REMARK 920 REMARK 920 This file was generated by MOLE 2 (https://mole.upol.cz, http://mole.chemi.muni.cz, version 2.5.17.4.24) REMARK 920 REMARK 920 Please cite the following references when reporting the results using MOLE: REMARK 920 REMARK 920 Sehnal D., Svobodova Varekova R., Berka K., Pravda L., Navratilova V., Banas P., Ionescu C.-M., Geidl S., Otyepka M., Koca J.: REMARK 920 MOLE 2.0: Advanced Approach for Analysis of Biomacromolecular Channels. Journal of Cheminformatics 2013, 5:39. doi:10.1186/1758-2946-5-39 REMARK 920 REMARK 920 and REMARK 920 REMARK 920 Berka, K; Hanak, O; Sehnal, D; Banas, P; Navratilova, V; Jaiswal, D; Ionescu, C-M; Svobodova Varekova, R; Koca, J; Otyepka M: REMARK 920 MOLEonline 2.0: Interactive Web-based Analysis of Biomacromolecular Channels.Nucleic Acid Research, 2012, doi:10.1093/nar/GKS363 REMARK 920 REMARK ATOM NAM RES TUNID X Y Z Distnm RadiusA HETATM 1 X TUN A 1 52.619 66.043 88.962 0.00 1.350 HETATM 2 X TUN A 2 51.844 66.401 88.654 0.91 1.400 HETATM 3 X TUN A 3 51.043 66.739 88.927 0.91 1.170 HETATM 4 X TUN A 4 50.159 66.934 88.943 0.91 1.150 HETATM 5 X TUN A 5 49.186 67.129 89.065 1.00 1.390 HETATM 6 X TUN A 6 48.288 67.405 89.194 0.95 1.820 HETATM 7 X TUN A 7 47.860 68.290 89.294 0.99 1.940 HETATM 8 X TUN A 8 47.383 68.374 88.694 0.77 1.810 HETATM 9 X TUN A 9 46.617 68.570 88.122 0.98 1.680 HETATM 10 X TUN A 10 45.734 68.640 87.911 0.91 1.690 HETATM 11 X TUN A 11 44.964 69.162 87.953 0.93 1.410 HETATM 12 X TUN A 12 44.364 69.957 88.042 1.00 1.140 HETATM 13 X TUN A 13 43.764 70.752 88.131 1.00 1.230 HETATM 14 X TUN A 14 43.253 71.280 87.623 0.89 1.390 HETATM 15 X TUN A 15 42.793 71.571 86.850 0.95 1.640 HETATM 16 X TUN A 16 41.886 71.503 86.541 0.96 1.570 HETATM 17 X TUN B 1 52.619 66.043 88.962 0.00 1.350 HETATM 18 X TUN B 2 52.446 65.453 88.285 0.91 1.500 HETATM 19 X TUN B 3 52.481 64.800 87.529 1.00 1.850 HETATM 20 X TUN B 4 52.464 64.333 86.815 0.85 2.270 HETATM 21 X TUN B 5 51.698 64.927 86.567 1.00 2.140 HETATM 22 X TUN B 6 50.777 65.153 86.347 0.97 1.940 HETATM 23 X TUN B 7 49.825 64.999 86.132 0.99 1.670 HETATM 24 X TUN B 8 48.994 64.562 85.986 0.95 1.440 HETATM 25 X TUN B 9 48.366 63.786 85.947 1.00 1.200 HETATM 26 X TUN B 10 47.649 63.148 86.217 1.00 1.130 HETATM 27 X TUN B 11 47.273 62.289 86.542 0.99 1.090 HETATM 28 X TUN B 12 46.858 61.463 86.658 0.93 1.180 HETATM 29 X TUN B 13 46.671 60.638 86.831 0.86 1.050 HETATM 30 X TUN B 14 46.057 59.850 86.861 1.00 1.180 HETATM 31 X TUN B 15 45.228 59.385 86.733 0.96 1.520 HETATM 32 X TUN B 16 44.462 59.063 86.953 0.86 1.710 HETATM 33 X TUN B 17 44.090 58.819 87.849 1.00 1.540 HETATM 34 X TUN B 18 43.562 58.676 88.647 0.97 1.620 HETATM 35 X TUN C 1 52.619 66.043 88.962 0.00 1.350 HETATM 36 X TUN C 2 52.446 65.453 88.285 0.91 1.500 HETATM 37 X TUN C 3 52.481 64.800 87.529 1.00 1.850 HETATM 38 X TUN C 4 52.686 64.195 86.823 0.95 2.320 HETATM 39 X TUN C 5 52.496 64.665 85.996 0.97 2.110 HETATM 40 X TUN C 6 52.348 64.833 85.132 0.89 1.840 HETATM 41 X TUN C 7 52.459 64.544 84.189 0.99 1.260 HETATM 42 X TUN C 8 52.441 64.202 83.380 0.88 0.970 HETATM 43 X TUN C 9 52.423 63.883 82.455 0.98 0.930 HETATM 44 X TUN C 10 51.677 63.884 81.788 1.00 0.720 HETATM 45 X TUN C 11 50.987 63.817 81.085 0.99 0.850 HETATM 46 X TUN C 12 50.475 63.817 80.231 1.00 1.100 HETATM 47 X TUN C 13 50.101 63.556 79.426 0.93 1.490 HETATM 48 X TUN C 14 50.390 63.877 78.611 0.92 1.500 HETATM 49 X TUN C 15 50.779 64.219 77.756 1.00 1.720 HETATM 50 X TUN C 16 50.918 64.256 76.794 0.97 1.930 HETATM 51 X TUN D 1 52.619 66.043 88.962 0.00 1.350 HETATM 52 X TUN D 2 52.446 65.453 88.285 0.91 1.500 HETATM 53 X TUN D 3 52.481 64.800 87.529 1.00 1.850 HETATM 54 X TUN D 4 52.464 64.333 86.815 0.85 2.270 HETATM 55 X TUN D 5 52.216 64.786 86.116 0.87 2.080 HETATM 56 X TUN D 6 51.600 65.324 85.706 0.91 2.070 HETATM 57 X TUN D 7 50.692 65.338 85.357 0.97 1.740 HETATM 58 X TUN D 8 49.736 65.090 85.199 1.00 1.460 HETATM 59 X TUN D 9 48.921 64.969 84.810 0.91 1.410 HETATM 60 X TUN D 10 48.445 65.254 84.313 0.74 1.150 HETATM 61 X TUN D 11 47.940 65.802 83.857 0.87 1.030 HETATM 62 X TUN D 12 47.371 66.352 83.280 0.98 1.210 HETATM 63 X TUN D 13 47.659 67.231 82.908 1.00 1.030 HETATM 64 X TUN D 14 47.904 68.146 82.588 1.00 1.200 HETATM 65 X TUN D 15 47.760 68.181 81.616 0.98 0.870 HETATM 66 X TUN D 16 47.917 68.223 80.632 1.00 0.730 HETATM 67 X TUN D 17 47.892 68.555 79.727 0.96 0.780 HETATM 68 X TUN D 18 47.705 69.104 78.913 1.00 1.040 HETATM 69 X TUN D 19 47.501 69.631 78.088 1.00 1.600 HETATM 70 X TUN D 20 47.593 70.004 77.268 0.91 1.960