Mouse prion 121-231 alpha carbon coordinates ... Kinemage model
Hamster amyloid H1 side chain coordinates ... Kinemage model
Prion dimer pdb alpha carbon coordinates ... Kinemage model
The structure of mouse prion fragment 121-231 was determined from solution NMR. Coordinates kindly provided by Dr. Martin Billeter of the Zurich group on 27 May 97. More graphics are available at his lab's home page. The data are in PDF format as used by the Brookhaven Protein Database.
HEADER CA-coordinates of the NMR structure of PrP(121-231). REMARK May 29, 1997. REMARK These coordinates describe a refined mean structure REMARK calculated with a more complete NMR input compared to REMARK the structure presented by Riek et al. (Nature 382, REMARK 180-182, 1996). A publication describing this refined REMARK structure is submitted, and the complete set of REMARK coordinates is deposited with the Protein Data Bank REMARK accession code 1AG2. ATOM 1 CA GLY 124 -10.625 12.191 4.609 1.00 1.00 ATOM 2 CA LEU 125 -8.514 13.845 1.821 1.00 1.00 ATOM 3 CA GLY 126 -11.828 14.646 0.116 1.00 1.00 ATOM 4 CA GLY 127 -13.173 11.587 -1.690 1.00 1.00 ATOM 5 CA TYR 128 -11.752 8.818 0.495 1.00 1.00 ATOM 6 CA MET 129 -10.899 7.653 4.014 1.00 1.00 ATOM 7 CA LEU 130 -7.220 8.171 4.816 1.00 1.00 ATOM 8 CA GLY 131 -7.421 5.757 7.773 1.00 1.00 ATOM 9 CA SER 132 -5.657 6.939 10.977 1.00 1.00 ATOM 10 CA ALA 133 -2.936 4.214 10.620 1.00 1.00 ATOM 11 CA MET 134 -2.793 0.543 9.544 1.00 1.00 ATOM 12 CA SER 135 -0.370 -2.402 9.798 1.00 1.00 ATOM 13 CA ARG 136 2.760 -2.863 7.762 1.00 1.00 ATOM 14 CA PRO 137 1.869 -5.933 5.599 1.00 1.00 ATOM 15 CA MET 138 4.275 -8.831 5.075 1.00 1.00 ATOM 16 CA ILE 139 4.304 -10.198 1.523 1.00 1.00 ATOM 17 CA HIS 140 6.286 -13.003 -0.068 1.00 1.00 ATOM 18 CA PHE 141 7.427 -11.385 -3.346 1.00 1.00 ATOM 19 CA GLY 142 8.403 -14.751 -4.961 1.00 1.00 ATOM 20 CA ASN 143 12.115 -13.773 -4.913 1.00 1.00 ATOM 21 CA ASP 144 14.027 -13.790 -1.580 1.00 1.00 ATOM 22 CA TRP 145 15.643 -10.415 -2.190 1.00 1.00 ATOM 23 CA GLU 146 12.412 -8.701 -3.176 1.00 1.00 ATOM 24 CA ASP 147 10.962 -9.925 0.157 1.00 1.00 ATOM 25 CA ARG 148 14.110 -8.622 1.873 1.00 1.00 ATOM 26 CA TYR 149 13.900 -5.387 -0.188 1.00 1.00 ATOM 27 CA TYR 150 10.422 -4.614 1.152 1.00 1.00 ATOM 28 CA ARG 151 11.243 -5.834 4.709 1.00 1.00 ATOM 29 CA GLU 152 14.448 -3.847 4.933 1.00 1.00 ATOM 30 CA ASN 153 12.276 -0.844 3.912 1.00 1.00 ATOM 31 CA MET 154 8.901 -1.385 5.673 1.00 1.00 ATOM 32 CA TYR 155 9.952 1.227 8.313 1.00 1.00 ATOM 33 CA ARG 156 10.343 4.031 5.716 1.00 1.00 ATOM 34 CA TYR 157 7.170 2.932 3.860 1.00 1.00 ATOM 35 CA PRO 158 3.547 4.109 4.508 1.00 1.00 ATOM 36 CA ASN 159 1.795 3.641 7.869 1.00 1.00 ATOM 37 CA GLN 160 -1.466 5.123 6.481 1.00 1.00 ATOM 38 CA VAL 161 -3.245 4.727 3.103 1.00 1.00 ATOM 39 CA TYR 162 -6.394 6.071 1.466 1.00 1.00 ATOM 40 CA TYR 163 -9.273 3.678 0.865 1.00 1.00 ATOM 41 CA ARG 164 -12.479 3.926 -1.145 1.00 1.00 ATOM 42 CA PRO 165 -14.631 1.312 0.705 1.00 1.00 ATOM 43 CA VAL 166 -15.694 -1.858 -1.148 1.00 1.00 ATOM 44 CA ASP 167 -19.251 -1.526 0.134 1.00 1.00 ATOM 45 CA GLN 168 -20.607 -3.114 -3.103 1.00 1.00 ATOM 46 CA TYR 169 -18.180 -2.875 -6.082 1.00 1.00 ATOM 47 CA SER 170 -16.394 -6.209 -5.253 1.00 1.00 ATOM 48 CA ASN 171 -12.921 -7.238 -6.533 1.00 1.00 ATOM 49 CA GLN 172 -10.089 -5.664 -4.521 1.00 1.00 ATOM 50 CA ASN 173 -8.132 -4.523 -7.589 1.00 1.00 ATOM 51 CA ASN 174 -11.028 -2.215 -8.601 1.00 1.00 ATOM 52 CA PHE 175 -10.760 -0.101 -5.431 1.00 1.00 ATOM 53 CA VAL 176 -6.988 -0.628 -5.050 1.00 1.00 ATOM 54 CA HIS 177 -6.833 1.478 -8.278 1.00 1.00 ATOM 55 CA ASP 178 -7.340 4.737 -6.307 1.00 1.00 ATOM 56 CA CYS 179 -4.874 3.416 -3.705 1.00 1.00 ATOM 57 CA VAL 180 -1.930 2.261 -5.872 1.00 1.00 ATOM 58 CA ASN 181 -2.600 5.595 -7.620 1.00 1.00 ATOM 59 CA ILE 182 -3.195 8.274 -4.989 1.00 1.00 ATOM 60 CA THR 183 -1.644 6.676 -1.872 1.00 1.00 ATOM 61 CA ILE 184 1.556 5.965 -3.838 1.00 1.00 ATOM 62 CA LYS 185 1.571 9.573 -5.069 1.00 1.00 ATOM 63 CA GLN 186 0.901 10.867 -1.547 1.00 1.00 ATOM 64 CA HIS 187 3.744 8.700 -0.147 1.00 1.00 ATOM 65 CA THR 188 6.142 9.904 -2.848 1.00 1.00 ATOM 66 CA VAL 189 5.365 13.627 -3.450 1.00 1.00 ATOM 67 CA THR 190 4.600 14.367 0.180 1.00 1.00 ATOM 68 CA THR 191 7.606 12.370 1.520 1.00 1.00 ATOM 69 CA THR 192 10.091 13.683 -1.095 1.00 1.00 ATOM 70 CA THR 193 8.943 17.153 0.062 1.00 1.00 ATOM 71 CA LYS 194 11.107 16.628 3.269 1.00 1.00 ATOM 72 CA GLY 195 14.023 15.235 1.165 1.00 1.00 ATOM 73 CA GLU 196 13.181 11.504 1.133 1.00 1.00 ATOM 74 CA ASN 197 13.297 9.873 -2.307 1.00 1.00 ATOM 75 CA PHE 198 11.857 6.493 -3.229 1.00 1.00 ATOM 76 CA THR 199 13.266 5.119 -6.488 1.00 1.00 ATOM 77 CA GLU 200 11.131 3.566 -9.221 1.00 1.00 ATOM 78 CA THR 201 11.978 0.212 -7.552 1.00 1.00 ATOM 79 CA ASP 202 11.005 1.533 -4.063 1.00 1.00 ATOM 80 CA VAL 203 7.659 2.665 -5.560 1.00 1.00 ATOM 81 CA LYS 204 7.076 -0.700 -7.386 1.00 1.00 ATOM 82 CA MET 205 7.765 -2.509 -4.103 1.00 1.00 ATOM 83 CA MET 206 5.306 -0.140 -2.349 1.00 1.00 ATOM 84 CA GLU 207 2.539 -1.128 -4.874 1.00 1.00 ATOM 85 CA ARG 208 2.327 -4.564 -3.256 1.00 1.00 ATOM 86 CA VAL 209 2.274 -3.083 0.230 1.00 1.00 ATOM 87 CA VAL 210 -0.389 -0.465 -0.666 1.00 1.00 ATOM 88 CA GLU 211 -2.761 -3.051 -2.265 1.00 1.00 ATOM 89 CA GLN 212 -2.336 -5.027 0.977 1.00 1.00 ATOM 90 CA MET 213 -2.648 -2.082 3.473 1.00 1.00 ATOM 91 CA CYS 214 -5.812 -0.686 1.832 1.00 1.00 ATOM 92 CA VAL 215 -7.407 -4.105 2.457 1.00 1.00 ATOM 93 CA THR 216 -5.463 -4.757 5.780 1.00 1.00 ATOM 94 CA GLN 217 -7.486 -1.722 7.003 1.00 1.00 ATOM 95 CA TYR 218 -11.081 -2.516 5.833 1.00 1.00 ATOM 96 CA GLN 219 -10.384 -6.330 6.145 1.00 1.00 ATOM 97 CA LYS 220 -12.447 -5.991 9.350 1.00 1.00 ATOM 98 CA GLU 221 -15.342 -6.629 6.910 1.00 1.00 ATOM 99 CA SER 222 -13.454 -7.591 3.704 1.00 1.00 ATOM 100 CA GLN 223 -11.818 -10.752 5.116 1.00 1.00 ATOM 101 CA ALA 224 -14.944 -12.077 3.308 1.00 1.00 ATOM 102 CA TYR 225 -13.379 -10.890 -0.018 1.00 1.00 ATOM 103 CA TYR 226 -9.556 -11.078 0.295 1.00 1.00 END
Proposed H1 model of Dr. Hideyo Inouye. Coordinates kindly provided on 11 Mar 1997. Note that these pdf coordinates also show the side chain atoms. The suggested structure is a hairpin loop.
ATOM 1 N MET 1 7.802 4.478 14.949 1.00 0.00 ATOM 2 CA MET 1 7.440 3.636 13.795 1.00 0.00 ATOM 3 C MET 1 7.944 4.370 12.576 1.00 0.00 ATOM 4 O MET 1 7.966 5.589 12.607 1.00 0.00 ATOM 5 CB MET 1 5.916 3.463 13.766 1.00 0.00 ATOM 6 CG MET 1 5.350 2.606 12.624 1.00 0.00 ATOM 7 SD MET 1 3.559 2.502 12.698 1.00 0.00 ATOM 8 CE MET 1 3.271 1.540 11.200 1.00 0.00 ATOM 9 H1 MET 1 7.461 4.057 15.832 1.00 0.00 ATOM 10 H2 MET 1 8.831 4.614 14.977 1.00 0.00 ATOM 11 H3 MET 1 7.378 5.412 14.791 1.00 0.00 ATOM 12 N LYS 2 8.381 3.615 11.563 1.00 0.00 ATOM 13 CA LYS 2 8.769 4.265 10.317 1.00 0.00 ATOM 14 C LYS 2 8.329 3.375 9.163 1.00 0.00 ATOM 15 O LYS 2 8.449 2.169 9.271 1.00 0.00 ATOM 16 CB LYS 2 10.292 4.492 10.314 1.00 0.00 ATOM 17 CG LYS 2 10.964 4.308 8.953 1.00 0.00 ATOM 18 CD LYS 2 12.236 3.458 9.024 1.00 0.00 ATOM 19 CE LYS 2 12.551 2.790 7.691 1.00 0.00 ATOM 20 NZ LYS 2 13.803 2.024 7.808 1.00 0.00 ATOM 21 H LYS 2 8.379 2.615 11.598 1.00 0.00 ATOM 22 HZ1 LYS 2 14.010 1.552 6.909 1.00 0.00 ATOM 23 HZ2 LYS 2 14.595 2.665 8.041 1.00 0.00 ATOM 24 HZ3 LYS 2 13.703 1.312 8.557 1.00 0.00 ATOM 25 N HIS 3 8.052 3.973 7.880 1.00 0.00 ATOM 26 CA HIS 3 7.474 3.160 6.795 1.00 0.00 ATOM 27 C HIS 3 7.853 3.776 5.466 1.00 0.00 ATOM 28 O HIS 3 7.884 4.993 5.355 1.00 0.00 ATOM 29 CB HIS 3 5.946 3.100 6.957 1.00 0.00 ATOM 30 CG HIS 3 5.263 3.221 5.620 1.00 0.00 ATOM 31 ND1 HIS 3 3.944 3.463 5.471 1.00 0.00 ATOM 32 CD2 HIS 3 5.861 3.131 4.359 1.00 0.00 ATOM 33 CE1 HIS 3 3.701 3.526 4.123 1.00 0.00 ATOM 34 NE2 HIS 3 4.885 3.324 3.452 1.00 0.00 ATOM 35 H HIS 3 8.028 4.964 7.784 1.00 0.00 ATOM 36 HD1 HIS 3 3.265 3.571 6.176 1.00 0.00 ATOM 37 N MET 4 8.322 3.244 4.659 1.00 0.00 ATOM 38 CA MET 4 8.666 3.867 3.386 1.00 0.00 ATOM 39 C MET 4 8.348 2.883 2.270 1.00 0.00 ATOM 40 O MET 4 8.683 1.721 2.404 1.00 0.00 ATOM 41 CB MET 4 10.156 4.253 3.411 1.00 0.00 ATOM 42 CG MET 4 10.971 3.769 2.213 1.00 0.00 ATOM 43 SD MET 4 12.712 4.231 2.357 1.00 0.00 ATOM 44 CE MET 4 13.234 3.654 0.739 1.00 0.00 ATOM 45 H MET 4 8.387 2.250 4.731 1.00 0.00 ATOM 46 N ALA 5 7.692 3.407 1.216 1.00 0.00 ATOM 47 CA ALA 5 7.381 2.682 -0.024 1.00 0.00 ATOM 48 C ALA 5 6.858 3.744 -0.972 1.00 0.00 ATOM 49 O ALA 5 6.203 4.669 -0.519 1.00 0.00 ATOM 50 CB ALA 5 6.302 1.605 0.184 1.00 0.00 ATOM 51 H ALA 5 7.381 4.355 1.238 1.00 0.00 ATOM 52 N GLY 6 7.274 3.661 -2.233 1.00 0.00 ATOM 53 CA GLY 6 7.589 4.911 -2.932 1.00 0.00 ATOM 54 C GLY 6 6.379 5.656 -3.461 1.00 0.00 ATOM 55 O GLY 6 5.957 5.473 -4.600 1.00 0.00 ATOM 56 H GLY 6 7.284 2.789 -2.723 1.00 0.00 ATOM 57 N ALA 7 5.855 6.495 -2.553 1.00 0.00 ATOM 58 CA ALA 7 4.499 7.037 -2.691 1.00 0.00 ATOM 59 C ALA 7 3.435 5.950 -2.905 1.00 0.00 ATOM 60 O ALA 7 3.737 4.813 -3.228 1.00 0.00 ATOM 61 CB ALA 7 4.409 8.088 -3.811 1.00 0.00 ATOM 62 H ALA 7 6.369 6.619 -1.702 1.00 0.00 ATOM 63 N ALA 8 2.164 6.321 -2.728 1.00 0.00 ATOM 64 CA ALA 8 1.785 6.990 -1.492 1.00 0.00 ATOM 65 C ALA 8 1.202 5.931 -0.573 1.00 0.00 ATOM 66 O ALA 8 1.063 4.780 -0.972 1.00 0.00 ATOM 67 CB ALA 8 0.737 8.068 -1.769 1.00 0.00 ATOM 68 H ALA 8 1.490 5.751 -3.206 1.00 0.00 ATOM 69 N ALA 9 0.880 6.348 0.655 1.00 0.00 ATOM 70 CA ALA 9 0.315 5.406 1.621 1.00 0.00 ATOM 71 C ALA 9 -0.197 6.180 2.808 1.00 0.00 ATOM 72 O ALA 9 -0.127 7.405 2.819 1.00 0.00 ATOM 73 CB ALA 9 1.371 4.409 2.119 1.00 0.00 ATOM 74 H ALA 9 0.966 7.305 0.936 1.00 0.00 ATOM 75 N ALA 10 -0.697 5.433 3.801 1.00 0.00 ATOM 76 CA ALA 10 -1.162 6.092 5.008 1.00 0.00 ATOM 77 C ALA 10 -0.660 5.349 6.232 1.00 0.00 ATOM 78 O ALA 10 -0.516 4.132 6.213 1.00 0.00 ATOM 79 CB ALA 10 -2.693 6.120 5.024 1.00 0.00 ATOM 80 H ALA 10 -0.731 4.435 3.748 1.00 0.00 ATOM 81 N GLY 11 -0.375 6.115 7.296 1.00 0.00 ATOM 82 CA GLY 11 0.046 5.444 8.527 1.00 0.00 ATOM 83 C GLY 11 -0.316 6.257 9.741 1.00 0.00 ATOM 84 O GLY 11 -0.144 7.469 9.744 1.00 0.00 ATOM 85 H GLY 11 -0.437 7.115 7.264 1.00 0.00 ATOM 86 N ALA 12 -0.833 5.543 10.741 1.00 0.00 ATOM 87 CA ALA 12 -1.282 6.227 11.941 1.00 0.00 ATOM 88 C ALA 12 -0.887 5.421 13.159 1.00 0.00 ATOM 89 O ALA 12 -1.008 4.202 13.156 1.00 0.00 ATOM 90 CB ALA 12 -2.806 6.379 11.908 1.00 0.00 ATOM 91 H ALA 12 -0.909 4.546 10.688 1.00 0.00 ATOM 92 N VAL 13 -0.373 6.145 14.171 1.00 0.00 ATOM 93 CA VAL 13 0.077 5.492 15.404 1.00 0.00 ATOM 94 C VAL 13 -0.369 6.365 16.550 1.00 0.00 ATOM 95 O VAL 13 -0.199 7.578 16.489 1.00 0.00 ATOM 96 CB VAL 13 1.617 5.340 15.440 1.00 0.00 ATOM 97 CG1 VAL 13 2.117 4.694 16.741 1.00 0.00 ATOM 98 CG2 VAL 13 2.144 4.569 14.234 1.00 0.00 ATOM 99 H VAL 13 -0.333 7.145 14.150 1.00 0.00 ATOM 100 N VAL 14 -0.974 5.699 17.533 1.00 0.00 ATOM 101 CA VAL 14 -1.406 6.335 18.764 1.00 0.00 ATOM 102 C VAL 14 -0.922 5.422 19.898 1.00 0.00 ATOM 103 O VAL 14 -0.594 4.266 19.618 1.00 0.00 ATOM 104 CB VAL 14 -2.947 6.506 18.748 1.00 0.00 ATOM 105 CG1 VAL 14 -3.462 7.255 19.972 1.00 0.00 ATOM 106 CG2 VAL 14 -3.443 7.211 17.475 1.00 0.00 ATOM 107 OXT VAL 14 -0.836 5.855 21.041 1.00 0.00 ATOM 108 H VAL 14 -1.002 4.700 17.585 1.00 0.00 END
Mouse prion dimer alpha carbon coordinates125-231 kindly provided by Dr. James Warwicker on 23 May 97. The disulphide bond is also included. The data is based on the Swiss NMR data plus a prediction that 109-122 fold horizontlly across an exposed apolar surface as an alpha helix. The dimer is displayed in fig. 2a of BBRC (1997) 232, 508-512. It may play an important role in the species barrier.
ATOM 1 CA LEU A 125 4.510 2.518 21.519 1.00 0.00 ATOM 2 CA GLY A 126 7.513 3.959 23.390 1.00 0.00 ATOM 3 CA GLY A 127 5.606 6.110 25.905 1.00 0.00 ATOM 4 CA TYR A 128 4.058 7.718 22.805 1.00 0.00 ATOM 5 CA MET A 129 1.168 6.671 20.539 1.00 0.00 ATOM 6 CA LEU A 130 4.247 5.970 18.389 1.00 0.00 ATOM 7 CA GLY A 131 1.763 7.169 15.746 1.00 0.00 ATOM 8 CA SER A 132 1.381 7.259 11.946 1.00 0.00 ATOM 9 CA ALA A 133 1.865 6.545 8.225 1.00 0.00 ATOM 10 CA MET A 134 2.886 8.456 5.079 1.00 0.00 ATOM 11 CA SER A 135 3.920 8.338 1.403 1.00 0.00 ATOM 12 CA ARG A 136 6.844 10.760 0.977 1.00 0.00 ATOM 13 CA PRO A 137 9.596 13.332 1.612 1.00 0.00 ATOM 14 CA MET A 138 12.023 13.952 -1.272 1.00 0.00 ATOM 15 CA ILE A 139 15.198 15.781 -0.195 1.00 0.00 ATOM 16 CA HIS A 140 18.515 16.126 -2.058 1.00 0.00 ATOM 17 CA PHE A 141 19.924 18.743 0.342 1.00 0.00 ATOM 18 CA GLY A 142 19.605 21.253 -2.520 1.00 0.00 ATOM 19 CA ASN A 143 21.512 19.102 -5.036 1.00 0.00 ATOM 20 CA ASP A 144 19.432 17.671 -7.902 1.00 0.00 ATOM 21 CA TRP A 145 21.581 14.514 -7.972 1.00 0.00 ATOM 22 CA GLU A 146 23.398 13.273 -4.849 1.00 0.00 ATOM 23 CA ASP A 147 19.586 13.150 -4.644 1.00 0.00 ATOM 24 CA ARG A 148 17.472 11.315 -7.243 1.00 0.00 ATOM 25 CA TYR A 149 20.203 9.276 -5.517 1.00 0.00 ATOM 26 CA TYR A 150 18.380 9.647 -2.181 1.00 0.00 ATOM 27 CA ARG A 151 15.840 7.871 -4.414 1.00 0.00 ATOM 28 CA GLU A 152 18.204 4.959 -5.138 1.00 0.00 ATOM 29 CA ASN A 153 19.566 4.188 -1.653 1.00 0.00 ATOM 30 CA MET A 154 15.816 3.647 -1.172 1.00 0.00 ATOM 31 CA TYR A 155 13.515 0.597 -1.227 1.00 0.00 ATOM 32 CA ARG A 156 15.495 0.550 2.040 1.00 0.00 ATOM 33 CA TYR A 157 13.498 3.538 3.334 1.00 0.00 ATOM 34 CA PRO A 158 10.882 2.542 5.934 1.00 0.00 ATOM 35 CA ASN A 159 7.487 4.253 6.303 1.00 0.00 ATOM 36 CA GLN A 160 6.768 4.866 10.005 1.00 0.00 ATOM 37 CA VAL A 161 5.958 7.397 12.749 1.00 0.00 ATOM 38 CA TYR A 162 6.391 8.791 16.279 1.00 0.00 ATOM 39 CA TYR A 163 5.262 11.370 18.861 1.00 0.00 ATOM 40 CA ARG A 164 2.956 13.310 21.208 1.00 0.00 ATOM 41 CA PRO A 165 -0.406 14.193 22.795 1.00 0.00 ATOM 42 CA VAL A 166 0.781 17.528 24.231 1.00 0.00 ATOM 43 CA ASP A 167 2.298 17.817 27.725 1.00 0.00 ATOM 44 CA GLN A 168 4.912 18.813 25.125 1.00 0.00 ATOM 45 CA TYR A 169 7.113 21.456 26.787 1.00 0.00 ATOM 46 CA SER A 170 9.869 23.889 27.826 1.00 0.00 ATOM 47 CA ASN A 171 8.141 24.307 24.445 1.00 0.00 ATOM 48 CA GLN A 172 11.340 23.723 22.440 1.00 0.00 ATOM 49 CA ASN A 173 12.670 20.144 22.301 1.00 0.00 ATOM 50 CA ASN A 174 9.133 18.768 21.862 1.00 0.00 ATOM 51 CA PHE A 175 12.178 17.937 19.710 1.00 0.00 ATOM 52 CA VAL A 176 14.642 16.381 17.241 1.00 0.00 ATOM 53 CA HIS A 177 14.208 14.142 20.305 1.00 0.00 ATOM 54 CA ASP A 178 13.457 10.428 20.791 1.00 0.00 ATOM 55 CA CYS A 179 11.342 10.901 17.645 1.00 0.00 ATOM 56 CB CYS A 179 10.610 12.228 17.442 1.00 0.00 ATOM 57 SG CYS A 179 9.011 12.062 16.631 1.00 0.00 ATOM 58 CA VAL A 180 14.158 10.784 15.067 1.00 0.00 ATOM 59 CA ASN A 181 16.065 7.918 16.724 1.00 0.00 ATOM 60 CA ILE A 182 12.658 6.376 17.508 1.00 0.00 ATOM 61 CA THR A 183 9.844 5.862 14.978 1.00 0.00 ATOM 62 CA ILE A 184 12.687 4.519 12.810 1.00 0.00 ATOM 63 CA LYS A 185 14.435 2.479 15.526 1.00 0.00 ATOM 64 CA GLN A 186 11.071 0.947 14.565 1.00 0.00 ATOM 65 CA HIS A 187 8.621 1.330 11.659 1.00 0.00 ATOM 66 CA THR A 188 11.681 -0.750 12.607 1.00 0.00 ATOM 67 CA VAL A 189 8.638 -2.620 13.962 1.00 0.00 ATOM 68 CA THR A 190 5.503 -2.956 11.806 1.00 0.00 ATOM 69 CA THR A 191 8.101 -3.581 9.076 1.00 0.00 ATOM 70 CA THR A 192 9.849 -6.292 11.122 1.00 0.00 ATOM 71 CA THR A 193 6.570 -8.251 11.112 1.00 0.00 ATOM 72 CA LYS A 194 5.344 -8.582 7.509 1.00 0.00 ATOM 73 CA GLY A 195 9.151 -8.326 7.706 1.00 0.00 ATOM 74 CA GLU A 196 11.397 -5.660 6.144 1.00 0.00 ATOM 75 CA ASN A 197 13.257 -2.557 7.371 1.00 0.00 ATOM 76 CA PHE A 198 16.536 -0.598 7.381 1.00 0.00 ATOM 77 CA THR A 199 18.762 1.803 5.414 1.00 0.00 ATOM 78 CA GLU A 200 20.391 5.217 5.948 1.00 0.00 ATOM 79 CA THR A 201 18.757 6.972 2.974 1.00 0.00 ATOM 80 CA ASP A 202 15.133 5.871 3.468 1.00 0.00 ATOM 81 CA VAL A 203 13.903 6.696 6.989 1.00 0.00 ATOM 82 CA LYS A 204 16.580 9.421 6.944 1.00 0.00 ATOM 83 CA MET A 205 14.588 10.686 3.941 1.00 0.00 ATOM 84 CA MET A 206 11.191 9.545 5.262 1.00 0.00 ATOM 85 CA GLU A 207 12.544 10.807 8.604 1.00 0.00 ATOM 86 CA ARG A 208 13.387 14.351 7.454 1.00 0.00 ATOM 87 CA VAL A 209 10.230 12.930 5.838 1.00 0.00 ATOM 88 CA VAL A 210 8.768 11.894 9.212 1.00 0.00 ATOM 89 CA GLU A 211 11.028 14.392 11.014 1.00 0.00 ATOM 90 CA GLN A 212 8.977 16.742 8.809 1.00 0.00 ATOM 91 CA MET A 213 6.657 14.222 10.498 1.00 0.00 ATOM 92 CA CYS A 214 9.219 13.687 13.280 1.00 0.00 ATOM 93 SG CYS A 214 8.842 12.105 14.598 1.00 0.00 ATOM 94 CB CYS A 214 8.525 13.782 14.026 1.00 0.00 ATOM 95 CA VAL A 215 10.584 17.137 14.193 1.00 0.00 ATOM 96 CA THR A 216 7.524 17.062 11.909 1.00 0.00 ATOM 97 CA GLN A 217 6.251 15.054 14.899 1.00 0.00 ATOM 98 CA TYR A 218 4.697 17.288 17.579 1.00 0.00 ATOM 99 CA GLN A 219 3.076 20.646 16.753 1.00 0.00 ATOM 100 CA LEU B 125 -6.382 10.652 -1.862 0.00 0.00 ATOM 101 CA GLY B 126 -6.901 14.232 -3.181 0.00 0.00 ATOM 102 CA GLY B 127 -3.842 14.409 -5.440 0.00 0.00 ATOM 103 CA TYR B 128 -1.920 13.557 -2.257 0.00 0.00 ATOM 104 CA MET B 129 -1.196 10.227 -0.472 0.00 0.00 ATOM 105 CA LEU B 130 -3.793 11.901 1.785 0.00 0.00 ATOM 106 CA GLY B 131 -1.587 10.141 4.367 0.00 0.00 ATOM 107 CA SER B 132 -1.620 9.211 8.074 0.00 0.00 ATOM 108 CA ALA B 133 -2.799 8.520 11.641 0.00 0.00 ATOM 109 CA MET B 134 -2.195 9.894 15.148 0.00 0.00 ATOM 110 CA SER B 135 -3.236 9.999 18.822 0.00 0.00 ATOM 111 CA ARG B 136 -3.141 13.680 19.919 0.00 0.00 ATOM 112 CA PRO B 137 -2.731 17.500 19.987 0.00 0.00 ATOM 113 CA MET B 138 -3.964 19.293 23.136 0.00 0.00 ATOM 114 CA ILE B 139 -4.353 23.096 22.678 0.00 0.00 ATOM 115 CA HIS B 140 -6.249 25.623 24.857 0.00 0.00 ATOM 116 CA PHE B 141 -4.838 28.708 23.084 0.00 0.00 ATOM 117 CA GLY B 142 -2.930 29.409 26.299 0.00 0.00 ATOM 118 CA ASN B 143 -5.989 29.232 28.559 0.00 0.00 ATOM 119 CA ASP B 144 -6.107 26.220 30.936 0.00 0.00 ATOM 120 CA TRP B 145 -9.885 26.085 30.645 0.00 0.00 ATOM 121 CA GLU B 146 -11.679 27.371 27.526 0.00 0.00 ATOM 122 CA ASP B 147 -9.456 24.282 26.968 0.00 0.00 ATOM 123 CA ARG B 148 -9.846 21.054 29.011 0.00 0.00 ATOM 124 CA TYR B 149 -12.941 22.358 27.204 0.00 0.00 ATOM 125 CA TYR B 150 -11.256 21.708 23.837 0.00 0.00 ATOM 126 CA ARG B 151 -11.311 18.239 25.494 0.00 0.00 ATOM 127 CA GLU B 152 -15.084 18.302 25.905 0.00 0.00 ATOM 128 CA ASN B 153 -16.204 19.563 22.473 0.00 0.00 ATOM 129 CA MET B 154 -14.321 16.329 21.577 0.00 0.00 ATOM 130 CA TYR B 155 -15.327 12.694 20.898 0.00 0.00 ATOM 131 CA ARG B 156 -16.271 14.834 17.861 0.00 0.00 ATOM 132 CA TYR B 157 -12.610 15.210 16.937 0.00 0.00 ATOM 133 CA PRO B 158 -11.582 12.996 13.984 0.00 0.00 ATOM 134 CA ASN B 159 -8.159 11.342 13.621 0.00 0.00 ATOM 135 CA GLN B 160 -6.919 11.783 10.035 0.00 0.00 ATOM 136 CA VAL B 161 -4.205 13.101 7.714 0.00 0.00 ATOM 137 CA TYR B 162 -3.063 14.891 4.534 0.00 0.00 ATOM 138 CA TYR B 163 -0.133 15.953 2.352 0.00 0.00 ATOM 139 CA ARG B 164 2.986 15.657 0.186 0.00 0.00 ATOM 140 CA PRO B 165 5.848 13.762 -1.512 0.00 0.00 ATOM 141 CA VAL B 166 7.871 16.917 -2.235 0.00 0.00 ATOM 142 CA ASP B 167 7.490 18.923 -5.477 0.00 0.00 ATOM 143 CA GLN B 168 6.463 21.135 -2.524 0.00 0.00 ATOM 144 CA TYR B 169 7.352 24.738 -3.499 0.00 0.00 ATOM 145 CA SER B 170 7.686 28.552 -3.852 0.00 0.00 ATOM 146 CA ASN B 171 8.759 26.810 -0.616 0.00 0.00 ATOM 147 CA GLN B 172 6.193 28.675 1.530 0.00 0.00 ATOM 148 CA ASN B 173 2.573 27.625 1.160 0.00 0.00 ATOM 149 CA ASN B 174 3.592 23.909 1.039 0.00 0.00 ATOM 150 CA PHE B 175 0.913 25.480 3.272 0.00 0.00 ATOM 151 CA VAL B 176 -2.012 26.105 5.639 0.00 0.00 ATOM 152 CA HIS B 177 -3.235 24.995 2.207 0.00 0.00 ATOM 153 CA ASP B 178 -5.649 22.310 1.017 0.00 0.00 ATOM 154 CA CYS B 179 -4.278 20.332 3.998 0.00 0.00 ATOM 155 CB CYS B 179 -2.814 20.485 4.364 0.00 0.00 ATOM 156 SG CYS B 179 -2.050 18.963 4.989 0.00 0.00 ATOM 157 CA VAL B 180 -6.297 22.061 6.753 0.00 0.00 ATOM 158 CA ASN B 181 -9.549 22.209 4.797 0.00 0.00 ATOM 159 CA ILE B 182 -8.631 18.718 3.460 0.00 0.00 ATOM 160 CA THR B 183 -7.558 15.714 5.603 0.00 0.00 ATOM 161 CA ILE B 184 -10.517 16.821 7.745 0.00 0.00 ATOM 162 CA LYS B 185 -12.932 17.512 4.881 0.00 0.00 ATOM 163 CA GLN B 186 -12.186 13.752 5.260 0.00 0.00 ATOM 164 CA HIS B 187 -10.663 11.496 7.961 0.00 0.00 ATOM 165 CA THR B 188 -14.057 12.901 6.938 0.00 0.00 ATOM 166 CA VAL B 189 -13.566 9.612 5.016 0.00 0.00 ATOM 167 CA THR B 190 -12.126 6.521 6.795 0.00 0.00 ATOM 168 CA THR B 191 -14.425 7.751 9.592 0.00 0.00 ATOM 169 CA THR B 192 -17.425 7.931 7.268 0.00 0.00 ATOM 170 CA THR B 193 -16.981 4.158 6.648 0.00 0.00 ATOM 171 CA LYS B 194 -16.817 2.342 10.015 0.00 0.00 ATOM 172 CA GLY B 195 -18.898 5.576 10.201 0.00 0.00 ATOM 173 CA GLU B 196 -18.302 8.654 12.395 0.00 0.00 ATOM 174 CA ASN B 197 -16.886 12.175 11.896 0.00 0.00 ATOM 175 CA PHE B 198 -17.329 15.948 12.516 0.00 0.00 ATOM 176 CA THR B 199 -16.965 18.784 15.059 0.00 0.00 ATOM 177 CA GLU B 200 -15.226 22.178 15.273 0.00 0.00 ATOM 178 CA THR B 201 -13.126 21.365 18.351 0.00 0.00 ATOM 179 CA ASP B 202 -11.757 17.907 17.355 0.00 0.00 ATOM 180 CA VAL B 203 -10.058 18.030 13.939 0.00 0.00 ATOM 181 CA LYS B 204 -9.543 21.759 14.693 0.00 0.00 ATOM 182 CA MET B 205 -7.613 20.367 17.682 0.00 0.00 ATOM 183 CA MET B 206 -6.340 17.215 15.889 0.00 0.00 ATOM 184 CA GLU B 207 -5.874 19.631 12.952 0.00 0.00 ATOM 185 CA ARG B 208 -3.707 22.172 14.770 0.00 0.00 ATOM 186 CA VAL B 209 -3.056 18.525 15.829 0.00 0.00 ATOM 187 CA VAL B 210 -2.689 17.350 12.212 0.00 0.00 ATOM 188 CA GLU B 211 -1.937 20.940 11.080 0.00 0.00 ATOM 189 CA GLN B 212 0.949 20.277 13.470 0.00 0.00 ATOM 190 CA MET B 213 0.524 17.248 11.171 0.00 0.00 ATOM 191 CA CYS B 214 -1.198 19.482 8.576 0.00 0.00 ATOM 192 SG CYS B 214 -2.094 18.491 6.975 0.00 0.00 ATOM 193 CB CYS B 214 -0.638 19.115 7.800 0.00 0.00 ATOM 194 CA VAL B 215 0.762 22.754 8.402 0.00 0.00 ATOM 195 CA THR B 216 2.350 19.852 10.359 0.00 0.00 ATOM 196 CA GLN B 217 1.808 18.192 6.965 0.00 0.00 ATOM 197 CA TYR B 218 4.733 18.729 4.590 0.00 0.00 ATOM 198 CA GLN B 219 8.271 19.245 5.842 0.00 0.00 END