 769 O ALA A 126 35.193 25.954 11.446 1.00 52.07 O ATOM 770 CB ALA A 126 38.026 27.273 12.427 1.00 52.69 C ATOM 771 H ALA A 126 37.892 26.403 14.835 1.00 0.00 H ATOM 772 N HIS A 127 36.472 24.473 12.558 1.00 40.74 N ATOM 773 CA HIS A 127 35.916 23.344 11.815 1.00 45.03 C ATOM 774 C HIS A 127 34.427 23.191 12.092 1.00 40.55 C ATOM 775 O HIS A 127 33.620 23.052 11.165 1.00 40.57 O ATOM 776 CB HIS A 127 36.658 22.052 12.165 1.00 34.05 C ATOM 777 CG HIS A 127 36.093 20.836 11.497 1.00 34.64 C ATOM 778 ND1 HIS A 127 35.246 19.958 12.140 1.00 29.55 N ATOM 779 CD2 HIS A 127 36.241 20.360 10.237 1.00 34.69 C ATOM 780 CE1 HIS A 127 34.903 18.991 11.309 1.00 39.55 C ATOM 781 NE2 HIS A 127 35.493 19.211 10.147 1.00 34.59 N ATOM 782 H HIS A 127 37.189 24.308 13.293 1.00 0.00 H ATOM 783 N LEU A 128 34.046 23.213 13.369 1.00 34.70 N ATOM 784 CA LEU A 128 32.636 23.139 13.725 1.00 42.57 C ATOM 785 C LEU A 128 31.869 24.343 13.193 1.00 51.66 C ATOM 786 O LEU A 128 30.744 24.203 12.699 1.00 45.32 O ATOM 787 CB LEU A 128 32.502 23.035 15.242 1.00 48.76 C ATOM 788 CG LEU A 128 31.162 22.639 15.850 1.00 61.80 C ATOM 789 CD1 LEU A 128 30.373 21.740 14.912 1.00 54.54 C ATOM 790 CD2 LEU A 128 31.449 21.925 17.151 1.00 59.80 C ATOM 791 H LEU A 128 34.763 23.284 14.119 1.00 0.00 H ATOM 792 N ALA A 129 32.470 25.533 13.271 1.00 48.31 N ATOM 793 CA ALA A 129 31.812 26.730 12.760 1.00 46.14 C ATOM 794 C ALA A 129 31.612 26.661 11.253 1.00 45.10 C ATOM 795 O ALA A 129 30.654 27.240 10.728 1.00 51.10 O ATOM 796 CB ALA A 129 32.622 27.973 13.126 1.00 40.76 C ATOM 797 H ALA A 129 33.415 25.607 13.700 1.00 0.00 H ATOM 798 N ASP A 130 32.490 25.951 10.544 1.00 41.71 N ATOM 799 CA ASP A 130 32.412 25.915 9.087 1.00 40.68 C ATOM 800 C ASP A 130 31.428 24.856 8.600 1.00 44.97 C ATOM 801 O ASP A 130 30.617 25.120 7.705 1.00 41.56 O ATOM 802 CB ASP A 130 33.804 25.671 8.496 1.00 43.29 C ATOM 803 CG ASP A 130 33.780 25.533 6.983 1.00 60.14 C ATOM 804 OD1 ASP A 130 33.751 26.573 6.289 1.00 68.07 O ATOM 805 OD2 ASP A 130 33.792 24.385 6.487 1.00 54.24 O ATOM 806 H ASP A 130 33.237 25.418 11.033 1.00 0.00 H ATOM 807 N THR A 131 31.491 23.648 9.166 1.00 44.62 N ATOM 808 CA THR A 131 30.622 22.565 8.711 1.00 42.90 C ATOM 809 C THR A 131 29.179 22.750 9.161 1.00 43.76 C ATOM 810 O THR A 131 28.278 22.126 8.592 1.00 40.71 O ATOM 811 CB THR A 131 31.154 21.219 9.207 1.00 38.08 C ATOM 812 OG1 THR A 131 31.188 21.213 10.641 1.00 36.25 O ATOM 813 CG2 THR A 131 32.555 20.972 8.665 1.00 33.05 C ATOM 814 HG1 THR A 131 31.781 21.939 10.959 1.00 0.00 H ATOM 815 H THR A 131 32.166 23.476 9.939 1.00 0.00 H ATOM 816 N MET A 132 28.943 23.597 10.164 1.00 45.10 N ATOM 817 CA MET A 132 27.595 23.834 10.668 1.00 35.24 C ATOM 818 C MET A 132 26.755 24.670 9.709 1.00 35.88 C ATOM 819 O MET A 132 25.522 24.609 9.768 1.00 29.54 O ATOM 820 CB MET A 132 27.694 24.520 12.031 1.00 45.61 C ATOM 821 CG MET A 132 26.391 24.806 12.734 1.00 47.20 C ATOM 822 SD MET A 132 26.727 25.821 14.182 1.00 65.96 S ATOM 823 CE MET A 132 28.012 24.856 14.969 1.00 47.86 C ATOM 824 H MET A 132 29.742 24.102 10.598 1.00 0.00 H ATOM 825 N ILE A 133 27.395 25.437 8.826 1.00 36.18 N ATOM 826 CA ILE A 133 26.674 26.359 7.957 1.00 36.24 C ATOM 827 C ILE A 133 25.943 25.581 6.873 1.00 38.13 C ATOM 828 O ILE A 133 26.518 24.702 6.218 1.00 36.68 O ATOM 829 CB ILE A 133 27.639 27.392 7.357 1.00 37.52 C ATOM 830 CG1 ILE A 133 28.002 28.441 8.411 1.00 29.18 C ATOM 831 CG2 ILE A 133 27.035 28.046 6.119 1.00 31.50 C ATOM 832 CD1 ILE A 133 29.005 29.459 7.939 1.00 48.15 C ATOM 833 H ILE A 133 28.431 25.376 8.756 1.00 0.00 H ATOM 834 N GLY A 134 24.666 25.907 6.676 1.00 33.60 N ATOM 835 CA GLY A 134 23.839 25.233 5.700 1.00 28.27 C ATOM 836 C GLY A 134 23.128 23.998 6.207 1.00 32.71 C ATOM 837 O GLY A 134 22.386 23.374 5.439 1.00 33.64 O ATOM 838 H GLY A 134 24.250 26.673 7.244 1.00 0.00 H ATOM 839 N LYS A 135 23.321 23.632 7.469 1.00 27.65 N ATOM 840 CA LYS A 135 22.754 22.412 8.019 1.00 29.07 C ATOM 841 C LYS A 135 21.418 22.685 8.697 1.00 31.77 C ATOM 842 O LYS A 135 21.162 23.785 9.198 1.00 28.29 O ATOM 843 CB LYS A 135 23.715 21.780 9.029 1.00 32.87 C ATOM 844 CG LYS A 135 25.084 21.420 8.473 1.00 42.27 C ATOM 845 CD LYS A 135 25.017 20.198 7.570 1.00 39.40 C ATOM 846 CE LYS A 135 26.412 19.701 7.202 1.00 44.06 C ATOM 847 NZ LYS A 135 27.157 20.666 6.347 1.00 48.88 N ATOM 848 HZ1 LYS A 135 26.630 20.823 5.464 1.00 0.00 H ATOM 849 HZ2 LYS A 135 27.262 21.568 6.855 1.00 0.00 H ATOM 850 HZ3 LYS A 135 28.097 20.279 6.127 1.00 0.00 H ATOM 851 H LYS A 135 23.898 24.240 8.085 1.00 0.00 H ATOM 852 N ALA A 136 20.565 21.665 8.706 1.00 32.63 N ATOM 853 CA ALA A 136 19.369 21.676 9.533 1.00 24.29 C ATOM 854 C ALA A 136 19.748 21.353 10.972 1.00 26.66 C ATOM 855 O ALA A 136 20.624 20.521 11.225 1.00 29.06 O ATOM 856 CB ALA A 136 18.346 20.666 9.015 1.00 19.36 C ATOM 857 H ALA A 136 20.758 20.838 8.106 1.00 0.00 H ATOM 858 N VAL A 137 19.096 22.025 11.921 1.00 26.88 N ATOM 859 CA VAL A 137 19.455 21.908 13.328 1.00 23.44 C ATOM 860 C VAL A 137 18.199 21.811 14.181 1.00 24.77 C ATOM 861 O VAL A 137 17.099 22.179 13.764 1.00 29.40 O ATOM 862 CB VAL A 137 20.322 23.093 13.817 1.00 34.50 C ATOM 863 CG1 VAL A 137 21.637 23.159 13.054 1.00 29.89 C ATOM 864 CG2 VAL A 137 19.557 24.407 13.699 1.00 23.34 C ATOM 865 H VAL A 137 18.310 22.650 11.650 1.00 0.00 H ATOM 866 N GLU A 138 18.386 21.292 15.391 1.00 32.56 N ATOM 867 CA GLU A 138 17.398 21.355 16.460 1.00 34.19 C ATOM 868 C GLU A 138 17.957 22.276 17.536 1.00 34.03 C ATOM 869 O GLU A 138 19.047 22.029 18.061 1.00 35.00 O ATOM 870 CB GLU A 138 17.103 19.966 17.027 1.00 40.84 C ATOM 871 CG GLU A 138 16.553 18.964 16.014 1.00 36.49 C ATOM 872 CD GLU A 138 15.061 19.130 15.756 1.00 49.60 C ATOM 873 OE1 GLU A 138 14.535 18.456 14.842 1.00 48.06 O ATOM 874 OE2 GLU A 138 14.413 19.931 16.466 1.00 41.25 O ATOM 875 H GLU A 138 19.289 20.814 15.585 1.00 0.00 H ATOM 876 N HIS A 139 17.224 23.340 17.851 1.00 32.01 N ATOM 877 CA HIS A 139 17.707 24.389 18.740 1.00 29.71 C ATOM 878 C HIS A 139 16.857 24.395 20.003 1.00 29.90 C ATOM 879 O HIS A 139 15.652 24.660 19.945 1.00 28.03 O ATOM 880 CB HIS A 139 17.663 25.751 18.042 1.00 27.80 C ATOM 881 CG HIS A 139 18.625 26.753 18.600 1.00 25.91 C ATOM 882 ND1 HIS A 139 18.614 28.081 18.231 1.00 35.20 N ATOM 883 CD2 HIS A 139 19.631 26.621 19.496 1.00 29.97 C ATOM 884 CE1 HIS A 139 19.570 28.725 18.877 1.00 32.74 C ATOM 885 NE2 HIS A 139 20.203 27.861 19.650 1.00 31.93 N ATOM 886 H HIS A 139 16.269 23.427 17.447 1.00 0.00 H ATOM 887 N MET A 140 17.486 24.108 21.138 1.00 27.12 N ATOM 888 CA MET A 140 16.787 24.009 22.412 1.00 31.85 C ATOM 889 C MET A 140 16.701 25.377 23.078 1.00 33.27 C ATOM 890 O MET A 140 17.713 26.070 23.221 1.00 30.95 O ATOM 891 CB MET A 140 17.501 23.018 23.333 1.00 31.35 C ATOM 892 CG MET A 140 16.707 22.658 24.576 1.00 47.49 C ATOM 893 SD MET A 140 15.204 21.748 24.167 1.00 63.56 S ATOM 894 CE MET A 140 15.902 20.239 23.495 1.00 43.25 C ATOM 895 H MET A 140 18.513 23.948 21.116 1.00 0.00 H ATOM 896 N PHE A 141 15.495 25.754 23.491 1.00 38.46 N ATOM 897 CA PHE A 141 15.245 27.007 24.187 1.00 40.97 C ATOM 898 C PHE A 141 14.595 26.729 25.537 1.00 48.45 C ATOM 899 O PHE A 141 14.104 25.629 25.805 1.00 62.55 O ATOM 900 CB PHE A 141 14.361 27.939 23.349 1.00 38.28 C ATOM 901 CG PHE A 141 15.098 28.643 22.250 1.00 34.27 C ATOM 902 CD1 PHE A 141 15.416 27.982 21.075 1.00 44.00 C ATOM 903 CD2 PHE A 141 15.476 29.969 22.391 1.00 44.87 C ATOM 904 CE1 PHE A 141 16.104 28.630 20.060 1.00 46.51 C ATOM 905 CE2 PHE A 141 16.160 30.626 21.378 1.00 35.99 C ATOM 906 CZ PHE A 141 16.472 29.956 20.210 1.00 34.08 C ATOM 907 H PHE A 141 14.690 25.122 23.307 1.00 0.00 H ATOM 908 N GLU A 142 14.595 27.748 26.392 1.00 63.41 N ATOM 909 CA GLU A 142 14.102 27.639 27.757 1.00 63.39 C ATOM 910 C GLU A 142 12.894 28.548 27.946 1.00 70.30 C ATOM 911 O GLU A 142 12.894 29.701 27.501 1.00 56.06 O ATOM 912 CB GLU A 142 15.199 28.001 28.760 1.00 59.97 C ATOM 913 CG GLU A 142 15.025 27.368 30.128 1.00 71.12 C ATOM 914 CD GLU A 142 16.240 27.569 31.013 1.00 87.87 C ATOM 915 OE1 GLU A 142 17.039 28.487 30.725 1.00 96.50 O ATOM 916 OE2 GLU A 142 16.401 26.805 31.990 1.00100.61 O ATOM 917 H GLU A 142 14.964 28.665 26.070 1.00 0.00 H ATOM 918 N THR A 143 11.870 28.025 28.612 1.00 76.62 N ATOM 919 CA THR A 143 10.611 28.728 28.790 1.00 89.25 C ATOM 920 C THR A 143 10.556 29.382 30.171 1.00 90.75 C ATOM 921 O THR A 143 11.567 29.515 30.867 1.00 80.88 O ATOM 922 CB THR A 143 9.443 27.762 28.579 1.00 84.31 C ATOM 923 OG1 THR A 143 9.560 26.660 29.491 1.00 79.70 O ATOM 924 CG2 THR A 143 9.440 27.237 27.152 1.00 76.33 C ATOM 925 HG1 THR A 143 10.414 26.186 29.327 1.00 0.00 H ATOM 926 H THR A 143 11.974 27.075 29.022 1.00 0.00 H ATOM 927 N GLU A 144 9.355 29.795 30.579 1.00 95.44 N ATOM 928 CA GLU A 144 9.169 30.408 31.889 1.00 92.57 C ATOM 929 C GLU A 144 9.225 29.365 32.997 1.00 89.55 C ATOM 930 O GLU A 144 9.983 29.503 33.963 1.00 88.96 O ATOM 931 CB GLU A 144 7.834 31.156 31.927 1.00 97.18 C ATOM 932 CG GLU A 144 7.707 32.248 30.877 1.00104.53 C ATOM 933 CD GLU A 144 8.746 33.344 31.050 1.00106.72 C ATOM 934 OE1 GLU A 144 8.983 33.760 32.205 1.00115.66 O ATOM 935 OE2 GLU A 144 9.335 33.781 30.036 1.00 97.74 O ATOM 936 H GLU A 144 8.535 29.677 29.950 1.00 0.00 H ATOM 937 N ASP A 145 8.430 28.304 32.861 1.00 93.16 N ATOM 938 CA ASP A 145 8.333 27.260 33.874 1.00 96.67 C ATOM 939 C ASP A 145 9.595 26.407 33.913 1.00 96.66 C ATOM 940 O ASP A 145 9.689 25.447 34.687 1.00 98.39 O ATOM 941 CB ASP A 145 7.111 26.376 33.608 1.00 94.02 C ATOM 942 CG ASP A 145 7.097 25.815 32.200 1.00 98.32 C ATOM 943 OD1 ASP A 145 7.674 26.462 31.303 1.00 96.54 O ATOM 944 OD2 ASP A 145 6.512 24.728 31.988 1.00 90.79 O ATOM 945 H ASP A 145 7.856 28.217 31.998 1.00 0.00 H ATOM 946 N GLY A 146 10.570 26.743 33.069 1.00 93.04 N ATOM 947 CA GLY A 146 11.786 25.975 32.949 1.00 80.08 C ATOM 948 C GLY A 146 11.736 24.857 31.932 1.00 82.63 C ATOM 949 O GLY A 146 12.780 24.254 31.648 1.00 79.41 O ATOM 950 H GLY A 146 10.450 27.589 32.476 1.00 0.00 H ATOM 951 N SER A 147 10.564 24.565 31.369 1.00 87.74 N ATOM 952 CA SER A 147 10.459 23.517 30.366 1.00 85.47 C ATOM 953 C SER A 147 11.237 23.901 29.111 1.00 80.56 C ATOM 954 O SER A 147 11.539 25.072 28.864 1.00 74.15 O ATOM 955 CB SER A 147 8.996 23.247 30.015 1.00 83.46 C ATOM 956 OG SER A 147 8.312 22.622 31.088 1.00 96.71 O ATOM 957 HG SER A 147 8.341 23.210 31.884 1.00 0.00 H ATOM 958 H SER A 147 9.714 25.093 31.650 1.00 0.00 H ATOM 959 N LYS A 148 11.554 22.891 28.309 1.00 78.09 N ATOM 960 CA LYS A 148 12.427 23.049 27.154 1.00 70.44 C ATOM 961 C LYS A 148 11.624 22.913 25.866 1.00 66.84 C ATOM 962 O LYS A 148 10.959 21.895 25.646 1.00 74.55 O ATOM 963 CB LYS A 148 13.558 22.022 27.187 1.00 69.52 C ATOM 964 CG LYS A 148 14.686 22.373 28.136 1.00 75.12 C ATOM 965 CD LYS A 148 15.859 21.425 27.962 1.00 78.38 C ATOM 966 CE LYS A 148 17.102 21.957 28.658 1.00 84.73 C ATOM 967 NZ LYS A 148 18.275 21.060 28.459 1.00100.00 N ATOM 968 HZ1 LYS A 148 18.060 20.119 28.847 1.00 0.00 H ATOM 969 HZ2 LYS A 148 18.479 20.979 27.442 1.00 0.00 H ATOM 970 HZ3 LYS A 148 19.101 21.458 28.949 1.00 0.00 H ATOM 971 H LYS A 148 11.163 21.949 28.514 1.00 0.00 H ATOM 972 N ASP A 149 11.694 23.938 25.023 1.00 65.15 N ATOM 973 CA ASP A 149 11.180 23.882 23.663 1.00 55.29 C ATOM 974 C ASP A 149 12.330 23.646 22.693 1.00 46.70 C ATOM 975 O ASP A 149 13.424 24.194 22.862 1.00 45.63 O ATOM 976 CB ASP A 149 10.446 25.173 23.292 1.00 55.83 C ATOM 977 CG ASP A 149 9.041 25.226 23.852 1.00 66.69 C ATOM 978 OD1 ASP A 149 8.475 24.151 24.143 1.00 75.88 O ATOM 979 OD2 ASP A 149 8.499 26.342 23.992 1.00 83.69 O ATOM 980 H ASP A 149 12.136 24.820 25.350 1.00 0.00 H ATOM 981 N GLU A 150 12.075 22.830 21.676 1.00 38.46 N ATOM 982 CA GLU A 150 13.063 22.497 20.658 1.00 32.08 C ATOM 983 C GLU A 150 12.511 22.912 19.303 1.00 32.20 C ATOM 984 O GLU A 150 11.423 22.476 18.913 1.00 36.69 O ATOM 985 CB GLU A 150 13.389 21.002 20.688 1.00 41.92 C ATOM 986 CG GLU A 150 14.373 20.543 19.627 1.00 47.90 C ATOM 987 CD GLU A 150 14.684 19.060 19.731 1.00 53.89 C ATOM 988 OE1 GLU A 150 15.544 18.687 20.557 1.00 58.73 O ATOM 989 OE2 GLU A 150 14.058 18.266 18.997 1.00 46.11 O ATOM 990 H GLU A 150 11.127 22.410 21.603 1.00 0.00 H ATOM 991 N TRP A 151 13.259 23.749 18.589 1.00 28.52 N ATOM 992 CA TRP A 151 12.804 24.340 17.339 1.00 25.44 C ATOM 993 C TRP A 151 13.678 23.869 16.189 1.00 25.85 C ATOM 994 O TRP A 151 14.909 23.892 16.291 1.00 34.06 O ATOM 995 CB TRP A 151 12.829 25.867 17.416 1.00 27.20 C ATOM 996 CG TRP A 151 11.908 26.433 18.440 1.00 32.66 C ATOM 997 CD1 TRP A 151 12.054 26.380 19.796 1.00 36.67 C ATOM 998 CD2 TRP A 151 10.702 27.162 18.193 1.00 35.93 C ATOM 999 NE1 TRP A 151 11.007 27.024 20.409 1.00 39.10 N ATOM 1000 CE2 TRP A 151 10.164 27.515 19.447 1.00 40.07 C ATOM 1001 CE3 TRP A 151 10.024 27.552 17.034 1.00 36.59 C ATOM 1002 CZ2 TRP A 151 8.980 28.235 19.574 1.00 32.60 C ATOM 1003 CZ3 TRP A 151 8.848 28.268 17.163 1.00 41.29 C ATOM 1004 CH2 TRP A 151 8.338 28.601 18.423 1.00 37.84 C ATOM 1005 HE1 TRP A 151 10.876 27.123 21.436 1.00 0.00 H ATOM 1006 H TRP A 151 14.208 23.991 18.938 1.00 0.00 H ATOM 1007 N ARG A 152 13.042 23.449 15.099 1.00 30.63 N ATOM 1008 CA ARG A 152 13.770 23.112 13.885 1.00 25.78 C ATOM 1009 C ARG A 152 14.205 24.389 13.184 1.00 28.76 C ATOM 1010 O ARG A 152 13.398 25.301 12.976 1.00 30.11 O ATOM 1011 CB ARG A 152 12.911 22.265 12.946 1.00 34.97 C ATOM 1012 CG ARG A 152 12.679 20.844 13.422 1.00 44.52 C ATOM 1013 CD ARG A 152 12.219 19.962 12.273 1.00 57.14 C ATOM 1014 NE ARG A 152 11.801 18.637 12.723 1.00 60.39 N ATOM 1015 CZ ARG A 152 11.390 17.670 11.910 1.00 61.39 C ATOM 1016 NH1 ARG A 152 11.347 17.880 10.600 1.00 56.10 N ATOM 1017 NH2 ARG A 152 11.027 16.492 12.405 1.00 48.85 N ATOM 1018 HE ARG A 152 11.827 18.438 13.743 1.00 0.00 H ATOM 1019 HH12 ARG A 152 11.025 17.124 9.962 1.00 0.00 H ATOM 1020 HH11 ARG A 152 11.635 18.801 10.211 1.00 0.00 H ATOM 1021 HH22 ARG A 152 10.706 15.736 11.767 1.00 0.00 H ATOM 1022 HH21 ARG A 152 11.064 16.325 13.431 1.00 0.00 H ATOM 1023 H ARG A 152 12.006 23.360 15.115 1.00 0.00 H ATOM 1024 N GLY A 153 15.483 24.454 12.820 1.00 27.66 N ATOM 1025 CA GLY A 153 16.022 25.617 12.151 1.00 28.87 C ATOM 1026 C GLY A 153 17.033 25.224 11.094 1.00 30.26 C ATOM 1027 O GLY A 153 17.268 24.042 10.838 1.00 26.45 O ATOM 1028 H GLY A 153 16.110 23.649 13.022 1.00 0.00 H ATOM 1029 N MET A 154 17.623 26.246 10.477 1.00 22.01 N ATOM 1030 CA MET A 154 18.715 26.048 9.539 1.00 27.73 C ATOM 1031 C MET A 154 19.737 27.152 9.736 1.00 22.95 C ATOM 1032 O MET A 154 19.381 28.333 9.768 1.00 24.48 O ATOM 1033 CB MET A 154 18.231 26.036 8.086 1.00 24.26 C ATOM 1034 CG MET A 154 19.370 25.877 7.091 1.00 29.22 C ATOM 1035 SD MET A 154 18.822 25.521 5.415 1.00 63.02 S ATOM 1036 CE MET A 154 17.815 26.962 5.078 1.00 41.85 C ATOM 1037 H MET A 154 17.293 27.213 10.672 1.00 0.00 H ATOM 1038 N VAL A 155 20.998 26.761 9.882 1.00 25.87 N ATOM 1039 CA VAL A 155 22.096 27.716 9.963 1.00 26.11 C ATOM 1040 C VAL A 155 22.371 28.231 8.558 1.00 21.80 C ATOM 1041 O VAL A 155 22.592 27.447 7.631 1.00 21.66 O ATOM 1042 CB VAL A 155 23.345 27.073 10.578 1.00 27.24 C ATOM 1043 CG1 VAL A 155 24.427 28.120 10.801 1.00 30.65 C ATOM 1044 CG2 VAL A 155 22.985 26.379 11.882 1.00 24.44 C ATOM 1045 H VAL A 155 21.208 25.744 9.940 1.00 0.00 H ATOM 1046 N LEU A 156 22.349 29.551 8.395 1.00 21.21 N ATOM 1047 CA LEU A 156 22.420 30.166 7.076 1.00 18.45 C ATOM 1048 C LEU A 156 23.823 30.631 6.717 1.00 21.11 C ATOM 1049 O LEU A 156 24.289 30.387 5.601 1.00 31.91 O ATOM 1050 CB LEU A 156 21.450 31.348 7.003 1.00 23.74 C ATOM 1051 CG LEU A 156 19.992 31.010 7.301 1.00 21.27 C ATOM 1052 CD1 LEU A 156 19.193 32.287 7.478 1.00 22.40 C ATOM 1053 CD2 LEU A 156 19.418 30.161 6.190 1.00 21.07 C ATOM 1054 H LEU A 156 22.279 30.162 9.234 1.00 0.00 H ATOM 1055 N ALA A 157 24.501 31.306 7.638 1.00 20.04 N ATOM 1056 CA ALA A 157 25.805 31.887 7.354 1.00 28.38 C ATOM 1057 C ALA A 157 26.389 32.415 8.653 1.00 26.73 C ATOM 1058 O ALA A 157 25.708 32.503 9.679 1.00 22.56 O ATOM 1059 CB ALA A 157 25.720 33.013 6.315 1.00 16.20 C ATOM 1060 H ALA A 157 24.090 31.422 8.586 1.00 0.00 H ATOM 1061 N ARG A 158 27.671 32.758 8.591 1.00 24.87 N ATOM 1062 CA ARG A 158 28.280 33.559 9.639 1.00 26.39 C ATOM 1063 C ARG A 158 27.783 34.996 9.531 1.00 29.72 C ATOM 1064 O ARG A 158 27.642 35.539 8.431 1.00 28.46 O ATOM 1065 CB ARG A 158 29.801 33.515 9.521 1.00 37.40 C ATOM 1066 CG ARG A 158 30.524 34.252 10.626 1.00 41.89 C ATOM 1067 CD ARG A 158 30.550 33.424 11.895 1.00 44.18 C ATOM 1068 NE ARG A 158 31.399 32.246 11.745 1.00 43.74 N ATOM 1069 CZ ARG A 158 32.724 32.268 11.841 1.00 41.30 C ATOM 1070 NH1 ARG A 158 33.419 31.149 11.691 1.00 44.45 N ATOM 1071 NH2 ARG A 158 33.355 33.409 12.084 1.00 34.55 N ATOM 1072 HE ARG A 158 30.939 31.334 11.551 1.00 0.00 H ATOM 1073 HH12 ARG A 158 34.456 31.167 11.766 1.00 0.00 H ATOM 1074 HH11 ARG A 158 32.927 30.253 11.498 1.00 0.00 H ATOM 1075 HH22 ARG A 158 34.392 33.424 12.159 1.00 0.00 H ATOM 1076 HH21 ARG A 158 32.813 34.289 12.200 1.00 0.00 H ATOM 1077 H ARG A 158 28.246 32.449 7.782 1.00 0.00 H ATOM 1078 N ALA A 159 27.503 35.607 10.676 1.00 27.12 N ATOM 1079 CA ALA A 159 27.009 36.972 10.672 1.00 28.54 C ATOM 1080 C ALA A 159 28.147 37.957 10.411 1.00 28.26 C ATOM 1081 O ALA A 159 29.287 37.722 10.817 1.00 27.12 O ATOM 1082 CB ALA A 159 26.339 37.302 12.002 1.00 27.38 C ATOM 1083 H ALA A 159 27.638 35.107 11.578 1.00 0.00 H ATOM 1084 N PRO A 160 27.867 39.057 9.719 1.00 25.42 N ATOM 1085 CA PRO A 160 28.882 40.103 9.557 1.00 27.91 C ATOM 1086 C PRO A 160 29.078 40.897 10.842 1.00 29.43 C ATOM 1087 O PRO A 160 28.241 40.890 11.748 1.00 30.19 O ATOM 1088 CB PRO A 160 28.312 40.987 8.442 1.00 22.17 C ATOM 1089 CG PRO A 160 26.832 40.784 8.531 1.00 31.77 C ATOM 1090 CD PRO A 160 26.645 39.341 8.947 1.00 24.11 C ATOM 1091 N VAL A 161 30.231 41.569 10.914 1.00 27.49 N ATOM 1092 CA VAL A 161 30.579 42.502 11.986 1.00 24.26 C ATOM 1093 C VAL A 161 30.742 41.787 13.325 1.00 29.65 C ATOM 1094 O VAL A 161 31.751 41.970 14.014 1.00 29.21 O ATOM 1095 CB VAL A 161 29.545 43.638 12.090 1.00 26.24 C ATOM 1096 CG1 VAL A 161 29.895 44.572 13.237 1.00 25.35 C ATOM 1097 CG2 VAL A 161 29.472 44.402 10.776 1.00 19.46 C ATOM 1098 H VAL A 161 30.928 41.419 10.157 1.00 0.00 H ATOM 1099 N MET A 162 29.755 40.983 13.715 1.00 30.52 N ATOM 1100 CA MET A 162 29.827 40.201 14.950 1.00 29.64 C ATOM 1101 C MET A 162 30.199 38.773 14.553 1.00 32.94 C ATOM 1102 O MET A 162 29.340 37.926 14.303 1.00 29.51 O ATOM 1103 CB MET A 162 28.511 40.290 15.717 1.00 32.67 C ATOM 1104 CG MET A 162 28.209 41.708 16.212 1.00 35.11 C ATOM 1105 SD MET A 162 26.546 41.988 16.872 1.00 39.16 S ATOM 1106 CE MET A 162 26.552 40.927 18.316 1.00 27.62 C ATOM 1107 H MET A 162 28.904 40.908 13.122 1.00 0.00 H ATOM 1108 N ASN A 163 31.505 38.509 14.508 1.00 32.25 N ATOM 1109 CA ASN A 163 32.039 37.349 13.808 1.00 35.38 C ATOM 1110 C ASN A 163 31.875 36.037 14.565 1.00 36.28 C ATOM 1111 O ASN A 163 32.233 34.986 14.025 1.00 42.51 O ATOM 1112 CB ASN A 163 33.520 37.567 13.503 1.00 25.97 C ATOM 1113 CG ASN A 163 34.385 37.415 14.731 1.00 45.19 C ATOM 1114 OD1 ASN A 163 34.295 38.212 15.665 1.00 55.14 O ATOM 1115 ND2 ASN A 163 35.228 36.387 14.741 1.00 52.05 N ATOM 1116 HD22 ASN A 163 35.268 35.740 13.928 1.00 0.00 H ATOM 1117 HD21 ASN A 163 35.847 36.230 15.562 1.00 0.00 H ATOM 1118 H ASN A 163 32.165 39.153 14.989 1.00 0.00 H ATOM 1119 N THR A 164 31.362 36.057 15.792 1.00 30.77 N ATOM 1120 CA THR A 164 31.087 34.826 16.519 1.00 26.65 C ATOM 1121 C THR A 164 29.601 34.494 16.553 1.00 35.27 C ATOM 1122 O THR A 164 29.190 33.594 17.295 1.00 32.19 O ATOM 1123 CB THR A 164 31.639 34.911 17.944 1.00 26.73 C ATOM 1124 OG1 THR A 164 30.876 35.855 18.707 1.00 32.75 O ATOM 1125 CG2 THR A 164 33.100 35.339 17.923 1.00 43.33 C ATOM 1126 HG1 THR A 164 29.930 35.564 18.739 1.00 0.00 H ATOM 1127 H THR A 164 31.153 36.971 16.242 1.00 0.00 H ATOM 1128 N TRP A 165 28.790 35.200 15.773 1.00 34.22 N ATOM 1129 CA TRP A 165 27.356 34.980 15.699 1.00 32.82 C ATOM 1130 C TRP A 165 27.006 34.371 14.348 1.00 23.72 C ATOM 1131 O TRP A 165 27.731 34.541 13.364 1.00 19.60 O ATOM 1132 CB TRP A 165 26.586 36.292 15.911 1.00 29.46 C ATOM 1133 CG TRP A 165 26.767 36.883 17.285 1.00 26.89 C ATOM 1134 CD1 TRP A 165 27.929 37.356 17.830 1.00 26.82 C ATOM 1135 CD2 TRP A 165 25.755 37.064 18.284 1.00 22.41 C ATOM 1136 NE1 TRP A 165 27.702 37.810 19.108 1.00 27.12 N ATOM 1137 CE2 TRP A 165 26.375 37.647 19.407 1.00 26.77 C ATOM 1138 CE3 TRP A 165 24.385 36.787 18.338 1.00 24.41 C ATOM 1139 CZ2 TRP A 165 25.672 37.960 20.568 1.00 24.74 C ATOM 1140 CZ3 TRP A 165 23.690 37.096 19.494 1.00 25.57 C ATOM 1141 CH2 TRP A 165 24.335 37.677 20.592 1.00 21.68 C ATOM 1142 HE1 TRP A 165 28.420 38.212 19.744 1.00 0.00 H ATOM 1143 H TRP A 165 29.204 35.950 15.184 1.00 0.00 H ATOM 1144 N PHE A 166 25.893 33.649 14.313 1.00 22.00 N ATOM 1145 CA PHE A 166 25.462 32.933 13.123 1.00 26.21 C ATOM 1146 C PHE A 166 24.058 33.367 12.739 1.00 25.35 C ATOM 1147 O PHE A 166 23.181 33.495 13.599 1.00 26.01 O ATOM 1148 CB PHE A 166 25.477 31.411 13.345 1.00 28.41 C ATOM 1149 CG PHE A 166 26.853 30.811 13.405 1.00 28.81 C ATOM 1150 CD1 PHE A 166 27.605 30.877 14.566 1.00 25.05 C ATOM 1151 CD2 PHE A 166 27.387 30.159 12.302 1.00 33.61 C ATOM 1152 CE1 PHE A 166 28.871 30.317 14.623 1.00 38.08 C ATOM 1153 CE2 PHE A 166 28.650 29.596 12.352 1.00 29.73 C ATOM 1154 CZ PHE A 166 29.393 29.676 13.514 1.00 37.64 C ATOM 1155 H PHE A 166 25.306 33.593 15.170 1.00 0.00 H ATOM 1156 N TYR A 167 23.849 33.590 11.445 1.00 24.09 N ATOM 1157 CA TYR A 167 22.497 33.753 10.928 1.00 23.50 C ATOM 1158 C TYR A 167 21.766 32.415 10.980 1.00 28.29 C ATOM 1159 O TYR A 167 22.326 31.377 10.613 1.00 28.38 O ATOM 1160 CB TYR A 167 22.538 34.279 9.493 1.00 29.26 C ATOM 1161 CG TYR A 167 22.772 35.770 9.370 1.00 23.56 C ATOM 1162 CD1 TYR A 167 22.543 36.626 10.439 1.00 25.37 C ATOM 1163 CD2 TYR A 167 23.211 36.323 8.173 1.00 27.18 C ATOM 1164 CE1 TYR A 167 22.750 37.992 10.318 1.00 22.38 C ATOM 1165 CE2 TYR A 167 23.422 37.682 8.043 1.00 16.66 C ATOM 1166 CZ TYR A 167 23.191 38.512 9.116 1.00 24.13 C ATOM 1167 OH TYR A 167 23.399 39.868 8.982 1.00 25.50 O ATOM 1168 HH TYR A 167 23.189 40.319 9.838 1.00 0.00 H ATOM 1169 H TYR A 167 24.659 33.649 10.795 1.00 0.00 H ATOM 1170 N ILE A 168 20.516 32.434 11.438 1.00 25.22 N ATOM 1171 CA ILE A 168 19.725 31.211 11.541 1.00 25.09 C ATOM 1172 C ILE A 168 18.249 31.572 11.438 1.00 30.68 C ATOM 1173 O ILE A 168 17.817 32.626 11.914 1.00 30.06 O ATOM 1174 CB ILE A 168 20.041 30.448 12.848 1.00 21.27 C ATOM 1175 CG1 ILE A 168 19.264 29.134 12.911 1.00 22.13 C ATOM 1176 CG2 ILE A 168 19.731 31.297 14.065 1.00 24.93 C ATOM 1177 CD1 ILE A 168 19.559 28.300 14.142 1.00 23.25 C ATOM 1178 H ILE A 168 20.094 33.339 11.729 1.00 0.00 H ATOM 1179 N THR A 169 17.478 30.696 10.799 1.00 27.68 N ATOM 1180 CA THR A 169 16.036 30.838 10.688 1.00 24.21 C ATOM 1181 C THR A 169 15.381 29.529 11.111 1.00 28.15 C ATOM 1182 O THR A 169 16.041 28.497 11.234 1.00 27.32 O ATOM 1183 CB THR A 169 15.619 31.209 9.263 1.00 27.60 C ATOM 1184 OG1 THR A 169 14.214 31.485 9.239 1.00 28.79 O ATOM 1185 CG2 THR A 169 15.935 30.066 8.303 1.00 19.09 C ATOM 1186 HG1 THR A 169 14.016 32.238 9.850 1.00 0.00 H ATOM 1187 H THR A 169 17.929 29.869 10.358 1.00 0.00 H ATOM 1188 N TYR A 170 14.068 29.570 11.328 1.00 32.60 N ATOM 1189 CA TYR A 170 13.348 28.430 11.876 1.00 32.10 C ATOM 1190 C TYR A 170 12.096 28.143 11.056 1.00 33.81 C ATOM 1191 O TYR A 170 11.548 29.021 10.387 1.00 32.85 O ATOM 1192 CB TYR A 170 12.984 28.666 13.350 1.00 25.12 C ATOM 1193 CG TYR A 170 14.188 28.957 14.217 1.00 32.04 C ATOM 1194 CD1 TYR A 170 14.975 27.925 14.715 1.00 24.76 C ATOM 1195 CD2 TYR A 170 14.549 30.269 14.525 1.00 27.95 C ATOM 1196 CE1 TYR A 170 16.084 28.190 15.504 1.00 29.39 C ATOM 1197 CE2 TYR A 170 15.653 30.545 15.314 1.00 17.81 C ATOM 1198 CZ TYR A 170 16.420 29.502 15.799 1.00 32.37 C ATOM 1199 OH TYR A 170 17.522 29.767 16.581 1.00 23.67 O ATOM 1200 HH TYR A 170 17.953 28.915 16.841 1.00 0.00 H ATOM 1201 H TYR A 170 13.544 30.439 11.100 1.00 0.00 H ATOM 1202 N GLU A 171 11.648 26.885 11.118 1.00 36.57 N ATOM 1203 CA GLU A 171 10.452 26.479 10.384 1.00 35.81 C ATOM 1204 C GLU A 171 9.209 27.183 10.918 1.00 33.75 C ATOM 1205 O GLU A 171 8.445 27.779 10.151 1.00 34.76 O ATOM 1206 CB GLU A 171 10.275 24.960 10.453 1.00 42.95 C ATOM 1207 CG GLU A 171 11.055 24.168 9.413 1.00 48.11 C ATOM 1208 CD GLU A 171 10.524 22.749 9.251 1.00 71.88 C ATOM 1209 OE1 GLU A 171 9.295 22.558 9.389 1.00 76.34 O ATOM 1210 OE2 GLU A 171 11.329 21.825 8.995 1.00 63.50 O ATOM 1211 H GLU A 171 12.157 26.187 11.696 1.00 0.00 H ATOM 1212 N LYS A 172 8.988 27.120 12.229 1.00 32.61 N ATOM 1213 CA LYS A 172 7.826 27.735 12.858 1.00 29.94 C ATOM 1214 C LYS A 172 8.030 29.215 13.172 1.00 42.97 C ATOM 1215 O LYS A 172 7.182 29.817 13.842 1.00 42.75 O ATOM 1216 CB LYS A 172 7.461 26.970 14.134 1.00 38.18 C ATOM 1217 CG LYS A 172 6.979 25.542 13.881 1.00 33.12 C ATOM 1218 CD LYS A 172 6.764 24.786 15.182 1.00 45.92 C ATOM 1219 CE LYS A 172 6.294 23.361 14.922 1.00 44.08 C ATOM 1220 NZ LYS A 172 6.224 22.571 16.181 1.00 40.76 N ATOM 1221 HZ1 LYS A 172 7.167 22.532 16.618 1.00 0.00 H ATOM 1222 HZ2 LYS A 172 5.556 23.024 16.836 1.00 0.00 H ATOM 1223 HZ3 LYS A 172 5.901 21.606 15.966 1.00 0.00 H ATOM 1224 H LYS A 172 9.671 26.613 12.827 1.00 0.00 H ATOM 1225 N ASP A 173 9.128 29.808 12.704 1.00 36.80 N ATOM 1226 CA ASP A 173 9.407 31.227 12.879 1.00 28.38 C ATOM 1227 C ASP A 173 10.407 31.654 11.813 1.00 31.20 C ATOM 1228 O ASP A 173 11.597 31.829 12.107 1.00 26.54 O ATOM 1229 CB ASP A 173 9.947 31.511 14.282 1.00 35.26 C ATOM 1230 CG ASP A 173 9.785 32.970 14.690 1.00 40.83 C ATOM 1231 OD1 ASP A 173 9.417 33.798 13.831 1.00 34.13 O ATOM 1232 OD2 ASP A 173 10.030 33.289 15.874 1.00 36.96 O ATOM 1233 H ASP A 173 9.820 29.229 12.188 1.00 0.00 H ATOM 1234 N PRO A 174 9.967 31.827 10.559 1.00 28.31 N ATOM 1235 CA PRO A 174 10.889 32.013 9.433 1.00 26.68 C ATOM 1236 C PRO A 174 11.371 33.450 9.236 1.00 27.19 C ATOM 1237 O PRO A 174 11.275 34.014 8.147 1.00 23.23 O ATOM 1238 CB PRO A 174 10.056 31.530 8.239 1.00 25.03 C ATOM 1239 CG PRO A 174 8.672 31.895 8.606 1.00 25.03 C ATOM 1240 CD PRO A 174 8.565 31.762 10.110 1.00 27.84 C ATOM 1241 N VAL A 175 11.912 34.042 10.300 1.00 27.21 N ATOM 1242 CA VAL A 175 12.558 35.344 10.217 1.00 28.10 C ATOM 1243 C VAL A 175 14.037 35.183 10.568 1.00 27.04 C ATOM 1244 O VAL A 175 14.484 34.124 11.007 1.00 22.44 O ATOM 1245 CB VAL A 175 11.877 36.398 11.113 1.00 26.44 C ATOM 1246 CG1 VAL A 175 10.504 36.751 10.556 1.00 28.59 C ATOM 1247 CG2 VAL A 175 11.754 35.893 12.533 1.00 24.91 C ATOM 1248 H VAL A 175 11.871 33.558 11.220 1.00 0.00 H ATOM 1249 N LEU A 176 14.797 36.255 10.359 1.00 28.32 N ATOM 1250 CA LEU A 176 16.245 36.203 10.510 1.00 22.69 C ATOM 1251 C LEU A 176 16.642 36.370 11.974 1.00 23.17 C ATOM 1252 O LEU A 176 16.260 37.348 12.623 1.00 18.78 O ATOM 1253 CB LEU A 176 16.897 37.283 9.647 1.00 16.65 C ATOM 1254 CG LEU A 176 18.421 37.281 9.543 1.00 18.68 C ATOM 1255 CD1 LEU A 176 18.939 35.897 9.211 1.00 23.78 C ATOM 1256 CD2 LEU A 176 18.877 38.284 8.490 1.00 19.98 C ATOM 1257 H LEU A 176 14.347 37.151 10.081 1.00 0.00 H ATOM 1258 N TYR A 177 17.405 35.409 12.493 1.00 24.38 N ATOM 1259 CA TYR A 177 17.878 35.419 13.870 1.00 19.10 C ATOM 1260 C TYR A 177 19.399 35.369 13.912 1.00 22.46 C ATOM 1261 O TYR A 177 20.056 34.952 12.954 1.00 23.00 O ATOM 1262 CB TYR A 177 17.320 34.234 14.666 1.00 24.50 C ATOM 1263 CG TYR A 177 15.914 34.421 15.168 1.00 23.28 C ATOM 1264 CD1 TYR A 177 15.673 35.007 16.401 1.00 26.74 C ATOM 1265 CD2 TYR A 177 14.827 34.001 14.416 1.00 26.00 C ATOM 1266 CE1 TYR A 177 14.388 35.175 16.872 1.00 32.50 C ATOM 1267 CE2 TYR A 177 13.538 34.163 14.879 1.00 28.99 C ATOM 1268 CZ TYR A 177 13.321 34.754 16.106 1.00 35.79 C ATOM 1269 OH TYR A 177 12.032 34.920 16.567 1.00 34.83 O ATOM 1270 HH TYR A 177 11.594 34.036 16.643 1.00 0.00 H ATOM 1271 H TYR A 177 17.677 34.611 11.884 1.00 0.00 H ATOM 1272 N MET A 178 19.950 35.775 15.055 1.00 26.02 N ATOM 1273 CA MET A 178 21.386 35.773 15.299 1.00 26.00 C ATOM 1274 C MET A 178 21.667 35.139 16.650 1.00 25.91 C ATOM 1275 O MET A 178 21.108 35.568 17.664 1.00 28.47 O ATOM 1276 CB MET A 178 21.959 37.192 15.277 1.00 29.89 C ATOM 1277 CG MET A 178 22.544 37.609 13.956 1.00 35.95 C ATOM 1278 SD MET A 178 23.190 39.286 14.040 1.00 35.08 S ATOM 1279 CE MET A 178 24.431 39.130 15.320 1.00 28.44 C ATOM 1280 H MET A 178 19.322 36.111 15.813 1.00 0.00 H ATOM 1281 N TYR A 179 22.544 34.137 16.668 1.00 26.62 N ATOM 1282 CA TYR A 179 22.917 33.489 17.917 1.00 24.42 C ATOM 1283 C TYR A 179 24.379 33.072 17.870 1.00 24.29 C ATOM 1284 O TYR A 179 24.948 32.859 16.795 1.00 26.86 O ATOM 1285 CB TYR A 179 22.040 32.267 18.206 1.00 29.39 C ATOM 1286 CG TYR A 179 20.629 32.603 18.637 1.00 28.59 C ATOM 1287 CD1 TYR A 179 20.377 33.138 19.894 1.00 22.36 C ATOM 1288 CD2 TYR A 179 19.549 32.370 17.794 1.00 23.03 C ATOM 1289 CE1 TYR A 179 19.090 33.440 20.297 1.00 28.68 C ATOM 1290 CE2 TYR A 179 18.256 32.670 18.189 1.00 30.04 C ATOM 1291 CZ TYR A 179 18.034 33.203 19.441 1.00 29.19 C ATOM 1292 OH TYR A 179 16.754 33.502 19.837 1.00 31.12 O ATOM 1293 HH TYR A 179 16.772 33.873 20.755 1.00 0.00 H ATOM 1294 H TYR A 179 22.969 33.812 15.776 1.00 0.00 H ATOM 1295 N GLN A 180 24.981 32.967 19.057 1.00 23.65 N ATOM 1296 CA GLN A 180 26.310 32.376 19.213 1.00 29.42 C ATOM 1297 C GLN A 180 26.132 30.865 19.328 1.00 28.57 C ATOM 1298 O GLN A 180 26.073 30.283 20.415 1.00 30.23 O ATOM 1299 CB GLN A 180 27.020 32.972 20.421 1.00 27.25 C ATOM 1300 CG GLN A 180 27.264 34.461 20.297 1.00 31.91 C ATOM 1301 CD GLN A 180 27.755 35.081 21.591 1.00 47.39 C ATOM 1302 OE1 GLN A 180 28.934 35.422 21.725 1.00 40.44 O ATOM 1303 NE2 GLN A 180 26.849 35.238 22.553 1.00 28.47 N ATOM 1304 HE22 GLN A 180 25.866 34.936 22.396 1.00 0.00 H ATOM 1305 HE21 GLN A 180 27.124 35.663 23.462 1.00 0.00 H ATOM 1306 H GLN A 180 24.487 33.318 19.902 1.00 0.00 H ATOM 1307 N LEU A 181 26.036 30.222 18.164 1.00 27.64 N ATOM 1308 CA LEU A 181 25.635 28.821 18.119 1.00 30.17 C ATOM 1309 C LEU A 181 26.729 27.884 18.619 1.00 39.56 C ATOM 1310 O LEU A 181 26.419 26.818 19.163 1.00 37.24 O ATOM 1311 CB LEU A 181 25.225 28.442 16.697 1.00 26.75 C ATOM 1312 CG LEU A 181 23.948 29.105 16.184 1.00 31.85 C ATOM 1313 CD1 LEU A 181 23.613 28.599 14.794 1.00 28.41 C ATOM 1314 CD2 LEU A 181 22.792 28.860 17.147 1.00 27.80 C ATOM 1315 H LEU A 181 26.249 30.725 17.279 1.00 0.00 H ATOM 1316 N LEU A 182 28.003 28.246 18.437 1.00 34.16 N ATOM 1317 CA LEU A 182 29.082 27.389 18.923 1.00 34.37 C ATOM 1318 C LEU A 182 28.979 27.173 20.426 1.00 39.04 C ATOM 1319 O LEU A 182 29.292 26.089 20.930 1.00 44.91 O ATOM 1320 CB LEU A 182 30.443 27.987 18.570 1.00 34.40 C ATOM 1321 CG LEU A 182 30.869 27.987 17.102 1.00 48.64 C ATOM 1322 CD1 LEU A 182 32.261 28.573 16.976 1.00 55.68 C ATOM 1323 CD2 LEU A 182 30.822 26.587 16.522 1.00 41.52 C ATOM 1324 H LEU A 182 28.226 29.137 17.950 1.00 0.00 H ATOM 1325 N ASP A 183 28.536 28.194 21.158 1.00 38.24 N ATOM 1326 CA ASP A 183 28.437 28.074 22.606 1.00 41.66 C ATOM 1327 C ASP A 183 27.216 27.266 23.028 1.00 43.61 C ATOM 1328 O ASP A 183 27.285 26.523 24.012 1.00 48.55 O ATOM 1329 CB ASP A 183 28.426 29.467 23.237 1.00 45.80 C ATOM 1330 CG ASP A 183 29.668 30.271 22.880 1.00 65.01 C ATOM 1331 OD1 ASP A 183 30.748 29.659 22.728 1.00 63.33 O ATOM 1332 OD2 ASP A 183 29.564 31.508 22.736 1.00 67.04 O ATOM 1333 H ASP A 183 28.259 29.082 20.693 1.00 0.00 H ATOM 1334 N ASP A 184 26.100 27.387 22.305 1.00 37.92 N ATOM 1335 CA ASP A 184 24.968 26.502 22.557 1.00 46.23 C ATOM 1336 C ASP A 184 25.301 25.060 22.204 1.00 40.67 C ATOM 1337 O ASP A 184 24.807 24.132 22.853 1.00 39.78 O ATOM 1338 CB ASP A 184 23.748 26.963 21.766 1.00 37.86 C ATOM 1339 CG ASP A 184 23.203 28.279 22.259 1.00 34.22 C ATOM 1340 OD1 ASP A 184 23.348 28.564 23.468 1.00 47.03 O ATOM 1341 OD2 ASP A 184 22.630 29.028 21.440 1.00 40.89 O ATOM 1342 H ASP A 184 26.038 28.112 21.562 1.00 0.00 H ATOM 1343 N TYR A 185 26.131 24.857 21.180 1.00 44.75 N ATOM 1344 CA TYR A 185 26.513 23.510 20.774 1.00 38.54 C ATOM 1345 C TYR A 185 27.283 22.805 21.882 1.00 41.67 C ATOM 1346 O TYR A 185 27.004 21.647 22.210 1.00 34.98 O ATOM 1347 CB TYR A 185 27.349 23.580 19.499 1.00 42.52 C ATOM 1348 CG TYR A 185 27.571 22.252 18.823 1.00 46.34 C ATOM 1349 CD1 TYR A 185 28.623 21.425 19.194 1.00 47.50 C ATOM 1350 CD2 TYR A 185 26.737 21.833 17.797 1.00 59.06 C ATOM 1351 CE1 TYR A 185 28.828 20.211 18.567 1.00 57.55 C ATOM 1352 CE2 TYR A 185 26.934 20.629 17.165 1.00 57.26 C ATOM 1353 CZ TYR A 185 27.979 19.822 17.551 1.00 60.72 C ATOM 1354 OH TYR A 185 28.164 18.624 16.909 1.00 59.46 O ATOM 1355 HH TYR A 185 28.949 18.161 17.296 1.00 0.00 H ATOM 1356 H TYR A 185 26.512 25.674 20.662 1.00 0.00 H ATOM 1357 N LYS A 186 28.266 23.493 22.467 1.00 44.68 N ATOM 1358 CA LYS A 186 28.995 22.927 23.597 1.00 43.61 C ATOM 1359 C LYS A 186 28.079 22.733 24.799 1.00 45.53 C ATOM 1360 O LYS A 186 28.182 21.728 25.511 1.00 52.46 O ATOM 1361 CB LYS A 186 30.181 23.822 23.956 1.00 50.78 C ATOM 1362 CG LYS A 186 31.367 23.702 23.008 1.00 60.84 C ATOM 1363 CD LYS A 186 32.505 24.622 23.431 1.00 55.82 C ATOM 1364 CE LYS A 186 32.571 25.866 22.558 1.00 67.91 C ATOM 1365 NZ LYS A 186 33.085 25.553 21.195 1.00 66.32 N ATOM 1366 HZ1 LYS A 186 34.042 25.153 21.270 1.00 0.00 H ATOM 1367 HZ2 LYS A 186 32.455 24.864 20.738 1.00 0.00 H ATOM 1368 HZ3 LYS A 186 33.116 26.425 20.629 1.00 0.00 H ATOM 1369 H LYS A 186 28.514 24.440 22.115 1.00 0.00 H ATOM 1370 N GLU A 187 27.167 23.681 25.035 1.00 40.76 N ATOM 1371 CA GLU A 187 26.184 23.533 26.103 1.00 46.67 C ATOM 1372 C GLU A 187 25.224 22.375 25.864 1.00 45.44 C ATOM 1373 O GLU A 187 24.496 21.998 26.788 1.00 51.25 O ATOM 1374 CB GLU A 187 25.380 24.825 26.270 1.00 48.63 C ATOM 1375 CG GLU A 187 26.150 25.982 26.886 1.00 51.62 C ATOM 1376 CD GLU A 187 25.414 27.306 26.750 1.00 67.67 C ATOM 1377 OE1 GLU A 187 24.261 27.305 26.263 1.00 61.60 O ATOM 1378 OE2 GLU A 187 25.991 28.349 27.125 1.00 78.57 O ATOM 1379 H GLU A 187 27.158 24.539 24.447 1.00 0.00 H ATOM 1380 N GLY A 188 25.198 21.809 24.659 1.00 42.13 N ATOM 1381 CA GLY A 188 24.317 20.701 24.359 1.00 38.43 C ATOM 1382 C GLY A 188 22.918 21.081 23.930 1.00 41.41 C ATOM 1383 O GLY A 188 22.054 20.201 23.850 1.00 39.27 O ATOM 1384 H GLY A 188 25.827 22.172 23.915 1.00 0.00 H ATOM 1385 N ASP A 189 22.664 22.357 23.644 1.00 35.02 N ATOM 1386 CA ASP A 189 21.342 22.816 23.240 1.00 36.56 C ATOM 1387 C ASP A 189 21.174 22.905 21.730 1.00 32.95 C ATOM 1388 O ASP A 189 20.120 23.346 21.262 1.00 32.23 O ATOM 1389 CB ASP A 189 21.040 24.177 23.872 1.00 35.99 C ATOM 1390 CG ASP A 189 20.910 24.103 25.380 1.00 49.53 C ATOM 1391 OD1 ASP A 189 20.375 23.093 25.886 1.00 55.81 O ATOM 1392 OD2 ASP A 189 21.344 25.057 26.061 1.00 73.50 O ATOM 1393 H ASP A 189 23.437 23.050 23.712 1.00 0.00 H ATOM 1394 N LEU A 190 22.176 22.495 20.957 1.00 27.40 N ATOM 1395 CA LEU A 190 22.106 22.535 19.503 1.00 30.77 C ATOM 1396 C LEU A 190 22.580 21.198 18.957 1.00 43.99 C ATOM 1397 O LEU A 190 23.726 20.801 19.191 1.00 45.99 O ATOM 1398 CB LEU A 190 22.957 23.676 18.934 1.00 33.22 C ATOM 1399 CG LEU A 190 22.878 23.890 17.419 1.00 34.43 C ATOM 1400 CD1 LEU A 190 21.536 24.497 17.027 1.00 32.77 C ATOM 1401 CD2 LEU A 190 24.026 24.759 16.928 1.00 44.22 C ATOM 1402 H LEU A 190 23.041 22.133 21.407 1.00 0.00 H ATOM 1403 N ARG A 191 21.703 20.510 18.233 1.00 35.77 N ATOM 1404 CA ARG A 191 22.041 19.263 17.564 1.00 33.14 C ATOM 1405 C ARG A 191 21.909 19.459 16.062 1.00 31.86 C ATOM 1406 O ARG A 191 20.909 20.009 15.590 1.00 34.79 O ATOM 1407 CB ARG A 191 21.137 18.120 18.027 1.00 33.08 C ATOM 1408 CG ARG A 191 20.860 18.103 19.520 1.00 38.87 C ATOM 1409 CD ARG A 191 20.214 16.790 19.932 1.00 53.98 C ATOM 1410 NE ARG A 191 19.386 16.228 18.866 1.00 60.27 N ATOM 1411 CZ ARG A 191 18.073 16.414 18.754 1.00 61.80 C ATOM 1412 NH1 ARG A 191 17.427 17.151 19.648 1.00 61.43 N ATOM 1413 NH2 ARG A 191 17.406 15.860 17.748 1.00 56.63 N ATOM 1414 HE ARG A 191 19.855 15.643 18.146 1.00 0.00 H ATOM 1415 HH12 ARG A 191 16.401 17.295 19.559 1.00 0.00 H ATOM 1416 HH11 ARG A 191 17.947 17.584 20.438 1.00 0.00 H ATOM 1417 HH22 ARG A 191 16.380 16.006 17.661 1.00 0.00 H ATOM 1418 HH21 ARG A 191 17.910 15.280 17.047 1.00 0.00 H ATOM 1419 H ARG A 191 20.735 20.878 18.141 1.00 0.00 H ATOM 1420 N ILE A 192 22.903 19.013 15.325 1.00 34.47 N ATOM 1421 CA ILE A 192 22.907 19.116 13.872 1.00 37.61 C ATOM 1422 C ILE A 192 22.342 17.831 13.281 1.00 42.38 C ATOM 1423 O ILE A 192 22.545 16.734 13.811 1.00 49.33 O ATOM 1424 CB ILE A 192 24.331 19.412 13.354 1.00 41.58 C ATOM 1425 CG1 ILE A 192 24.873 20.690 14.000 1.00 38.23 C ATOM 1426 CG2 ILE A 192 24.343 19.535 11.840 1.00 48.05 C ATOM 1427 CD1 ILE A 192 26.222 21.118 13.466 1.00 44.93 C ATOM 1428 H ILE A 192 23.717 18.570 15.797 1.00 0.00 H ATOM 1429 N MET A 193 21.613 17.968 12.177 1.00 47.33 N ATOM 1430 CA MET A 193 20.970 16.885 11.449 1.00 43.12 C ATOM 1431 C MET A 193 21.764 16.546 10.192 1.00 57.51 C ATOM 1432 O MET A 193 22.569 17.356 9.723 1.00 63.92 O ATOM 1433 CB MET A 193 19.532 17.287 11.093 1.00 51.96 C ATOM 1434 CG MET A 193 18.649 17.491 12.318 1.00 48.79 C ATOM 1435 SD MET A 193 16.955 17.975 11.930 1.00 83.85 S ATOM 1436 CE MET A 193 16.332 16.476 11.172 1.00 67.65 C ATOM 1437 H MET A 193 21.492 18.931 11.803 1.00 0.00 H ATOM 1438 N PRO A 194 21.581 15.333 9.619 1.00 70.22 N ATOM 1439 CA PRO A 194 22.392 14.854 8.486 1.00 60.56 C ATOM 1440 C PRO A 194 22.531 15.840 7.327 1.00 71.81 C ATOM 1441 O PRO A 194 23.664 16.200 6.995 1.00 71.80 O ATOM 1442 CB PRO A 194 21.637 13.598 8.020 1.00 63.60 C ATOM 1443 CG PRO A 194 20.291 13.665 8.686 1.00 69.99 C ATOM 1444 CD PRO A 194 20.561 14.337 9.987 1.00 63.24 C TER 1445 PRO A 194 ATOM 1446 N ASP A 211 22.297 31.896 -11.283 1.00 60.86 N ATOM 1447 CA ASP A 211 21.256 32.910 -11.408 1.00 70.63 C ATOM 1448 C ASP A 211 20.569 33.159 -10.068 1.00 71.36 C ATOM 1449 O ASP A 211 20.452 32.256 -9.241 1.00 63.37 O ATOM 1450 CB ASP A 211 20.233 32.493 -12.465 1.00 73.71 C ATOM 1451 CG ASP A 211 19.793 31.053 -12.309 1.00 82.99 C ATOM 1452 OD1 ASP A 211 20.577 30.152 -12.677 1.00 89.64 O ATOM 1453 OD2 ASP A 211 18.666 30.821 -11.823 1.00 92.41 O ATOM 1454 HN3 ASP A 211 21.873 31.005 -10.955 1.00 0.00 H ATOM 1455 HN2 ASP A 211 23.010 32.216 -10.597 1.00 0.00 H ATOM 1456 HN1 ASP A 211 22.747 31.747 -12.209 1.00 0.00 H ATOM 1457 N SER A 212 20.109 34.392 -9.865 1.00 57.84 N ATOM 1458 CA SER A 212 19.580 34.825 -8.582 1.00 52.01 C ATOM 1459 C SER A 212 18.254 35.548 -8.772 1.00 52.04 C ATOM 1460 O SER A 212 18.050 36.258 -9.760 1.00 49.96 O ATOM 1461 CB SER A 212 20.567 35.747 -7.859 1.00 35.49 C ATOM 1462 OG SER A 212 20.064 36.127 -6.592 1.00 43.55 O ATOM 1463 HG SER A 212 20.717 36.721 -6.144 1.00 0.00 H ATOM 1464 H SER A 212 20.129 35.070 -10.653 1.00 0.00 H ATOM 1465 N LEU A 213 17.356 35.364 -7.805 1.00 48.30 N ATOM 1466 CA LEU A 213 16.071 36.048 -7.784 1.00 38.54 C ATOM 1467 C LEU A 213 16.123 37.384 -7.053 1.00 38.41 C ATOM 1468 O LEU A 213 15.078 38.017 -6.872 1.00 38.66 O ATOM 1469 CB LEU A 213 15.008 35.156 -7.139 1.00 29.12 C ATOM 1470 CG LEU A 213 14.674 33.849 -7.855 1.00 43.41 C ATOM 1471 CD1 LEU A 213 13.571 33.112 -7.113 1.00 42.40 C ATOM 1472 CD2 LEU A 213 14.275 34.112 -9.295 1.00 38.47 C ATOM 1473 H LEU A 213 17.582 34.705 -7.033 1.00 0.00 H ATOM 1474 N VAL A 214 17.307 37.825 -6.629 1.00 37.49 N ATOM 1475 CA VAL A 214 17.421 39.078 -5.893 1.00 41.53 C ATOM 1476 C VAL A 214 17.057 40.238 -6.810 1.00 37.04 C ATOM 1477 O VAL A 214 17.493 40.300 -7.966 1.00 46.84 O ATOM 1478 CB VAL A 214 18.833 39.232 -5.311 1.00 36.90 C ATOM 1479 CG1 VAL A 214 18.996 40.594 -4.662 1.00 36.33 C ATOM 1480 CG2 VAL A 214 19.097 38.135 -4.289 1.00 39.74 C ATOM 1481 H VAL A 214 18.162 37.267 -6.826 1.00 0.00 H ATOM 1482 N GLY A 215 16.248 41.163 -6.296 1.00 39.14 N ATOM 1483 CA GLY A 215 15.695 42.241 -7.078 1.00 39.10 C ATOM 1484 C GLY A 215 14.253 42.030 -7.485 1.00 45.39 C ATOM 1485 O GLY A 215 13.549 43.008 -7.764 1.00 47.45 O ATOM 1486 H GLY A 215 16.005 41.105 -5.287 1.00 0.00 H ATOM 1487 N LYS A 216 13.799 40.782 -7.520 1.00 41.72 N ATOM 1488 CA LYS A 216 12.412 40.482 -7.825 1.00 39.83 C ATOM 1489 C LYS A 216 11.524 40.800 -6.627 1.00 42.01 C ATOM 1490 O LYS A 216 11.991 40.977 -5.499 1.00 46.48 O ATOM 1491 CB LYS A 216 12.243 39.011 -8.218 1.00 38.62 C ATOM 1492 CG LYS A 216 12.495 38.704 -9.694 1.00 48.13 C ATOM 1493 CD LYS A 216 13.943 38.947 -10.085 1.00 55.57 C ATOM 1494 CE LYS A 216 14.120 38.951 -11.591 1.00 64.39 C ATOM 1495 NZ LYS A 216 15.437 39.538 -11.976 1.00 63.26 N ATOM 1496 HZ1 LYS A 216 15.493 40.518 -11.631 1.00 0.00 H ATOM 1497 HZ2 LYS A 216 16.203 38.976 -11.552 1.00 0.00 H ATOM 1498 HZ3 LYS A 216 15.530 39.528 -13.012 1.00 0.00 H ATOM 1499 H LYS A 216 14.455 39.999 -7.324 1.00 0.00 H ATOM 1500 N GLN A 217 10.224 40.872 -6.888 1.00 44.76 N ATOM 1501 CA GLN A 217 9.220 41.022 -5.848 1.00 46.44 C ATOM 1502 C GLN A 217 8.432 39.727 -5.717 1.00 43.49 C ATOM 1503 O GLN A 217 8.228 39.005 -6.695 1.00 50.75 O ATOM 1504 CB GLN A 217 8.266 42.178 -6.155 1.00 39.42 C ATOM 1505 CG GLN A 217 8.945 43.524 -6.293 1.00 38.70 C ATOM 1506 CD GLN A 217 7.968 44.627 -6.642 1.00 44.00 C ATOM 1507 OE1 GLN A 217 6.754 44.450 -6.539 1.00 39.02 O ATOM 1508 NE2 GLN A 217 8.494 45.773 -7.065 1.00 35.19 N ATOM 1509 HE22 GLN A 217 9.526 45.876 -7.136 1.00 0.00 H ATOM 1510 HE21 GLN A 217 7.873 46.566 -7.325 1.00 0.00 H ATOM 1511 H GLN A 217 9.911 40.819 -7.878 1.00 0.00 H ATOM 1512 N VAL A 218 7.995 39.434 -4.497 1.00 47.33 N ATOM 1513 CA VAL A 218 7.179 38.261 -4.217 1.00 48.92 C ATOM 1514 C VAL A 218 5.876 38.722 -3.583 1.00 46.03 C ATOM 1515 O VAL A 218 5.864 39.659 -2.777 1.00 47.48 O ATOM 1516 CB VAL A 218 7.911 37.253 -3.307 1.00 48.12 C ATOM 1517 CG1 VAL A 218 9.049 36.589 -4.068 1.00 45.31 C ATOM 1518 CG2 VAL A 218 8.435 37.942 -2.057 1.00 45.29 C ATOM 1519 H VAL A 218 8.246 40.067 -3.711 1.00 0.00 H ATOM 1520 N GLU A 219 4.778 38.077 -3.964 1.00 50.62 N ATOM 1521 CA GLU A 219 3.458 38.404 -3.447 1.00 56.16 C ATOM 1522 C GLU A 219 2.881 37.176 -2.760 1.00 61.19 C ATOM 1523 O GLU A 219 2.875 36.083 -3.336 1.00 59.32 O ATOM 1524 CB GLU A 219 2.530 38.888 -4.566 1.00 58.53 C ATOM 1525 CG GLU A 219 1.195 39.431 -4.073 1.00 70.24 C ATOM 1526 CD GLU A 219 0.339 40.005 -5.194 1.00 79.55 C ATOM 1527 OE1 GLU A 219 0.184 41.246 -5.254 1.00 83.01 O ATOM 1528 OE2 GLU A 219 -0.173 39.215 -6.018 1.00 67.01 O ATOM 1529 H GLU A 219 4.866 37.308 -4.659 1.00 0.00 H ATOM 1530 N TYR A 220 2.415 37.356 -1.525 1.00 59.26 N ATOM 1531 CA TYR A 220 1.834 36.281 -0.736 1.00 61.61 C ATOM 1532 C TYR A 220 0.453 36.694 -0.247 1.00 68.03 C ATOM 1533 O TYR A 220 0.193 37.875 0.000 1.00 60.91 O ATOM 1534 CB TYR A 220 2.723 35.913 0.462 1.00 48.87 C ATOM 1535 CG TYR A 220 4.022 35.239 0.083 1.00 54.47 C ATOM 1536 CD1 TYR A 220 4.088 33.861 -0.086 1.00 67.72 C ATOM 1537 CD2 TYR A 220 5.185 35.976 -0.104 1.00 49.40 C ATOM 1538 CE1 TYR A 220 5.274 33.237 -0.433 1.00 54.36 C ATOM 1539 CE2 TYR A 220 6.375 35.361 -0.449 1.00 49.80 C ATOM 1540 CZ TYR A 220 6.414 33.992 -0.611 1.00 50.47 C ATOM 1541 OH TYR A 220 7.595 33.379 -0.954 1.00 51.14 O ATOM 1542 HH TYR A 220 7.449 32.403 -1.029 1.00 0.00 H ATOM 1543 H TYR A 220 2.469 38.307 -1.107 1.00 0.00 H ATOM 1544 N ALA A 221 -0.432 35.707 -0.114 1.00 75.97 N ATOM 1545 CA ALA A 221 -1.791 35.912 0.379 1.00 77.08 C ATOM 1546 C ALA A 221 -1.883 35.313 1.777 1.00 77.34 C ATOM 1547 O ALA A 221 -1.845 34.088 1.936 1.00 86.61 O ATOM 1548 CB ALA A 221 -2.818 35.283 -0.561 1.00 64.72 C ATOM 1549 H ALA A 221 -0.141 34.743 -0.374 1.00 0.00 H ATOM 1550 N LYS A 222 -1.999 36.174 2.784 1.00 81.71 N ATOM 1551 CA LYS A 222 -2.043 35.727 4.174 1.00 83.95 C ATOM 1552 C LYS A 222 -3.291 36.248 4.886 1.00 81.73 C ATOM 1553 O LYS A 222 -4.376 35.677 4.768 1.00 70.11 O ATOM 1554 CB LYS A 222 -0.787 36.182 4.923 1.00 80.12 C ATOM 1555 CG LYS A 222 0.490 36.142 4.093 1.00 79.82 C ATOM 1556 CD LYS A 222 0.909 34.718 3.758 1.00 76.40 C ATOM 1557 CE LYS A 222 1.345 33.969 5.004 1.00 84.96 C ATOM 1558 NZ LYS A 222 2.413 34.700 5.740 1.00 64.41 N ATOM 1559 HZ1 LYS A 222 3.241 34.817 5.121 1.00 0.00 H ATOM 1560 HZ2 LYS A 222 2.058 35.634 6.026 1.00 0.00 H ATOM 1561 HZ3 LYS A 222 2.684 34.157 6.585 1.00 0.00 H ATOM 1562 H LYS A 222 -2.060 37.191 2.577 1.00 0.00 H TER 1563 LYS A 222 ATOM 1564 N ARG A 228 0.122 41.540 0.416 1.00 56.15 N ATOM 1565 CA ARG A 228 1.399 41.470 1.117 1.00 55.34 C ATOM 1566 C ARG A 228 2.550 41.274 0.135 1.00 48.11 C ATOM 1567 O ARG A 228 2.759 40.174 -0.379 1.00 43.76 O ATOM 1568 CB ARG A 228 1.386 40.338 2.142 1.00 53.37 C ATOM 1569 CG ARG A 228 2.516 40.403 3.152 1.00 50.43 C ATOM 1570 CD ARG A 228 2.817 39.024 3.708 1.00 62.59 C ATOM 1571 NE ARG A 228 3.680 39.078 4.884 1.00 64.21 N ATOM 1572 CZ ARG A 228 4.333 38.031 5.377 1.00 62.68 C ATOM 1573 NH1 ARG A 228 4.235 36.847 4.785 1.00 58.46 N ATOM 1574 NH2 ARG A 228 5.093 38.169 6.456 1.00 57.20 N ATOM 1575 HE ARG A 228 3.791 39.993 5.366 1.00 0.00 H ATOM 1576 HH12 ARG A 228 4.747 36.028 5.172 1.00 0.00 H ATOM 1577 HH11 ARG A 228 3.647 36.738 3.934 1.00 0.00 H ATOM 1578 HH22 ARG A 228 5.604 37.349 6.841 1.00 0.00 H ATOM 1579 HH21 ARG A 228 5.178 39.097 6.917 1.00 0.00 H ATOM 1580 HN3 ARG A 228 -0.033 40.656 -0.109 1.00 0.00 H ATOM 1581 HN2 ARG A 228 0.136 42.341 -0.248 1.00 0.00 H ATOM 1582 HN1 ARG A 228 -0.644 41.674 1.106 1.00 0.00 H ATOM 1583 N THR A 229 3.297 42.344 -0.119 1.00 50.49 N ATOM 1584 CA THR A 229 4.378 42.329 -1.090 1.00 46.68 C ATOM 1585 C THR A 229 5.708 42.594 -0.398 1.00 45.08 C ATOM 1586 O THR A 229 5.779 43.309 0.606 1.00 40.51 O ATOM 1587 CB THR A 229 4.157 43.374 -2.190 1.00 53.40 C ATOM 1588 OG1 THR A 229 2.763 43.445 -2.509 1.00 61.72 O ATOM 1589 CG2 THR A 229 4.936 43.001 -3.447 1.00 54.91 C ATOM 1590 HG1 THR A 229 2.622 44.120 -3.219 1.00 0.00 H ATOM 1591 H THR A 229 3.100 43.225 0.397 1.00 0.00 H ATOM 1592 N GLY A 230 6.766 42.005 -0.950 1.00 43.19 N ATOM 1593 CA GLY A 230 8.107 42.245 -0.462 1.00 45.46 C ATOM 1594 C GLY A 230 9.091 42.198 -1.609 1.00 39.46 C ATOM 1595 O GLY A 230 8.731 41.940 -2.760 1.00 36.66 O ATOM 1596 H GLY A 230 6.626 41.357 -1.751 1.00 0.00 H ATOM 1597 N MET A 231 10.350 42.457 -1.279 1.00 30.54 N ATOM 1598 CA MET A 231 11.431 42.391 -2.247 1.00 36.93 C ATOM 1599 C MET A 231 12.479 41.394 -1.776 1.00 33.57 C ATOM 1600 O MET A 231 12.768 41.298 -0.578 1.00 26.79 O ATOM 1601 CB MET A 231 12.082 43.760 -2.468 1.00 32.08 C ATOM 1602 CG MET A 231 12.784 43.871 -3.817 1.00 33.94 C ATOM 1603 SD MET A 231 14.166 45.026 -3.822 1.00 64.71 S ATOM 1604 CE MET A 231 13.352 46.549 -3.347 1.00 44.44 C ATOM 1605 H MET A 231 10.570 42.715 -0.296 1.00 0.00 H ATOM 1606 N VAL A 232 13.040 40.658 -2.729 1.00 32.17 N ATOM 1607 CA VAL A 232 14.124 39.723 -2.453 1.00 32.40 C ATOM 1608 C VAL A 232 15.428 40.507 -2.406 1.00 29.86 C ATOM 1609 O VAL A 232 15.830 41.118 -3.402 1.00 32.57 O ATOM 1610 CB VAL A 232 14.175 38.617 -3.514 1.00 37.62 C ATOM 1611 CG1 VAL A 232 15.245 37.610 -3.172 1.00 36.17 C ATOM 1612 CG2 VAL A 232 12.814 37.945 -3.641 1.00 31.04 C ATOM 1613 H VAL A 232 12.694 40.752 -3.705 1.00 0.00 H ATOM 1614 N ILE A 233 16.094 40.490 -1.253 1.00 30.79 N ATOM 1615 CA ILE A 233 17.234 41.365 -1.017 1.00 30.30 C ATOM 1616 C ILE A 233 18.560 40.619 -0.897 1.00 29.41 C ATOM 1617 O ILE A 233 19.617 41.260 -1.005 1.00 28.52 O ATOM 1618 CB ILE A 233 17.010 42.246 0.230 1.00 39.41 C ATOM 1619 CG1 ILE A 233 16.735 41.380 1.460 1.00 28.70 C ATOM 1620 CG2 ILE A 233 15.862 43.218 0.001 1.00 32.78 C ATOM 1621 CD1 ILE A 233 16.636 42.166 2.750 1.00 21.83 C ATOM 1622 H ILE A 233 15.793 39.836 -0.503 1.00 0.00 H ATOM 1623 N HIS A 234 18.550 39.305 -0.676 1.00 30.87 N ATOM 1624 CA HIS A 234 19.805 38.573 -0.549 1.00 33.77 C ATOM 1625 C HIS A 234 19.586 37.092 -0.826 1.00 36.43 C ATOM 1626 O HIS A 234 18.560 36.526 -0.443 1.00 33.12 O ATOM 1627 CB HIS A 234 20.420 38.752 0.844 1.00 25.78 C ATOM 1628 CG HIS A 234 21.637 37.911 1.076 1.00 33.31 C ATOM 1629 ND1 HIS A 234 22.837 38.144 0.437 1.00 37.33 N ATOM 1630 CD2 HIS A 234 21.837 36.829 1.867 1.00 31.12 C ATOM 1631 CE1 HIS A 234 23.724 37.247 0.830 1.00 40.37 C ATOM 1632 NE2 HIS A 234 23.143 36.437 1.697 1.00 41.77 N ATOM 1633 H HIS A 234 17.645 38.800 -0.594 1.00 0.00 H ATOM 1634 N GLN A 235 20.571 36.474 -1.474 1.00 35.16 N ATOM 1635 CA GLN A 235 20.588 35.040 -1.735 1.00 37.13 C ATOM 1636 C GLN A 235 21.583 34.366 -0.801 1.00 30.45 C ATOM 1637 O GLN A 235 22.760 34.740 -0.770 1.00 32.14 O ATOM 1638 CB GLN A 235 20.964 34.752 -3.189 1.00 34.12 C ATOM 1639 CG GLN A 235 20.995 33.276 -3.538 1.00 34.93 C ATOM 1640 CD GLN A 235 21.461 33.029 -4.958 1.00 30.52 C ATOM 1641 OE1 GLN A 235 20.726 32.482 -5.780 1.00 36.84 O ATOM 1642 NE2 GLN A 235 22.689 33.430 -5.254 1.00 44.27 N ATOM 1643 HE22 GLN A 235 23.276 33.888 -4.528 1.00 0.00 H ATOM 1644 HE21 GLN A 235 23.066 33.287 -6.213 1.00 0.00 H ATOM 1645 H GLN A 235 21.372 37.045 -1.812 1.00 0.00 H ATOM 1646 N VAL A 236 21.112 33.375 -0.047 1.00 28.22 N ATOM 1647 CA VAL A 236 21.979 32.658 0.883 1.00 36.59 C ATOM 1648 C VAL A 236 22.979 31.822 0.092 1.00 41.52 C ATOM 1649 O VAL A 236 22.594 30.974 -0.722 1.00 33.33 O ATOM 1650 CB VAL A 236 21.157 31.784 1.837 1.00 36.87 C ATOM 1651 CG1 VAL A 236 22.079 30.980 2.741 1.00 30.36 C ATOM 1652 CG2 VAL A 236 20.214 32.648 2.660 1.00 34.24 C ATOM 1653 H VAL A 236 20.110 33.107 -0.122 1.00 0.00 H ATOM 1654 N GLU A 237 24.271 32.055 0.339 1.00 34.18 N ATOM 1655 CA GLU A 237 25.322 31.373 -0.414 1.00 42.78 C ATOM 1656 C GLU A 237 25.245 29.860 -0.241 1.00 37.18 C ATOM 1657 O GLU A 237 25.221 29.112 -1.224 1.00 35.41 O ATOM 1658 CB GLU A 237 26.695 31.885 0.020 1.00 39.08 C ATOM 1659 CG GLU A 237 27.174 33.107 -0.726 1.00 53.08 C ATOM 1660 CD GLU A 237 28.667 33.324 -0.571 1.00 65.71 C ATOM 1661 OE1 GLU A 237 29.076 34.061 0.354 1.00 66.97 O ATOM 1662 OE2 GLU A 237 29.432 32.741 -1.368 1.00 70.34 O ATOM 1663 H GLU A 237 24.534 32.734 1.081 1.00 0.00 H ATOM 1664 N ALA A 238 25.212 29.390 1.010 1.00 34.51 N ATOM 1665 CA ALA A 238 25.233 27.953 1.265 1.00 31.72 C ATOM 1666 C ALA A 238 23.961 27.258 0.791 1.00 35.67 C ATOM 1667 O ALA A 238 23.945 26.028 0.675 1.00 38.06 O ATOM 1668 CB ALA A 238 25.453 27.688 2.756 1.00 27.55 C ATOM 1669 H ALA A 238 25.171 30.054 1.809 1.00 0.00 H ATOM 1670 N LYS A 239 22.898 28.013 0.521 1.00 42.88 N ATOM 1671 CA LYS A 239 21.616 27.445 0.100 1.00 34.32 C ATOM 1672 C LYS A 239 20.991 28.391 -0.912 1.00 31.99 C ATOM 1673 O LYS A 239 20.156 29.237 -0.571 1.00 39.17 O ATOM 1674 CB LYS A 239 20.692 27.228 1.298 1.00 34.25 C ATOM 1675 CG LYS A 239 20.455 25.770 1.660 1.00 44.65 C ATOM 1676 CD LYS A 239 19.327 25.182 0.832 1.00 48.51 C ATOM 1677 CE LYS A 239 18.918 23.809 1.344 1.00 60.82 C ATOM 1678 NZ LYS A 239 17.670 23.316 0.688 1.00 61.53 N ATOM 1679 HZ1 LYS A 239 16.893 23.980 0.881 1.00 0.00 H ATOM 1680 HZ2 LYS A 239 17.823 23.248 -0.338 1.00 0.00 H ATOM 1681 HZ3 LYS A 239 17.428 22.378 1.066 1.00 0.00 H ATOM 1682 H LYS A 239 22.982 29.046 0.613 1.00 0.00 H ATOM 1683 N PRO A 240 21.370 28.268 -2.187 1.00 41.71 N ATOM 1684 CA PRO A 240 21.040 29.315 -3.169 1.00 34.16 C ATOM 1685 C PRO A 240 19.555 29.456 -3.465 1.00 31.80 C ATOM 1686 O PRO A 240 19.166 30.459 -4.078 1.00 39.12 O ATOM 1687 CB PRO A 240 21.808 28.878 -4.425 1.00 44.61 C ATOM 1688 CG PRO A 240 22.788 27.833 -3.955 1.00 48.27 C ATOM 1689 CD PRO A 240 22.140 27.169 -2.790 1.00 35.32 C ATOM 1690 N SER A 241 18.721 28.497 -3.074 1.00 28.22 N ATOM 1691 CA SER A 241 17.279 28.610 -3.244 1.00 31.85 C ATOM 1692 C SER A 241 16.609 29.330 -2.083 1.00 35.77 C ATOM 1693 O SER A 241 15.397 29.563 -2.130 1.00 37.60 O ATOM 1694 CB SER A 241 16.654 27.224 -3.409 1.00 32.57 C ATOM 1695 OG SER A 241 16.758 26.484 -2.205 1.00 37.35 O ATOM 1696 HG SER A 241 16.285 26.966 -1.481 1.00 0.00 H ATOM 1697 H SER A 241 19.111 27.639 -2.633 1.00 0.00 H ATOM 1698 N VAL A 242 17.363 29.672 -1.047 1.00 34.16 N ATOM 1699 CA VAL A 242 16.853 30.394 0.111 1.00 35.34 C ATOM 1700 C VAL A 242 17.236 31.860 -0.025 1.00 36.44 C ATOM 1701 O VAL A 242 18.372 32.186 -0.394 1.00 36.78 O ATOM 1702 CB VAL A 242 17.403 29.790 1.416 1.00 37.22 C ATOM 1703 CG1 VAL A 242 16.921 30.581 2.603 1.00 27.14 C ATOM 1704 CG2 VAL A 242 16.990 28.334 1.539 1.00 35.34 C ATOM 1705 H VAL A 242 18.370 29.411 -1.062 1.00 0.00 H ATOM 1706 N TYR A 243 16.288 32.748 0.267 1.00 31.59 N ATOM 1707 CA TYR A 243 16.485 34.175 0.065 1.00 24.69 C ATOM 1708 C TYR A 243 15.968 34.962 1.260 1.00 25.98 C ATOM 1709 O TYR A 243 15.062 34.519 1.971 1.00 29.79 O ATOM 1710 CB TYR A 243 15.767 34.666 -1.194 1.00 31.21 C ATOM 1711 CG TYR A 243 16.315 34.128 -2.492 1.00 36.39 C ATOM 1712 CD1 TYR A 243 15.881 32.912 -3.004 1.00 33.94 C ATOM 1713 CD2 TYR A 243 17.251 34.847 -3.217 1.00 32.51 C ATOM 1714 CE1 TYR A 243 16.372 32.429 -4.202 1.00 33.24 C ATOM 1715 CE2 TYR A 243 17.744 34.373 -4.411 1.00 37.02 C ATOM 1716 CZ TYR A 243 17.307 33.166 -4.898 1.00 31.24 C ATOM 1717 OH TYR A 243 17.812 32.704 -6.089 1.00 42.42 O ATOM 1718 HH TYR A 243 18.793 32.600 -6.012 1.00 0.00 H ATOM 1719 H TYR A 243 15.381 32.412 0.650 1.00 0.00 H ATOM 1720 N PHE A 244 16.556 36.140 1.467 1.00 20.71 N ATOM 1721 CA PHE A 244 15.999 37.120 2.388 1.00 24.09 C ATOM 1722 C PHE A 244 14.938 37.939 1.668 1.00 27.98 C ATOM 1723 O PHE A 244 15.128 38.348 0.519 1.00 29.25 O ATOM 1724 CB PHE A 244 17.081 38.062 2.922 1.00 29.82 C ATOM 1725 CG PHE A 244 18.139 37.393 3.760 1.00 33.41 C ATOM 1726 CD1 PHE A 244 18.001 36.084 4.189 1.00 31.19 C ATOM 1727 CD2 PHE A 244 19.275 38.095 4.129 1.00 24.64 C ATOM 1728 CE1 PHE A 244 18.981 35.490 4.962 1.00 29.34 C ATOM 1729 CE2 PHE A 244 20.253 37.508 4.900 1.00 22.46 C ATOM 1730 CZ PHE A 244 20.108 36.206 5.318 1.00 21.02 C ATOM 1731 H PHE A 244 17.435 36.365 0.958 1.00 0.00 H ATOM 1732 N ILE A 245 13.820 38.186 2.347 1.00 26.50 N ATOM 1733 CA ILE A 245 12.738 38.997 1.801 1.00 29.61 C ATOM 1734 C ILE A 245 12.360 40.060 2.821 1.00 30.58 C ATOM 1735 O ILE A 245 12.156 39.753 4.001 1.00 29.33 O ATOM 1736 CB ILE A 245 11.510 38.147 1.421 1.00 35.48 C ATOM 1737 CG1 ILE A 245 11.833 37.247 0.226 1.00 34.15 C ATOM 1738 CG2 ILE A 245 10.317 39.037 1.098 1.00 25.86 C ATOM 1739 CD1 ILE A 245 12.187 35.829 0.601 1.00 31.36 C ATOM 1740 H ILE A 245 13.714 37.786 3.301 1.00 0.00 H ATOM 1741 N LYS A 246 12.278 41.308 2.367 1.00 34.80 N ATOM 1742 CA LYS A 246 11.828 42.434 3.177 1.00 35.41 C ATOM 1743 C LYS A 246 10.421 42.809 2.732 1.00 32.12 C ATOM 1744 O LYS A 246 10.219 43.218 1.585 1.00 29.42 O ATOM 1745 CB LYS A 246 12.780 43.624 3.034 1.00 27.12 C ATOM 1746 CG LYS A 246 12.275 44.924 3.649 1.00 29.84 C ATOM 1747 CD LYS A 246 12.156 44.825 5.158 1.00 33.91 C ATOM 1748 CE LYS A 246 11.687 46.141 5.762 1.00 27.25 C ATOM 1749 NZ LYS A 246 10.346 46.542 5.251 1.00 37.72 N ATOM 1750 HZ1 LYS A 246 10.390 46.655 4.218 1.00 0.00 H ATOM 1751 HZ2 LYS A 246 9.651 45.807 5.492 1.00 0.00 H ATOM 1752 HZ3 LYS A 246 10.065 47.443 5.688 1.00 0.00 H ATOM 1753 H LYS A 246 12.550 41.491 1.380 1.00 0.00 H ATOM 1754 N PHE A 247 9.454 42.662 3.631 1.00 31.60 N ATOM 1755 CA PHE A 247 8.069 42.970 3.310 1.00 34.18 C ATOM 1756 C PHE A 247 7.733 44.404 3.694 1.00 41.93 C ATOM 1757 O PHE A 247 8.344 44.988 4.593 1.00 43.30 O ATOM 1758 CB PHE A 247 7.117 42.004 4.015 1.00 33.94 C ATOM 1759 CG PHE A 247 7.017 40.665 3.346 1.00 37.78 C ATOM 1760 CD1 PHE A 247 6.240 40.501 2.212 1.00 40.87 C ATOM 1761 CD2 PHE A 247 7.704 39.572 3.845 1.00 35.90 C ATOM 1762 CE1 PHE A 247 6.146 39.273 1.590 1.00 41.15 C ATOM 1763 CE2 PHE A 247 7.612 38.340 3.231 1.00 43.09 C ATOM 1764 CZ PHE A 247 6.833 38.191 2.100 1.00 48.16 C ATOM 1765 H PHE A 247 9.692 42.320 4.584 1.00 0.00 H ATOM 1766 N ASP A 248 6.752 44.967 2.995 1.00 51.05 N ATOM 1767 CA ASP A 248 6.333 46.335 3.262 1.00 50.48 C ATOM 1768 C ASP A 248 5.694 46.433 4.639 1.00 45.50 C ATOM 1769 O ASP A 248 4.854 45.607 5.006 1.00 50.10 O ATOM 1770 CB ASP A 248 5.350 46.801 2.189 1.00 49.71 C ATOM 1771 CG ASP A 248 5.863 46.558 0.783 1.00 62.46 C ATOM 1772 OD1 ASP A 248 7.081 46.717 0.552 1.00 59.13 O ATOM 1773 OD2 ASP A 248 5.045 46.200 -0.092 1.00 69.02 O ATOM 1774 H ASP A 248 6.277 44.422 2.247 1.00 0.00 H ATOM 1775 N ASP A 249 6.104 47.448 5.402 1.00 40.29 N ATOM 1776 CA ASP A 249 5.527 47.740 6.716 1.00 52.28 C ATOM 1777 C ASP A 249 5.700 46.566 7.678 1.00 39.14 C ATOM 1778 O ASP A 249 4.802 46.232 8.452 1.00 38.08 O ATOM 1779 CB ASP A 249 4.055 48.142 6.597 1.00 62.88 C ATOM 1780 CG ASP A 249 3.837 49.278 5.609 1.00 72.65 C ATOM 1781 OD1 ASP A 249 4.833 49.916 5.198 1.00 66.22 O ATOM 1782 OD2 ASP A 249 2.669 49.537 5.247 1.00 79.26 O ATOM 1783 H ASP A 249 6.867 48.059 5.048 1.00 0.00 H ATOM 1784 N ASP A 250 6.870 45.934 7.617 1.00 42.03 N ATOM 1785 CA ASP A 250 7.266 44.892 8.560 1.00 29.35 C ATOM 1786 C ASP A 250 8.784 44.906 8.598 1.00 28.74 C ATOM 1787 O ASP A 250 9.425 44.628 7.580 1.00 33.55 O ATOM 1788 CB ASP A 250 6.740 43.517 8.131 1.00 34.04 C ATOM 1789 CG ASP A 250 6.856 42.464 9.229 1.00 38.93 C ATOM 1790 OD1 ASP A 250 7.734 42.591 10.111 1.00 38.48 O ATOM 1791 OD2 ASP A 250 6.063 41.497 9.204 1.00 35.85 O ATOM 1792 H ASP A 250 7.534 46.195 6.861 1.00 0.00 H ATOM 1793 N PHE A 251 9.362 45.247 9.747 1.00 18.82 N ATOM 1794 CA PHE A 251 10.807 45.398 9.832 1.00 26.17 C ATOM 1795 C PHE A 251 11.533 44.090 10.125 1.00 28.41 C ATOM 1796 O PHE A 251 12.712 44.124 10.487 1.00 20.85 O ATOM 1797 CB PHE A 251 11.186 46.459 10.877 1.00 24.01 C ATOM 1798 CG PHE A 251 10.349 46.433 12.124 1.00 25.46 C ATOM 1799 CD1 PHE A 251 10.124 45.250 12.811 1.00 35.52 C ATOM 1800 CD2 PHE A 251 9.814 47.609 12.632 1.00 29.23 C ATOM 1801 CE1 PHE A 251 9.360 45.234 13.966 1.00 31.61 C ATOM 1802 CE2 PHE A 251 9.053 47.601 13.787 1.00 26.36 C ATOM 1803 CZ PHE A 251 8.826 46.411 14.456 1.00 34.79 C ATOM 1804 H PHE A 251 8.776 45.407 10.591 1.00 0.00 H ATOM 1805 N HIS A 252 10.865 42.947 9.980 1.00 29.80 N ATOM 1806 CA HIS A 252 11.554 41.668 10.052 1.00 26.50 C ATOM 1807 C HIS A 252 12.176 41.334 8.705 1.00 26.12 C ATOM 1808 O HIS A 252 11.714 41.785 7.654 1.00 30.28 O ATOM 1809 CB HIS A 252 10.601 40.539 10.454 1.00 26.92 C ATOM 1810 CG HIS A 252 10.210 40.556 11.897 1.00 32.47 C ATOM 1811 ND1 HIS A 252 9.036 41.123 12.344 1.00 30.70 N ATOM 1812 CD2 HIS A 252 10.836 40.070 12.995 1.00 28.56 C ATOM 1813 CE1 HIS A 252 8.957 40.989 13.657 1.00 34.34 C ATOM 1814 NE2 HIS A 252 10.036 40.353 14.076 1.00 33.42 N ATOM 1815 H HIS A 252 9.839 42.969 9.813 1.00 0.00 H ATOM 1816 N ILE A 253 13.234 40.535 8.745 1.00 29.12 N ATOM 1817 CA ILE A 253 13.815 39.946 7.547 1.00 22.21 C ATOM 1818 C ILE A 253 13.310 38.514 7.482 1.00 29.25 C ATOM 1819 O ILE A 253 13.596 37.705 8.371 1.00 28.26 O ATOM 1820 CB ILE A 253 15.347 40.007 7.566 1.00 21.43 C ATOM 1821 CG1 ILE A 253 15.820 41.456 7.730 1.00 23.83 C ATOM 1822 CG2 ILE A 253 15.921 39.391 6.297 1.00 18.39 C ATOM 1823 CD1 ILE A 253 15.298 42.403 6.665 1.00 18.32 C ATOM 1824 H ILE A 253 13.665 40.321 9.667 1.00 0.00 H ATOM 1825 N TYR A 254 12.532 38.202 6.451 1.00 27.67 N ATOM 1826 CA TYR A 254 11.984 36.865 6.295 1.00 25.39 C ATOM 1827 C TYR A 254 12.914 36.015 5.446 1.00 24.01 C ATOM 1828 O TYR A 254 13.598 36.511 4.546 1.00 24.70 O ATOM 1829 CB TYR A 254 10.589 36.913 5.670 1.00 28.64 C ATOM 1830 CG TYR A 254 9.534 37.446 6.612 1.00 32.09 C ATOM 1831 CD1 TYR A 254 9.371 38.812 6.799 1.00 27.98 C ATOM 1832 CD2 TYR A 254 8.708 36.585 7.323 1.00 25.59 C ATOM 1833 CE1 TYR A 254 8.415 39.306 7.661 1.00 24.02 C ATOM 1834 CE2 TYR A 254 7.747 37.071 8.187 1.00 27.74 C ATOM 1835 CZ TYR A 254 7.606 38.433 8.351 1.00 31.96 C ATOM 1836 OH TYR A 254 6.655 38.923 9.210 1.00 32.15 O ATOM 1837 HH TYR A 254 6.689 39.912 9.208 1.00 0.00 H ATOM 1838 H TYR A 254 12.311 38.929 5.741 1.00 0.00 H ATOM 1839 N VAL A 255 12.940 34.724 5.753 1.00 26.43 N ATOM 1840 CA VAL A 255 13.840 33.768 5.120 1.00 22.90 C ATOM 1841 C VAL A 255 12.967 32.660 4.545 1.00 26.48 C ATOM 1842 O VAL A 255 12.461 31.810 5.288 1.00 28.67 O ATOM 1843 CB VAL A 255 14.874 33.217 6.108 1.00 33.44 C ATOM 1844 CG1 VAL A 255 15.840 32.289 5.407 1.00 27.12 C ATOM 1845 CG2 VAL A 255 15.627 34.356 6.788 1.00 15.96 C ATOM 1846 H VAL A 255 12.285 34.377 6.482 1.00 0.00 H ATOM 1847 N TYR A 256 12.776 32.668 3.225 1.00 26.74 N ATOM 1848 CA TYR A 256 11.949 31.687 2.538 1.00 22.87 C ATOM 1849 C TYR A 256 12.771 30.922 1.511 1.00 29.23 C ATOM 1850 O TYR A 256 13.723 31.451 0.930 1.00 32.35 O ATOM 1851 CB TYR A 256 10.761 32.340 1.813 1.00 27.24 C ATOM 1852 CG TYR A 256 9.718 32.976 2.705 1.00 31.09 C ATOM 1853 CD1 TYR A 256 9.612 32.639 4.047 1.00 28.75 C ATOM 1854 CD2 TYR A 256 8.828 33.911 2.193 1.00 37.45 C ATOM 1855 CE1 TYR A 256 8.652 33.222 4.854 1.00 33.70 C ATOM 1856 CE2 TYR A 256 7.868 34.496 2.989 1.00 38.74 C ATOM 1857 CZ TYR A 256 7.785 34.149 4.318 1.00 35.60 C ATOM 1858 OH TYR A 256 6.827 34.735 5.111 1.00 46.41 O ATOM 1859 HH TYR A 256 6.901 34.380 6.032 1.00 0.00 H ATOM 1860 H TYR A 256 13.239 33.409 2.661 1.00 0.00 H ATOM 1861 N ASP A 257 12.380 29.673 1.279 1.00 35.09 N ATOM 1862 CA ASP A 257 12.908 28.886 0.173 1.00 29.87 C ATOM 1863 C ASP A 257 12.031 29.139 -1.047 1.00 38.32 C ATOM 1864 O ASP A 257 10.844 28.797 -1.046 1.00 45.35 O ATOM 1865 CB ASP A 257 12.940 27.401 0.534 1.00 40.14 C ATOM 1866 CG ASP A 257 13.614 26.548 -0.530 1.00 53.40 C ATOM 1867 OD1 ASP A 257 13.164 26.563 -1.698 1.00 50.02 O ATOM 1868 OD2 ASP A 257 14.602 25.859 -0.196 1.00 53.95 O ATOM 1869 H ASP A 257 11.673 29.243 1.909 1.00 0.00 H ATOM 1870 N LEU A 258 12.610 29.740 -2.082 1.00 42.88 N ATOM 1871 CA LEU A 258 11.854 30.114 -3.268 1.00 41.74 C ATOM 1872 C LEU A 258 11.887 29.056 -4.363 1.00 49.45 C ATOM 1873 O LEU A 258 11.292 29.275 -5.424 1.00 60.04 O ATOM 1874 CB LEU A 258 12.366 31.448 -3.819 1.00 42.84 C ATOM 1875 CG LEU A 258 12.042 32.665 -2.952 1.00 41.21 C ATOM 1876 CD1 LEU A 258 12.551 33.939 -3.609 1.00 54.80 C ATOM 1877 CD2 LEU A 258 10.545 32.752 -2.690 1.00 40.27 C ATOM 1878 H LEU A 258 13.628 29.948 -2.043 1.00 0.00 H ATOM 1879 N VAL A 259 12.564 27.931 -4.133 1.00 61.36 N ATOM 1880 CA VAL A 259 12.581 26.788 -5.050 1.00 47.25 C ATOM 1881 C VAL A 259 12.968 27.195 -6.471 1.00 67.04 C ATOM 1882 O VAL A 259 13.778 28.102 -6.672 1.00 65.55 O ATOM 1883 CB VAL A 259 11.219 26.066 -5.043 1.00 47.19 C ATOM 1884 CG1 VAL A 259 10.418 26.406 -6.292 1.00 47.98 C ATOM 1885 CG2 VAL A 259 11.419 24.568 -4.915 1.00 58.96 C ATOM 1886 H VAL A 259 13.112 27.860 -3.252 1.00 0.00 H TER 1887 VAL A 259 HETATM 1888 MG MG A 1 10.479 18.694 16.617 1.00 30.05 MG HETATM 1889 O HOH 2 28.223 45.191 3.022 1.00 44.51 O HETATM 1890 O HOH 3 16.597 35.452 21.444 1.00 34.08 O HETATM 1891 O HOH 4 27.168 50.650 24.094 1.00 45.66 O HETATM 1892 O HOH 5 9.403 25.752 36.997 1.00 63.41 O HETATM 1893 O HOH 6 17.819 42.552 17.257 1.00 24.24 O HETATM 1894 O HOH 7 25.832 21.971 4.847 1.00 44.17 O HETATM 1895 O HOH 8 17.269 13.778 16.574 1.00 48.98 O HETATM 1896 O HOH 9 4.768 40.444 7.239 1.00 41.11 O HETATM 1897 O HOH 10 13.619 50.818 23.707 1.00 33.75 O HETATM 1898 O HOH 11 9.771 42.291 6.261 1.00 27.76 O HETATM 1899 O HOH 12 23.480 45.218 18.931 1.00 27.49 O HETATM 1900 O HOH 13 19.736 59.449 20.061 1.00 39.50 O HETATM 1901 O HOH 14 13.945 61.641 19.646 1.00 38.60 O HETATM 1902 O HOH 15 30.280 52.707 16.909 1.00 28.32 O HETATM 1903 O HOH 16 24.417 36.025 -2.149 1.00 36.13 O HETATM 1904 O HOH 17 7.899 49.201 5.049 1.00 50.06 O HETATM 1905 O HOH 18 29.216 23.770 6.042 1.00 43.58 O HETATM 1906 O HOH 19 12.485 51.539 7.500 1.00 26.85 O HETATM 1907 O HOH 20 13.841 39.409 11.658 1.00 23.96 O HETATM 1908 O HOH 21 -1.389 42.283 2.429 1.00 36.71 O HETATM 1909 O HOH 22 11.604 20.574 17.086 1.00 25.07 O HETATM 1910 O HOH 23 25.511 31.376 3.444 1.00 26.45 O HETATM 1911 O HOH 24 23.937 33.534 21.453 1.00 35.99 O HETATM 1912 O HOH 25 12.050 17.934 15.699 1.00 34.22 O HETATM 1913 O HOH 26 22.623 37.681 -2.715 1.00 35.78 O HETATM 1914 O HOH 27 6.924 49.955 15.980 1.00 41.75 O HETATM 1915 O HOH 28 23.049 40.755 -0.232 1.00 40.84 O HETATM 1916 O HOH 29 10.701 25.816 13.901 1.00 32.42 O HETATM 1917 O HOH 30 17.884 54.983 5.311 1.00 29.77 O HETATM 1918 O HOH 31 9.731 45.799 0.850 1.00 34.87 O HETATM 1919 O HOH 32 16.777 59.337 10.803 1.00 34.70 O HETATM 1920 O HOH 33 27.358 19.168 26.412 1.00 51.69 O HETATM 1921 O HOH 34 29.260 31.020 18.493 1.00 28.75 O HETATM 1922 O HOH 35 8.113 60.980 23.739 1.00 43.93 O HETATM 1923 O HOH 36 9.721 48.356 17.912 1.00 25.16 O HETATM 1924 O HOH 37 31.050 37.252 22.322 1.00 48.04 O HETATM 1925 O HOH 38 28.618 44.049 6.108 1.00 30.92 O HETATM 1926 O HOH 39 11.181 18.296 18.518 1.00 34.69 O HETATM 1927 O HOH 40 29.191 32.538 6.103 1.00 28.58 O HETATM 1928 O HOH 41 6.151 54.386 19.983 1.00 39.26 O HETATM 1929 O HOH 42 19.308 56.370 2.730 1.00 30.08 O HETATM 1930 O HOH 43 36.433 53.475 21.500 1.00 52.79 O HETATM 1931 O HOH 44 25.033 34.096 2.620 1.00 14.45 O HETATM 1932 O HOH 45 17.823 48.355 22.343 1.00 40.05 O HETATM 1933 O HOH 46 10.335 37.419 17.579 1.00 35.49 O HETATM 1934 O HOH 47 29.131 39.742 21.321 1.00 27.94 O HETATM 1935 O HOH 48 14.969 38.058 21.511 1.00 34.22 O HETATM 1936 O HOH 49 6.852 37.872 12.533 1.00 34.12 O HETATM 1937 O HOH 50 18.277 49.328 24.325 1.00 36.27 O HETATM 1938 O HOH 51 16.263 48.148 24.334 1.00 42.30 O HETATM 1939 O HOH 52 29.754 34.467 4.591 1.00 45.32 O HETATM 1940 O HOH 53 32.221 53.514 14.006 1.00 52.85 O HETATM 1941 C15 UNN A 54 11.403 44.378 20.160 1.00 0.03 C HETATM 1942 C14 UNN A 54 12.572 45.146 19.509 1.00 -0.03 C HETATM 1943 C06 UNN A 54 12.541 45.233 17.964 1.00 -0.03 C HETATM 1944 C05 UNN A 54 11.128 45.322 17.361 1.00 -0.03 C HETATM 1945 C04 UNN A 54 9.991 45.051 18.347 1.00 0.03 C HETATM 1946 N03 UNN A 54 10.351 43.968 19.270 1.00 -0.27 N HETATM 1947 C02 UNN A 54 9.717 42.693 19.271 1.00 0.20 C HETATM 1948 O01 UNN A 54 8.848 42.455 18.484 1.00 -0.39 O HETATM 1949 C16 UNN A 54 10.168 41.625 20.269 1.00 0.08 C HETATM 1950 C17 UNN A 54 9.417 41.192 21.416 1.00 0.08 C HETATM 1951 N18 UNN A 54 8.129 41.777 21.691 1.00 -0.27 N HETATM 1952 C19 UNN A 54 7.208 41.612 22.813 1.00 0.06 C HETATM 1953 C20 UNN A 54 5.809 41.556 22.625 1.00 -0.04 C HETATM 1954 C21 UNN A 54 4.918 41.403 23.694 1.00 -0.07 C HETATM 1955 C22 UNN A 54 5.369 41.298 25.003 1.00 -0.07 C HETATM 1956 C23 UNN A 54 6.739 41.351 25.221 1.00 -0.07 C HETATM 1957 C24 UNN A 54 7.637 41.508 24.163 1.00 -0.04 C HETATM 1958 H28 UNN A 54 8.698 41.552 24.380 1.00 0.05 H HETATM 1959 H27 UNN A 54 7.119 41.269 26.233 1.00 0.06 H HETATM 1960 H26 UNN A 54 4.675 41.179 25.827 1.00 0.05 H HETATM 1961 H25 UNN A 54 3.853 41.366 23.495 1.00 0.06 H HETATM 1962 H24 UNN A 54 5.412 41.634 21.619 1.00 0.05 H HETATM 1963 H23 UNN A 54 7.798 42.429 20.966 1.00 0.21 H HETATM 1964 C25 UNN A 54 9.993 40.173 22.249 1.00 -0.01 C HETATM 1965 C26 UNN A 54 11.263 39.558 22.044 1.00 0.04 C HETATM 1966 C27 UNN A 54 11.870 38.447 22.947 1.00 0.21 C HETATM 1967 N28 UNN A 54 11.684 37.050 22.707 1.00 -0.27 N HETATM 1968 C29 UNN A 54 12.263 35.925 23.545 1.00 0.03 C HETATM 1969 C30 UNN A 54 12.998 34.860 22.675 1.00 -0.03 C HETATM 1970 C31 UNN A 54 12.126 34.308 21.562 1.00 -0.03 C HETATM 1971 C32 UNN A 54 12.847 33.305 20.716 1.00 -0.01 C HETATM 1972 C33 UNN A 54 11.872 32.739 19.649 1.00 -0.03 C HETATM 1973 N34 UNN A 54 12.664 31.922 18.732 1.00 0.24 N HETATM 1974 C35 UNN A 54 13.067 30.788 19.601 1.00 -0.03 C HETATM 1975 C36 UNN A 54 13.099 29.555 18.687 1.00 -0.01 C HETATM 1976 C37 UNN A 54 12.421 29.983 17.382 1.00 -0.01 C HETATM 1977 C38 UNN A 54 11.754 31.302 17.723 1.00 -0.03 C HETATM 1978 H46 UNN A 54 11.670 31.939 16.830 1.00 0.08 H HETATM 1979 H47 UNN A 54 10.754 31.135 18.150 1.00 0.08 H HETATM 1980 H44 UNN A 54 11.675 29.238 17.068 1.00 0.03 H HETATM 1981 H45 UNN A 54 13.164 30.117 16.582 1.00 0.03 H HETATM 1982 H42 UNN A 54 12.549 28.722 19.149 1.00 0.03 H HETATM 1983 H43 UNN A 54 14.138 29.247 18.496 1.00 0.03 H HETATM 1984 H40 UNN A 54 12.336 30.646 20.410 1.00 0.08 H HETATM 1985 H41 UNN A 54 14.062 30.971 20.033 1.00 0.08 H HETATM 1986 H39 UNN A 54 13.433 32.421 18.314 1.00 0.20 H HETATM 1987 H37 UNN A 54 11.393 33.563 19.101 1.00 0.08 H HETATM 1988 H38 UNN A 54 11.100 32.122 20.133 1.00 0.08 H HETATM 1989 H35 UNN A 54 13.214 32.485 21.351 1.00 0.03 H HETATM 1990 H36 UNN A 54 13.698 33.790 20.216 1.00 0.03 H HETATM 1991 C39 UNN A 54 11.647 35.484 20.730 1.00 -0.03 C HETATM 1992 C40 UNN A 54 10.899 36.481 21.614 1.00 0.03 C HETATM 1993 H50 UNN A 54 10.552 37.308 20.977 1.00 0.05 H HETATM 1994 H51 UNN A 54 10.031 35.965 22.050 1.00 0.05 H HETATM 1995 H48 UNN A 54 10.973 35.121 19.940 1.00 0.03 H HETATM 1996 H49 UNN A 54 12.514 35.983 20.272 1.00 0.03 H HETATM 1997 H34 UNN A 54 11.254 33.810 22.011 1.00 0.03 H HETATM 1998 H32 UNN A 54 13.308 34.028 23.325 1.00 0.03 H HETATM 1999 H33 UNN A 54 13.888 35.326 22.226 1.00 0.03 H HETATM 2000 H30 UNN A 54 11.445 35.433 24.091 1.00 0.05 H HETATM 2001 H31 UNN A 54 12.979 36.351 24.263 1.00 0.05 H HETATM 2002 O41 UNN A 54 12.547 38.767 23.888 1.00 -0.38 O HETATM 2003 C42 UNN A 54 11.915 40.028 20.918 1.00 -0.05 C HETATM 2004 C43 UNN A 54 11.410 41.003 20.075 1.00 -0.05 C HETATM 2005 H53 UNN A 54 12.006 41.301 19.220 1.00 0.06 H HETATM 2006 H52 UNN A 54 12.884 39.605 20.680 1.00 0.06 H HETATM 2007 H29 UNN A 54 9.414 39.844 23.105 1.00 0.06 H HETATM 2008 H13 UNN A 54 9.789 45.965 18.924 1.00 0.05 H HETATM 2009 H14 UNN A 54 9.089 44.763 17.787 1.00 0.05 H HETATM 2010 H15 UNN A 54 10.993 46.335 16.953 1.00 0.03 H HETATM 2011 H16 UNN A 54 11.057 44.586 16.546 1.00 0.03 H HETATM 2012 C07 UNN A 54 13.427 46.395 17.532 1.00 -0.01 C HETATM 2013 C08 UNN A 54 12.891 47.087 16.267 1.00 -0.03 C HETATM 2014 N09 UNN A 54 12.318 48.411 16.715 1.00 0.24 N HETATM 2015 C10 UNN A 54 13.394 48.969 17.590 1.00 -0.03 C HETATM 2016 C11 UNN A 54 13.537 50.445 17.200 1.00 -0.01 C HETATM 2017 C12 UNN A 54 13.038 50.557 15.760 1.00 -0.01 C HETATM 2018 C13 UNN A 54 12.250 49.285 15.480 1.00 -0.03 C HETATM 2019 H9 UNN A 54 12.690 48.755 14.623 1.00 0.08 H HETATM 2020 H10 UNN A 54 11.202 49.536 15.258 1.00 0.08 H HETATM 2021 H3 UNN A 54 13.889 50.638 15.067 1.00 0.03 H HETATM 2022 H4 UNN A 54 12.390 51.439 15.649 1.00 0.03 H HETATM 2023 H5 UNN A 54 12.928 51.075 17.864 1.00 0.03 H HETATM 2024 H6 UNN A 54 14.590 50.756 17.264 1.00 0.03 H HETATM 2025 H7 UNN A 54 13.110 48.880 18.649 1.00 0.08 H HETATM 2026 H8 UNN A 54 14.341 48.435 17.418 1.00 0.08 H HETATM 2027 H22 UNN A 54 11.428 48.327 17.181 1.00 0.20 H HETATM 2028 H20 UNN A 54 12.108 46.472 15.800 1.00 0.08 H HETATM 2029 H21 UNN A 54 13.707 47.250 15.548 1.00 0.08 H HETATM 2030 H18 UNN A 54 14.438 46.014 17.327 1.00 0.03 H HETATM 2031 H19 UNN A 54 13.471 47.131 18.348 1.00 0.03 H HETATM 2032 H17 UNN A 54 12.990 44.307 17.575 1.00 0.03 H HETATM 2033 H11 UNN A 54 13.508 44.647 19.800 1.00 0.03 H HETATM 2034 H12 UNN A 54 12.565 46.172 19.905 1.00 0.03 H HETATM 2035 H1 UNN A 54 10.960 45.027 20.930 1.00 0.05 H HETATM 2036 H2 UNN A 54 11.815 43.475 20.634 1.00 0.05 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1446 1447 1454 1455 1456 CONECT 1454 1446 CONECT 1455 1446 CONECT 1456 1446 CONECT 1564 1565 1580 1581 1582 CONECT 1580 1564 CONECT 1581 1564 CONECT 1582 1564 CONECT 1941 1942 1946 2035 2036 CONECT 1942 1941 1943 2033 2034 CONECT 1943 1942 1944 2012 2032 CONECT 1944 1943 1945 2010 2011 CONECT 1945 1944 1946 2008 2009 CONECT 1946 1941 1945 1947 CONECT 1947 1946 1948 1949 CONECT 1948 1947 CONECT 1949 1947 1950 2004 CONECT 1950 1949 1951 1964 CONECT 1951 1950 1952 1963 CONECT 1952 1951 1953 1957 CONECT 1953 1952 1954 1962 CONECT 1954 1953 1955 1961 CONECT 1955 1954 1956 1960 CONECT 1956 1955 1957 1959 CONECT 1957 1952 1956 1958 CONECT 1958 1957 CONECT 1959 1956 CONECT 1960 1955 CONECT 1961 1954 CONECT 1962 1953 CONECT 1963 1951 CONECT 1964 1950 1965 2007 CONECT 1965 1964 1966 2003 CONECT 1966 1965 1967 2002 CONECT 1967 1966 1968 1992 CONECT 1968 1967 1969 2000 2001 CONECT 1969 1968 1970 1998 1999 CONECT 1970 1969 1971 1991 1997 CONECT 1971 1970 1972 1989 1990 CONECT 1972 1971 1973 1987 1988 CONECT 1973 1972 1974 1977 1986 CONECT 1974 1973 1975 1984 1985 CONECT 1975 1974 1976 1982 1983 CONECT 1976 1975 1977 1980 1981 CONECT 1977 1973 1976 1978 1979 CONECT 1978 1977 CONECT 1979 1977 CONECT 1980 1976 CONECT 1981 1976 CONECT 1982 1975 CONECT 1983 1975 CONECT 1984 1974 CONECT 1985 1974 CONECT 1986 1973 CONECT 1987 1972 CONECT 1988 1972 CONECT 1989 1971 CONECT 1990 1971 CONECT 1991 1970 1992 1995 1996 CONECT 1992 1967 1991 1993 1994 CONECT 1993 1992 CONECT 1994 1992 CONECT 1995 1991 CONECT 1996 1991 CONECT 1997 1970 CONECT 1998 1969 CONECT 1999 1969 CONECT 2000 1968 CONECT 2001 1968 CONECT 2002 1966 CONECT 2003 1965 2004 2006 CONECT 2004 1949 2003 2005 CONECT 2005 2004 CONECT 2006 2003 CONECT 2007 1964 CONECT 2008 1945 CONECT 2009 1945 CONECT 2010 1944 CONECT 2011 1944 CONECT 2012 1943 2013 2030 2031 CONECT 2013 2012 2014 2028 2029 CONECT 2014 2013 2015 2018 2027 CONECT 2015 2014 2016 2025 2026 CONECT 2016 2015 2017 2023 2024 CONECT 2017 2016 2018 2021 2022 CONECT 2018 2014 2017 2019 2020 CONECT 2019 2018 CONECT 2020 2018 CONECT 2021 2017 CONECT 2022 2017 CONECT 2023 2016 CONECT 2024 2016 CONECT 2025 2015 CONECT 2026 2015 CONECT 2027 2014 CONECT 2028 2013 CONECT 2029 2013 CONECT 2030 2012 CONECT 2031 2012 CONECT 2032 1943 CONECT 2033 1942 CONECT 2034 1942 CONECT 2035 1941 CONECT 2036 1941 MASTER 0 0 0 0 0 0 0 0 2033 3 108 16 END
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Structure:
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Protein
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Related entries of code: 5jsg
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4h75
RCSB PDB
PDBbind
238aa, >4H75_1|Chain... *
4mzf
RCSB PDB
PDBbind
224aa, >4MZF_2|Chain... at 95%
4mzh
RCSB PDB
PDBbind
224aa, >4MZH_1|Chain... at 95%
5jsj
RCSB PDB
PDBbind
222aa, >5JSJ_1|Chains... at 95%
6qpl
RCSB PDB
PDBbind
222aa, >6QPL_1|Chain... at 96%
6i8y
RCSB PDB
PDBbind
222aa, >6I8Y_1|Chain... at 96%
6i8l
RCSB PDB
PDBbind
222aa, >6I8L_1|Chain... at 96%
6i8b
RCSB PDB
PDBbind
222aa, >6I8B_1|Chains... at 96%
5y5w
RCSB PDB
PDBbind
235aa, >5Y5W_1|Chains... at 91%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5jsg
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Spindlin-1
Ligand Name
6P9
EC.Number
E.C.-.-.-.-
Resolution
2.5(Å)
Affinity (Kd/Ki/IC50)
Kd=14.2uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Nat. Chem. Biol. Vol. 13: pp. 750-756
Ligand Properties
Formula
C
3
6
H
5
3
N
5
O
2
Molecular Weight
587.838
Exact Mass
587.420
No. of atoms
96
No. of bonds
101
Polar Surface Area
61.53
LOGP Value
6.19 (
Computed with XLOGP3
)
6.36 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 12
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 6
Canonical SMILES
O=C(c1ccc(c(c1)Nc1ccccc1)C(=O)N1CCC(CC1)CC[NH+]1CCCC1)N1CCC(CC1)CC[NH+]1CCCC1
InChI String
InChI=1S/C36H51N5O2/c42-35(40-24-14-29(15-25-40)12-22-38-18-4-5-19-38)31-10-11-33(34(28-31)37-32-8-2-1-3-9-32)36(43)41-26-16-30(17-27-41)13-23-39-20-6-7-21-39/h1-3,8-11,28-30,37H,4-7,12-27H2/p+2
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):
Q9Y657
Entrez Gene ID
NCBI Entrez Gene ID:
10927
ASD
Information of known allosteric effects of PDB entries
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