mqaprna.py ver: f69479e-dirty start 2017-12-03 09:50:12 -------------------------- ---------------------------------------------------- Seq ss fn /home/mqapRNA/mqapRNAweb/media/jobs/70e1e318-b1a1-46a7-bcb7-f945758bf660/ss.txt Output csv /home/mqapRNA/mqapRNAweb/media/jobs/70e1e318-b1a1-46a7-bcb7-f945758bf660/70e1e31_raw.csv Input files #33 ['input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-000001_AA.pdb', 'input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-000001_AA.pdb', 'input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-000001_AA.pdb'] RNAkb 5pt Model path /home/magnus/Dropbox/WORK_/mqaprna-papier/SVMlin.rda Multiprocessing on Verbose off Ignore pdb fn off Methods ClashScore,AnalyzeGeometry,FARNA,SimRNA_0,RNAscore,eSCORE,RNAkb,SSAgreement,FARNA_hires,RASP,RNAkb_all rmsd biopython_all Native pdb off RASP all -------------------------- ---------------------------------------------------- AnalyzeGeometry on SSAgreement on pdb_id >seq ref_seq UGAAAGAAAUACAAAAACACAGUUCUGGUUGGUAGUCCAGACGCAUGAUUUCAUGUCAGUAACCUUCCCCUCCGGGAUGUCCCGUAUUUCUAAUUUUUUU ref_ss ....(((((((............(((((........))))).(((((....))))).........((((....)))).......)))))))......... to ignore 0 [] files to analyze: 33 ['input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-000001_AA.pdb', 'input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-000001_AA.pdb', 'input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-000001_AA.pdb', 'input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-000001_AA.pdb', 'input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-000001_AA.pdb'] -------------------------------------------------------------------------------- [-- ] 1 3.03 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-000001_AA.pdb {'AnalyzeGeometry': 23.0, 'eSCORE': 1.93736, 'FARNA': ['-39.853', '0.0', '-18.92', '-163.094', '-16.275', '-356.213', '23.497', '43.771', '-9.404', '-511.954', '0.0', '0.0', '24.536', '0.0'], 'ClashScore': 116.074237, 'length': 100, 'SimRNA_0': ['0', '-796.184152', '-364.249', '-90.721', '-1.576', '-430.358960', '-48.357', '-87.769', '-55.527', '-43.695', '-195.011', '', '-796.184152'], 'FARNA_hires': ['0.0', '-452.71', '-3.586', '0.0', '2.626', '13.495', '-439.84', '16.575', '-240.749', '2.46', '-136.6', '47.006', '-7.136', '279.364', '13.675'], 'RNAscore': 21.051, 'RASP': ['1.6922', '1028', '0.00164611', '9.99177', '3.0445', '-2.72608', '-8406.25', '63435', '-0.132517', '-8281.36', '41.5362', '-3.0068', '-19033.8', '143509', '-0.132632', '-18399.1', '73.9254', '-8.586', '-47448.7', '480735', '-0.0987004', '0', '0', '0'], 'RNAkb': ['3.15061e+04', '1.85860e+04', '9.67857e+03', '2.63022e+01', '0.00000e+00', '0.00000e+00', '-2.51349e-03', '0.00000e+00', '5.97970e+04', '2.09580e-09', '5.97970e+04'], 'RNAkb_all': ['3.15061e+04', '1.85860e+04', '9.67857e+03', '2.63022e+01', '0.00000e+00', '0.00000e+00', '-9.87002e-04', '0.00000e+00', '5.97970e+04', '2.09580e-09', '5.97970e+04'], 'SSAgreement': 'error'} [---- ] 2 6.06 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-000001_AA.pdb {'AnalyzeGeometry': 35.0, 'eSCORE': 2.09669, 'FARNA': ['-44.148', '-3.611', '-22.723', '-156.163', '-19.231', '-367.724', '44.166', '97.76', '-11.219', '-460.269', '0.0', '0.0', '22.624', '0.0'], 'ClashScore': 150.141643, 'length': 100, 'SimRNA_0': ['0', '-848.603400', '-384.575', '-95.381', '-1.433', '-462.595177', '-57.479', '-87.653', '-57.714', '-44.694', '-215.055', '', '-848.603400'], 'FARNA_hires': ['0.0', '-454.213', '-4.545', '0.0', '3.778', '14.863', '-400.571', '18.767', '-232.557', '1.242', '-146.001', '25.377', '0.0', '251.144', '14.29'], 'RNAscore': 21.1534, 'RASP': ['3.7135', '1168', '0.00317937', '11.0992', '3.50152', '-2.10928', '-8602.74', '72052', '-0.119396', '-8355.68', '45.3831', '-5.44388', '-18891.9', '162757', '-0.116074', '-18162.1', '89.5405', '-8.15097', '-46599.2', '538302', '-0.086567', '0', '0', '0'], 'RNAkb': ['1.93584e+04', '1.59207e+04', '9.89572e+03', '3.53958e+01', '0.00000e+00', '0.00000e+00', '-2.81315e-03', '0.00000e+00', '4.52102e+04', '1.80149e-09', '4.52102e+04'], 'RNAkb_all': ['1.93584e+04', '1.59207e+04', '9.89572e+03', '3.53958e+01', '0.00000e+00', '0.00000e+00', '-1.15317e-03', '0.00000e+00', '4.52102e+04', '1.80149e-09', '4.52102e+04'], 'SSAgreement': 'error'} [------- ] 3 9.09 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-000001_AA.pdb {'AnalyzeGeometry': 29.0, 'eSCORE': 1.86071, 'FARNA': ['-39.139', '-1.732', '-22.544', '-133.789', '-20.528', '-365.572', '35.318', '174.416', '-30.077', '-381.226', '0.0', '0.0', '22.42', '0.0'], 'ClashScore': 160.252366, 'length': 100, 'SimRNA_0': ['0', '-729.916766', '-297.316', '-65.729', '-1.409', '-431.191494', '-47.780', '-87.924', '-54.963', '-46.265', '-194.260', '', '-729.916766'], 'FARNA_hires': ['0.0', '-437.826', '-2.549', '0.0', '3.032', '14.068', '-367.308', '16.957', '-250.829', '0.734', '-150.649', '49.363', '-9.384', '245.563', '13.176'], 'RNAscore': 21.0334, 'RASP': ['3.5091', '1155', '0.00303818', '10.3448', '3.70368', '-1.84566', '-8413.26', '70360', '-0.119574', '-8262.32', '40.548', '-3.72243', '-18197.1', '160876', '-0.113113', '-17469.6', '89.8578', '-8.09618', '-44195.1', '539310', '-0.0819474', '0', '0', '0'], 'RNAkb': ['1.64082e+04', '1.90355e+04', '9.73679e+03', '3.77857e+01', '0.00000e+00', '0.00000e+00', '-2.53050e-03', '0.00000e+00', '4.52183e+04', '1.72618e-09', '4.52183e+04'], 'RNAkb_all': ['1.64082e+04', '1.90355e+04', '9.73679e+03', '3.77857e+01', '0.00000e+00', '0.00000e+00', '-1.07290e-03', '0.00000e+00', '4.52183e+04', '1.72618e-09', '4.52183e+04'], 'SSAgreement': 'error'} [--------- ] 4 12.12 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-000001_AA.pdb {'AnalyzeGeometry': 33.0, 'eSCORE': 2.09032, 'FARNA': ['-42.432', '-16.413', '-29.364', '-151.01', '-24.77', '-369.342', '80.849', '117.713', '-41.532', '-454.268', '0.0', '0.0', '22.032', '0.0'], 'ClashScore': 138.137193, 'length': 100, 'SimRNA_0': ['0', '-776.392200', '-366.341', '-86.961', '-1.021', '-409.030438', '-45.022', '-81.649', '-50.494', '-37.595', '-194.270', '', '-776.392200'], 'FARNA_hires': ['0.0', '-490.878', '-2.69', '0.0', '3.351', '14.609', '-447.891', '19.739', '-250.731', '0.827', '-152.355', '44.051', '-3.358', '268.432', '15.139'], 'RNAscore': 21.475, 'RASP': ['0.2802', '1194', '0.000234673', '9.4958', '4.04831', '-2.27641', '-7765.66', '74414', '-0.104358', '-7571.14', '58.0458', '-3.35123', '-17260.1', '169473', '-0.101846', '-16461.1', '102.36', '-7.80627', '-43132.5', '572198', '-0.0753804', '0', '0', '0'], 'RNAkb': ['2.59495e+04', '2.01697e+04', '9.91170e+03', '3.69293e+01', '0.00000e+00', '0.00000e+00', '-1.87484e-03', '0.00000e+00', '5.60678e+04', '1.97189e-09', '5.60678e+04'], 'RNAkb_all': ['2.59495e+04', '2.01697e+04', '9.91170e+03', '3.69293e+01', '0.00000e+00', '0.00000e+00', '-1.29562e-03', '0.00000e+00', '5.60678e+04', '1.97189e-09', '5.60678e+04'], 'SSAgreement': 'error'} [------------ ] 5 15.15 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-000001_AA.pdb {'AnalyzeGeometry': 32.0, 'eSCORE': 1.9201, 'FARNA': ['-39.11', '-1.321', '-24.608', '-147.719', '-21.743', '-365.988', '23.822', '118.683', '-27.169', '-458.891', '0.0', '0.0', '26.263', '0.0'], 'ClashScore': 174.44795, 'length': 100, 'SimRNA_0': ['0', '-739.212950', '-329.671', '-61.780', '0.694', '-410.236162', '-46.219', '-85.158', '-47.172', '-38.773', '-192.915', '', '-739.212950'], 'FARNA_hires': ['0.0', '-486.402', '-1.336', '0.0', '4.176', '12.641', '-412.113', '21.992', '-238.901', '2.787', '-149.531', '30.839', '-20.847', '249.137', '14.755'], 'RNAscore': 21.411, 'RASP': ['-5.5144', '1110', '-0.00496793', '11.1256', '4.10256', '-4.056', '-7319', '68896', '-0.106233', '-6975.97', '61.6065', '-5.568', '-16272.1', '156980', '-0.103657', '-15081.9', '108.355', '-10.9846', '-39101.6', '530837', '-0.0736604', '0', '0', '0'], 'RNAkb': ['2.41317e+04', '2.05773e+04', '9.79661e+03', '2.97280e+01', '0.00000e+00', '0.00000e+00', '-2.18682e-03', '0.00000e+00', '5.45353e+04', '1.92940e-09', '5.45353e+04'], 'RNAkb_all': ['2.41317e+04', '2.05773e+04', '9.79661e+03', '2.97280e+01', '0.00000e+00', '0.00000e+00', '-1.08453e-03', '0.00000e+00', '5.45353e+04', '1.92940e-09', '5.45353e+04'], 'SSAgreement': 'error'} [-------------- ] 6 18.18 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-000001_AA.pdb {'AnalyzeGeometry': 28.0, 'eSCORE': 1.95265, 'FARNA': ['-39.644', '-2.258', '-23.221', '-149.426', '-19.473', '-380.776', '39.548', '197.124', '-20.496', '-375.143', '0.0', '0.0', '23.478', '0.0'], 'ClashScore': 189.981096, 'length': 100, 'SimRNA_0': ['0', '-726.398366', '-316.346', '-91.307', '0.073', '-410.125033', '-46.628', '-85.588', '-50.461', '-34.518', '-192.930', '', '-726.398366'], 'FARNA_hires': ['0.0', '-408.691', '-3.021', '0.0', '3.215', '13.774', '-340.797', '14.244', '-243.152', '0.748', '-148.575', '49.324', '-7.35', '241.709', '11.189'], 'RNAscore': 20.6376, 'RASP': ['3.8814', '1121', '0.00346244', '10.223', '3.68608', '-1.72042', '-8105.39', '68724', '-0.117941', '-7840.33', '49.9315', '-5.30847', '-17722.7', '157303', '-0.112666', '-16928', '92.721', '-8.57056', '-45633.6', '518817', '-0.0879571', '0', '0', '0'], 'RNAkb': ['1.90211e+04', '1.78945e+04', '9.78319e+03', '3.49260e+01', '0.00000e+00', '0.00000e+00', '-2.18659e-03', '0.00000e+00', '4.67337e+04', '1.79871e-09', '4.67337e+04'], 'RNAkb_all': ['1.90211e+04', '1.78945e+04', '9.78319e+03', '3.49260e+01', '0.00000e+00', '0.00000e+00', '-1.04711e-03', '0.00000e+00', '4.67337e+04', '1.79871e-09', '4.67337e+04'], 'SSAgreement': 'error'} [---------------- ] 7 21.21 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-000001_AA.pdb {'AnalyzeGeometry': 28.0, 'eSCORE': 1.92592, 'FARNA': ['-40.661', '-0.642', '-21.103', '-134.008', '-18.27', '-380.554', '58.256', '123.151', '-14.33', '-403.859', '0.0', '0.0', '24.302', '0.0'], 'ClashScore': 160.528801, 'length': 100, 'SimRNA_0': ['0', '-722.054701', '-333.438', '-90.795', '-0.456', '-388.160350', '-21.537', '-82.051', '-46.800', '-35.187', '-202.585', '', '-722.054701'], 'FARNA_hires': ['0.0', '-465.761', '-3.442', '0.0', '2.808', '20.477', '-444.9', '15.81', '-240.797', '2.747', '-144.752', '38.101', '-6.889', '280.614', '14.462'], 'RNAscore': 21.1475, 'RASP': ['5.7438', '1178', '0.00487589', '12.3191', '4.05674', '-1.62084', '-7655.16', '71765', '-0.10667', '-7474.25', '46.3664', '-3.90175', '-16693.4', '164815', '-0.101286', '-15958.2', '110.281', '-6.66712', '-43157.1', '554403', '-0.0778443', '0', '0', '0'], 'RNAkb': ['1.73404e+04', '1.73407e+04', '9.77169e+03', '2.12609e+01', '0.00000e+00', '0.00000e+00', '-2.11056e-03', '0.00000e+00', '4.44740e+04', '1.71393e-09', '4.44740e+04'], 'RNAkb_all': ['1.73404e+04', '1.73407e+04', '9.77169e+03', '2.12609e+01', '0.00000e+00', '0.00000e+00', '-1.14107e-03', '0.00000e+00', '4.44740e+04', '1.71393e-09', '4.44740e+04'], 'SSAgreement': 'error'} [------------------- ] 8 24.24 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-000001_AA.pdb {'AnalyzeGeometry': 32.0, 'eSCORE': 1.97792, 'FARNA': ['-43.537', '-8.372', '-23.507', '-152.345', '-19.657', '-379.354', '43.339', '117.135', '-22.204', '-467.387', '0.0', '0.0', '21.114', '0.0'], 'ClashScore': 172.283465, 'length': 100, 'SimRNA_0': ['0', '-732.030449', '-332.713', '-76.938', '-3.692', '-395.624952', '-45.250', '-78.711', '-55.277', '-28.341', '-188.047', '', '-732.030449'], 'FARNA_hires': ['0.0', '-403.205', '-2.816', '0.0', '3.448', '15.482', '-388.697', '16.33', '-235.779', '2.392', '-141.921', '57.814', '-10.981', '269.624', '11.899'], 'RNAscore': 21.1272, 'RASP': ['4.5434', '1234', '0.00368185', '12.1002', '4.3389', '-1.74163', '-8011.26', '76260', '-0.105052', '-7742.5', '46.9673', '-5.72226', '-17586.5', '174551', '-0.100753', '-16554.4', '100.585', '-10.2613', '-44439.6', '574309', '-0.0773793', '0', '0', '0'], 'RNAkb': ['2.82970e+04', '1.93909e+04', '9.98595e+03', '3.79233e+01', '0.00000e+00', '0.00000e+00', '-1.35939e-03', '0.00000e+00', '5.77118e+04', '2.00758e-09', '5.77118e+04'], 'RNAkb_all': ['2.82970e+04', '1.93909e+04', '9.98595e+03', '3.79233e+01', '0.00000e+00', '0.00000e+00', '-1.16135e-03', '0.00000e+00', '5.77118e+04', '2.00758e-09', '5.77118e+04'], 'SSAgreement': 'error'} [--------------------- ] 9 27.27 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-000001_AA.pdb {'AnalyzeGeometry': 32.0, 'eSCORE': 1.95247, 'FARNA': ['-39.397', '-3.363', '-23.289', '-142.266', '-19.091', '-371.445', '78.117', '117.848', '-26.273', '-403.555', '0.0', '0.0', '25.604', '0.0'], 'ClashScore': 119.21988, 'length': 100, 'SimRNA_0': ['0', '-773.464488', '-368.907', '-110.731', '-0.869', '-403.689182', '-38.691', '-85.172', '-53.839', '-38.047', '-187.940', '', '-773.464488'], 'FARNA_hires': ['0.0', '-226.988', '-2.468', '0.0', '4.947', '10.713', '-60.758', '35.721', '-226.019', '3.7', '-184.241', '25.783', '-58.149', '208.536', '15.246'], 'RNAscore': 20.9799, 'RASP': ['4.6165', '1097', '0.0042083', '9.74188', '4.17534', '-1.22753', '-8184.99', '67422', '-0.121399', '-7913.9', '44.5691', '-6.08253', '-17884.8', '154391', '-0.115841', '-16976.1', '102.531', '-8.86298', '-45403.9', '522955', '-0.0868218', '0', '0', '0'], 'RNAkb': ['3.22948e+04', '2.02666e+04', '9.70151e+03', '2.19065e+01', '0.00000e+00', '0.00000e+00', '-2.16649e-03', '0.00000e+00', '6.22848e+04', '2.10709e-09', '6.22848e+04'], 'RNAkb_all': ['3.22948e+04', '2.02666e+04', '9.70151e+03', '2.19065e+01', '0.00000e+00', '0.00000e+00', '-1.21094e-03', '0.00000e+00', '6.22848e+04', '2.10709e-09', '6.22848e+04'], 'SSAgreement': 'error'} [------------------------ ] 10 30.3 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-000001_AA.pdb {'AnalyzeGeometry': 20.0, 'eSCORE': 1.86576, 'FARNA': ['-39.581', '-15.72', '-19.781', '-144.144', '-16.287', '-348.811', '69.504', '72.513', '-22.5', '-440.835', '0.0', '0.0', '23.971', '0.0'], 'ClashScore': 105.660377, 'length': 100, 'SimRNA_0': ['0', '-790.514851', '-366.325', '-117.930', '0.734', '-424.923134', '-51.680', '-80.335', '-55.876', '-41.701', '-195.332', '', '-790.514851'], 'FARNA_hires': ['0.0', '-501.327', '-2.171', '0.0', '3.195', '21.679', '-397.991', '22.162', '-244.425', '3.049', '-159.202', '22.942', '-21.26', '237.197', '13.498'], 'RNAscore': 21.3342, 'RASP': ['2.2537', '1164', '0.00193617', '10.9065', '3.88207', '-2.22891', '-7903.34', '71794', '-0.110084', '-7725.09', '48.3755', '-3.68481', '-17743', '162193', '-0.109395', '-17073.3', '92.6453', '-7.22881', '-42475', '535959', '-0.0792505', '0', '0', '0'], 'RNAkb': ['2.07028e+04', '1.80765e+04', '9.75534e+03', '3.16731e+01', '0.00000e+00', '0.00000e+00', '-7.66088e-04', '0.00000e+00', '4.85663e+04', '1.82302e-09', '4.85663e+04'], 'RNAkb_all': ['2.07028e+04', '1.80765e+04', '9.75534e+03', '3.16731e+01', '0.00000e+00', '0.00000e+00', '-1.03255e-03', '0.00000e+00', '4.85663e+04', '1.82302e-09', '4.85663e+04'], 'SSAgreement': 'error'} [-------------------------- ] 11 33.33 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-000001_AA.pdb {'AnalyzeGeometry': 27.0, 'eSCORE': 2.00179, 'FARNA': ['-42.107', '-3.149', '-27.491', '-156.305', '-23.721', '-372.914', '51.518', '121.362', '-24.802', '-451.557', '0.0', '0.0', '26.053', '0.0'], 'ClashScore': 151.448363, 'length': 100, 'SimRNA_0': ['0', '-790.198004', '-357.801', '-101.025', '-2.012', '-430.385254', '-42.333', '-84.305', '-58.038', '-40.839', '-204.870', '', '-790.198004'], 'FARNA_hires': ['0.0', '-453.806', '-3.877', '0.0', '3.231', '14.22', '-377.401', '17.585', '-243.981', '2.342', '-152.876', '33.942', '-2.653', '241.305', '14.355'], 'RNAscore': 21.0589, 'RASP': ['4.3589', '1161', '0.00375444', '9.85355', '4.3819', '-1.25394', '-7442.65', '70652', '-0.105342', '-7243.48', '44.9919', '-4.42683', '-16462.4', '161818', '-0.101734', '-15635.5', '104.345', '-7.9249', '-42939.7', '545767', '-0.0786777', '0', '0', '0'], 'RNAkb': ['3.62579e+04', '2.19784e+04', '9.92611e+03', '3.70905e+01', '0.00000e+00', '0.00000e+00', '-1.87271e-03', '0.00000e+00', '6.81995e+04', '2.19103e-09', '6.81995e+04'], 'RNAkb_all': ['3.62579e+04', '2.19784e+04', '9.92611e+03', '3.70905e+01', '0.00000e+00', '0.00000e+00', '-1.12089e-03', '0.00000e+00', '6.81995e+04', '2.19103e-09', '6.81995e+04'], 'SSAgreement': 'error'} [----------------------------- ] 12 36.36 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-000001_AA.pdb {'AnalyzeGeometry': 33.0, 'eSCORE': 1.9568, 'FARNA': ['-39.866', '-19.15', '-24.99', '-143.314', '-20.107', '-357.701', '68.544', '115.798', '-31.962', '-429.995', '0.0', '0.0', '22.754', '0.0'], 'ClashScore': 142.857143, 'length': 100, 'SimRNA_0': ['0', '-765.283502', '-374.961', '-119.749', '0.650', '-390.972485', '-41.745', '-81.210', '-48.832', '-31.365', '-187.821', '', '-765.283502'], 'FARNA_hires': ['0.0', '-474.266', '-3.928', '0.0', '3.305', '13.008', '-389.478', '19.226', '-244.909', '3.654', '-157.636', '41.589', '-23.671', '252.543', '12.031'], 'RNAscore': 21.991, 'RASP': ['6.7539', '1281', '0.00527237', '13.8372', '4.61423', '-1.5351', '-7788.76', '78405', '-0.0993401', '-7493.54', '51.5354', '-5.72851', '-16899.6', '178407', '-0.094725', '-15820.9', '103.371', '-10.4358', '-38584.6', '595521', '-0.0647913', '0', '0', '0'], 'RNAkb': ['1.64615e+04', '1.99026e+04', '9.98838e+03', '4.31407e+01', '0.00000e+00', '0.00000e+00', '2.12118e-04', '0.00000e+00', '4.63957e+04', '1.72307e-09', '4.63957e+04'], 'RNAkb_all': ['1.64615e+04', '1.99026e+04', '9.98838e+03', '4.31407e+01', '0.00000e+00', '0.00000e+00', '-8.53767e-04', '0.00000e+00', '4.63957e+04', '1.72307e-09', '4.63957e+04'], 'SSAgreement': 'error'} [------------------------------- ] 13 39.39 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-000001_AA.pdb {'AnalyzeGeometry': 29.0, 'eSCORE': 1.97885, 'FARNA': ['-38.193', '-4.441', '-24.25', '-148.085', '-22.097', '-336.37', '31.617', '77.786', '-17.007', '-456.553', '0.0', '0.0', '24.487', '0.0'], 'ClashScore': 140.207482, 'length': 100, 'SimRNA_0': ['0', '-750.311620', '-356.144', '-105.444', '-1.623', '-392.543980', '-46.402', '-81.974', '-56.106', '-37.913', '-170.149', '', '-750.311620'], 'FARNA_hires': ['0.0', '-491.105', '-2.586', '0.0', '3.524', '13.847', '-395.346', '18.249', '-244.918', '3.214', '-150.748', '23.97', '-4.792', '232.304', '12.178'], 'RNAscore': 20.9277, 'RASP': ['2.6375', '1060', '0.00248821', '10.8098', '3.9785', '-2.05412', '-7743.21', '65619', '-0.118003', '-7519', '52.86', '-4.24163', '-17675.5', '148231', '-0.119243', '-16873.3', '104.648', '-7.66569', '-44690.4', '492114', '-0.0908131', '0', '0', '0'], 'RNAkb': ['1.91814e+04', '2.11441e+04', '9.74256e+03', '3.99637e+01', '0.00000e+00', '0.00000e+00', '-2.61583e-03', '0.00000e+00', '5.01080e+04', '1.79048e-09', '5.01080e+04'], 'RNAkb_all': ['1.91814e+04', '2.11441e+04', '9.74256e+03', '3.99637e+01', '0.00000e+00', '0.00000e+00', '-8.09971e-04', '0.00000e+00', '5.01080e+04', '1.79048e-09', '5.01080e+04'], 'SSAgreement': 'error'} [--------------------------------- ] 14 42.42 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-000001_AA.pdb {'AnalyzeGeometry': 25.0, 'eSCORE': 1.90666, 'FARNA': ['-38.986', '-0.994', '-21.748', '-145.645', '-19.342', '-360.861', '34.871', '109.1', '-23.513', '-443.345', '0.0', '0.0', '23.773', '0.0'], 'ClashScore': 163.573451, 'length': 100, 'SimRNA_0': ['0', '-766.096432', '-359.629', '-104.452', '-2.121', '-404.346457', '-45.911', '-85.631', '-49.370', '-24.274', '-199.160', '', '-766.096432'], 'FARNA_hires': ['0.0', '-441.191', '-3.133', '0.0', '3.936', '11.694', '-385.706', '17.279', '-247.55', '3.004', '-143.926', '43.803', '-4.816', '251.492', '12.731'], 'RNAscore': 21.1586, 'RASP': ['2.7089', '1113', '0.00243387', '9.27859', '3.23627', '-2.03002', '-8056.7', '68184', '-0.118161', '-7730.6', '45.4548', '-7.1741', '-18023.9', '156609', '-0.115088', '-16988.6', '90.4302', '-11.4489', '-45574.4', '529298', '-0.0861036', '0', '0', '0'], 'RNAkb': ['1.67907e+04', '1.71789e+04', '9.71479e+03', '3.13861e+01', '0.00000e+00', '0.00000e+00', '-1.75789e-03', '0.00000e+00', '4.37158e+04', '1.73624e-09', '4.37158e+04'], 'RNAkb_all': ['1.67907e+04', '1.71789e+04', '9.71479e+03', '3.13861e+01', '0.00000e+00', '0.00000e+00', '-1.13571e-03', '0.00000e+00', '4.37158e+04', '1.73624e-09', '4.37158e+04'], 'SSAgreement': 'error'} [------------------------------------ ] 15 45.45 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-000001_AA.pdb {'AnalyzeGeometry': 32.0, 'eSCORE': 1.8696, 'FARNA': ['-40.902', '-8.813', '-14.59', '-135.476', '-12.511', '-350.571', '85.22', '141.289', '-23.314', '-336.97', '0.0', '0.0', '22.698', '0.0'], 'ClashScore': 169.502205, 'length': 100, 'SimRNA_0': ['0', '-703.745970', '-312.245', '-79.962', '-0.980', '-390.520712', '-41.293', '-79.315', '-56.922', '-35.301', '-177.690', '', '-703.745970'], 'FARNA_hires': ['0.0', '-340.468', '-2.084', '0.0', '3.153', '12.283', '-161.314', '31.707', '-230.636', '2.934', '-172.903', '22.324', '-40.454', '180.707', '13.815'], 'RNAscore': 21.746, 'RASP': ['1.8948', '1285', '0.00147455', '13.9902', '4.369', '-2.76846', '-7719.78', '78907', '-0.0978339', '-7466.53', '51.2144', '-4.94501', '-16692.4', '179253', '-0.0931222', '-15831.5', '92.3494', '-9.32267', '-40905.4', '601902', '-0.0679602', '0', '0', '0'], 'RNAkb': ['2.37290e+04', '2.07789e+04', '9.86733e+03', '3.59588e+01', '0.00000e+00', '0.00000e+00', '-1.06467e-03', '0.00000e+00', '5.44111e+04', '1.89957e-09', '5.44111e+04'], 'RNAkb_all': ['2.37290e+04', '2.07789e+04', '9.86733e+03', '3.59588e+01', '0.00000e+00', '0.00000e+00', '-1.16110e-03', '0.00000e+00', '5.44111e+04', '1.89957e-09', '5.44111e+04'], 'SSAgreement': 'error'} [-------------------------------------- ] 16 48.48 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-000001_AA.pdb {'AnalyzeGeometry': 23.0, 'eSCORE': 1.91829, 'FARNA': ['-40.623', '-0.939', '-27.474', '-144.136', '-21.957', '-356.231', '28.945', '89.396', '-17.404', '-466.297', '0.0', '0.0', '24.126', '0.0'], 'ClashScore': 114.087614, 'length': 100, 'SimRNA_0': ['0', '-784.793717', '-338.614', '-97.332', '0.153', '-446.332494', '-50.754', '-86.519', '-57.413', '-43.669', '-207.978', '', '-784.793717'], 'FARNA_hires': ['0.0', '-457.473', '-3.136', '0.0', '3.566', '14.051', '-402.204', '17.61', '-249.411', '3.926', '-145.325', '40.485', '0.0', '249.178', '13.787'], 'RNAscore': 20.6152, 'RASP': ['-0.8345', '1072', '-0.000778451', '8.98946', '3.328', '-2.95191', '-8840.38', '66713', '-0.132514', '-8541.36', '47.7622', '-6.26074', '-19987.9', '151026', '-0.132347', '-19063.8', '79.5192', '-11.6213', '-48201.4', '505535', '-0.0953473', '0', '0', '0'], 'RNAkb': ['2.08843e+04', '1.69563e+04', '9.75990e+03', '3.42171e+01', '0.00000e+00', '0.00000e+00', '-2.54806e-03', '0.00000e+00', '4.76347e+04', '1.84676e-09', '4.76347e+04'], 'RNAkb_all': ['2.08843e+04', '1.69563e+04', '9.75990e+03', '3.42171e+01', '0.00000e+00', '0.00000e+00', '-1.22029e-03', '0.00000e+00', '4.76347e+04', '1.84676e-09', '4.76347e+04'], 'SSAgreement': 'error'} [----------------------------------------- ] 17 51.52 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-000001_AA.pdb {'AnalyzeGeometry': 23.0, 'eSCORE': 1.91445, 'FARNA': ['-38.872', '-0.198', '-24.586', '-151.53', '-21.052', '-364.258', '59.755', '66.116', '-11.112', '-464.096', '0.0', '0.0', '21.641', '0.0'], 'ClashScore': 122.442556, 'length': 100, 'SimRNA_0': ['0', '-792.999451', '-355.016', '-88.709', '-0.442', '-437.541235', '-42.437', '-85.692', '-53.379', '-39.723', '-216.309', '', '-792.999451'], 'FARNA_hires': ['0.0', '-481.092', '-1.549', '0.0', '3.219', '14.789', '-418.978', '14.937', '-239.452', '3.301', '-148.706', '39.466', '-7.17', '247.262', '11.789'], 'RNAscore': 21.4454, 'RASP': ['6.5654', '1144', '0.00573899', '9.35716', '3.72311', '-0.749845', '-8282.09', '71112', '-0.116465', '-8108.18', '42.9906', '-4.04515', '-18052.9', '161866', '-0.11153', '-17369.4', '88.2142', '-7.74801', '-43906.6', '537864', '-0.0816315', '0', '0', '0'], 'RNAkb': ['1.54497e+04', '1.50718e+04', '9.57062e+03', '2.99472e+01', '0.00000e+00', '0.00000e+00', '-2.71945e-03', '0.00000e+00', '4.01220e+04', '1.69633e-09', '4.01220e+04'], 'RNAkb_all': ['1.54497e+04', '1.50718e+04', '9.57062e+03', '2.99472e+01', '0.00000e+00', '0.00000e+00', '-1.00410e-03', '0.00000e+00', '4.01220e+04', '1.69633e-09', '4.01220e+04'], 'SSAgreement': 'error'} [------------------------------------------- ] 18 54.55 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-000001_AA.pdb {'AnalyzeGeometry': 27.0, 'eSCORE': 1.95996, 'FARNA': ['-38.749', '-0.368', '-19.482', '-155.993', '-16.404', '-360.194', '31.239', '122.829', '-16.078', '-425.766', '0.0', '0.0', '27.435', '0.0'], 'ClashScore': 152.249135, 'length': 100, 'SimRNA_0': ['0', '-763.621658', '-356.505', '-92.262', '-0.985', '-406.132188', '-25.400', '-83.551', '-51.035', '-39.679', '-206.466', '', '-763.621658'], 'FARNA_hires': ['0.0', '-489.753', '-2.536', '0.0', '3.434', '12.104', '-439.557', '17.821', '-248.546', '2.241', '-148.041', '48.496', '-13.593', '266.782', '11.642'], 'RNAscore': 20.7491, 'RASP': ['2.4231', '992', '0.00244264', '9.42211', '3.69437', '-1.89451', '-8308.16', '60515', '-0.137291', '-8005.25', '41.3165', '-7.33147', '-18323.8', '138109', '-0.132676', '-17372.8', '88.0469', '-10.8016', '-45132.4', '464747', '-0.0971117', '0', '0', '0'], 'RNAkb': ['3.39100e+04', '1.81448e+04', '9.87068e+03', '3.60968e+01', '0.00000e+00', '0.00000e+00', '-2.24768e-03', '0.00000e+00', '6.19616e+04', '2.12693e-09', '6.19616e+04'], 'RNAkb_all': ['3.39100e+04', '1.81448e+04', '9.87068e+03', '3.60968e+01', '0.00000e+00', '0.00000e+00', '-1.03104e-03', '0.00000e+00', '6.19616e+04', '2.12693e-09', '6.19616e+04'], 'SSAgreement': 'error'} [---------------------------------------------- ] 19 57.58 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-000001_AA.pdb {'AnalyzeGeometry': 31.0, 'eSCORE': 1.96187, 'FARNA': ['-38.106', '-7.015', '-19.185', '-145.79', '-17.193', '-365.904', '38.881', '114.784', '-25.943', '-440.69', '0.0', '0.0', '24.779', '0.0'], 'ClashScore': 155.373464, 'length': 100, 'SimRNA_0': ['0', '-739.558872', '-308.475', '-96.756', '0.876', '-431.960173', '-46.075', '-85.178', '-54.598', '-39.660', '-206.450', '', '-739.558872'], 'FARNA_hires': ['0.0', '-319.683', '-0.529', '0.0', '3.56', '13.702', '-124.906', '41.588', '-215.101', '7.119', '-168.828', '28.738', '-132.139', '210.376', '16.737'], 'RNAscore': 20.988, 'RASP': ['0.0699', '1044', '6.6954e-05', '9.8202', '3.78992', '-2.57269', '-8193.04', '63526', '-0.128971', '-7976.18', '41.6616', '-5.2053', '-18004.9', '146743', '-0.122697', '-17367.4', '92.9665', '-6.85686', '-45882.4', '497194', '-0.0922827', '0', '0', '0'], 'RNAkb': ['2.97199e+04', '1.86247e+04', '1.00110e+04', '3.64301e+01', '0.00000e+00', '0.00000e+00', '-2.16241e-03', '0.00000e+00', '5.83921e+04', '2.02782e-09', '5.83921e+04'], 'RNAkb_all': ['2.97199e+04', '1.86247e+04', '1.00110e+04', '3.64301e+01', '0.00000e+00', '0.00000e+00', '-1.23485e-03', '0.00000e+00', '5.83921e+04', '2.02782e-09', '5.83921e+04'], 'SSAgreement': 'error'} [------------------------------------------------ ] 20 60.61 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-000001_AA.pdb {'AnalyzeGeometry': 27.0, 'eSCORE': 1.94256, 'FARNA': ['-45.265', '-10.969', '-24.884', '-147.728', '-22.591', '-382.43', '35.014', '98.277', '-19.748', '-494.886', '0.0', '0.0', '25.438', '0.0'], 'ClashScore': 185.651353, 'length': 100, 'SimRNA_0': ['0', '-722.788691', '-325.976', '-41.107', '0.382', '-397.194807', '-51.778', '-80.857', '-55.585', '-44.320', '-164.655', '', '-722.788691'], 'FARNA_hires': ['0.0', '-505.942', '-1.844', '0.0', '3.633', '16.237', '-426.935', '12.784', '-237.907', '5.722', '-146.059', '24.794', '-2.833', '226.61', '19.855'], 'RNAscore': 21.414, 'RASP': ['-2.3716', '1143', '-0.00207489', '9.29186', '4.56443', '-2.55529', '-7812.02', '69493', '-0.112414', '-7526.76', '54.1397', '-5.2689', '-17225', '158723', '-0.108523', '-16296.3', '100.093', '-9.27866', '-40956.5', '534090', '-0.0766846', '0', '0', '0'], 'RNAkb': ['2.32447e+04', '1.72118e+04', '9.82257e+03', '2.91771e+01', '0.00000e+00', '0.00000e+00', '-2.13235e-03', '0.00000e+00', '5.03083e+04', '1.85082e-09', '5.03083e+04'], 'RNAkb_all': ['2.32447e+04', '1.72118e+04', '9.82257e+03', '2.91771e+01', '0.00000e+00', '0.00000e+00', '-9.91645e-04', '0.00000e+00', '5.03083e+04', '1.85082e-09', '5.03083e+04'], 'SSAgreement': 'error'} [-------------------------------------------------- ] 21 63.64 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-000001_AA.pdb {'AnalyzeGeometry': 31.0, 'eSCORE': 1.97245, 'FARNA': ['-42.101', '-16.29', '-27.333', '-156.409', '-22.691', '-390.027', '38.093', '179.728', '-22.205', '-436.757', '0.0', '0.0', '22.478', '0.0'], 'ClashScore': 133.585381, 'length': 100, 'SimRNA_0': ['0', '-731.479678', '-346.037', '-84.061', '-1.867', '-383.575964', '-30.178', '-79.865', '-53.762', '-32.806', '-186.965', '', '-731.479678'], 'FARNA_hires': ['0.0', '-441.167', '-0.36', '0.0', '5.686', '26.461', '-319.208', '19.426', '-231.312', '0.923', '-163.902', '21.871', '-17.618', '201.292', '15.573'], 'RNAscore': 21.2325, 'RASP': ['-0.3552', '1180', '-0.000301017', '10.4529', '3.99089', '-2.7082', '-8490.64', '72597', '-0.116956', '-8129.94', '46.9618', '-7.68077', '-19009.8', '164860', '-0.115309', '-17801.1', '107.143', '-11.2807', '-43247.3', '546072', '-0.079197', '0', '0', '0'], 'RNAkb': ['2.56014e+04', '2.12697e+04', '1.00004e+04', '4.51499e+01', '0.00000e+00', '0.00000e+00', '-1.09908e-03', '0.00000e+00', '5.69166e+04', '1.94589e-09', '5.69166e+04'], 'RNAkb_all': ['2.56014e+04', '2.12697e+04', '1.00004e+04', '4.51499e+01', '0.00000e+00', '0.00000e+00', '-8.86861e-04', '0.00000e+00', '5.69166e+04', '1.94589e-09', '5.69166e+04'], 'SSAgreement': 'error'} [----------------------------------------------------- ] 22 66.67 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-000001_AA.pdb {'AnalyzeGeometry': 26.0, 'eSCORE': 1.84542, 'FARNA': ['-40.736', '-15.048', '-32.067', '-145.865', '-26.424', '-352.234', '48.153', '71.562', '-14.812', '-481.818', '0.0', '0.0', '25.653', '0.0'], 'ClashScore': 119.10748, 'length': 100, 'SimRNA_0': ['0', '-728.402817', '-335.256', '-77.675', '-0.524', '-392.623454', '-16.007', '-86.048', '-48.551', '-43.258', '-198.760', '', '-728.402817'], 'FARNA_hires': ['0.0', '-332.412', '-1.151', '0.0', '3.52', '13.05', '-175.495', '34.133', '-218.008', '11.564', '-173.892', '25.852', '-77.271', '207.91', '17.376'], 'RNAscore': 21.2328, 'RASP': ['0.6669', '1086', '0.000614088', '9.42468', '4.0538', '-2.16039', '-8046.04', '65925', '-0.122048', '-7768.74', '47.4094', '-5.84902', '-17926', '151330', '-0.118457', '-16979.5', '91.2453', '-10.3731', '-42746.7', '505198', '-0.0846138', '0', '0', '0'], 'RNAkb': ['2.39873e+04', '2.06463e+04', '9.71720e+03', '3.49526e+01', '0.00000e+00', '0.00000e+00', '-1.56105e-03', '0.00000e+00', '5.43857e+04', '1.88666e-09', '5.43857e+04'], 'RNAkb_all': ['2.39873e+04', '2.06463e+04', '9.71720e+03', '3.49526e+01', '0.00000e+00', '0.00000e+00', '-1.00069e-03', '0.00000e+00', '5.43857e+04', '1.88666e-09', '5.43857e+04'], 'SSAgreement': 'error'} [------------------------------------------------------- ] 23 69.7 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-000001_AA.pdb {'AnalyzeGeometry': 32.0, 'eSCORE': 1.93931, 'FARNA': ['-40.106', '-0.271', '-23.509', '-144.656', '-20.216', '-355.033', '25.995', '97.912', '-14.222', '-449.186', '0.0', '0.0', '24.921', '0.0'], 'ClashScore': 158.640227, 'length': 100, 'SimRNA_0': ['0', '-768.634645', '-334.083', '-89.746', '-0.214', '-434.337894', '-53.561', '-82.136', '-60.093', '-32.010', '-206.538', '', '-768.634645'], 'FARNA_hires': ['0.0', '-306.939', '-2.038', '0.0', '3.044', '14.283', '-147.423', '28.757', '-215.77', '7.329', '-161.589', '27.213', '-72.445', '198.346', '13.354'], 'RNAscore': 20.9951, 'RASP': ['1.2806', '1106', '0.00115787', '7.92421', '3.63664', '-1.82685', '-8659.4', '67410', '-0.128459', '-8383.34', '43.7335', '-6.31212', '-18594.7', '155217', '-0.119798', '-17760.6', '85.9538', '-9.70415', '-46546', '516869', '-0.0900537', '0', '0', '0'], 'RNAkb': ['1.92595e+04', '1.74701e+04', '9.81417e+03', '2.90859e+01', '0.00000e+00', '0.00000e+00', '-2.20847e-03', '0.00000e+00', '4.65729e+04', '1.80076e-09', '4.65729e+04'], 'RNAkb_all': ['1.92595e+04', '1.74701e+04', '9.81417e+03', '2.90859e+01', '0.00000e+00', '0.00000e+00', '-1.10851e-03', '0.00000e+00', '4.65729e+04', '1.80076e-09', '4.65729e+04'], 'SSAgreement': 'error'} [---------------------------------------------------------- ] 24 72.73 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-000001_AA.pdb {'AnalyzeGeometry': 26.0, 'eSCORE': 1.87784, 'FARNA': ['-40.895', '-12.596', '-22.112', '-145.158', '-18.339', '-353.012', '51.922', '188.787', '-37.21', '-363.646', '0.0', '0.0', '24.968', '0.0'], 'ClashScore': 141.280353, 'length': 100, 'SimRNA_0': ['0', '-775.482990', '-348.926', '-92.730', '-0.714', '-425.842899', '-50.743', '-85.589', '-51.592', '-41.766', '-196.153', '', '-775.482990'], 'FARNA_hires': ['0.0', '-431.763', '-2.418', '0.0', '3.693', '11.215', '-311.371', '23.825', '-229.191', '3.038', '-159.196', '26.425', '-24.956', '215.587', '11.588'], 'RNAscore': 21.3848, 'RASP': ['2.7965', '1158', '0.00241494', '7.95054', '3.5585', '-1.44838', '-8073.65', '70415', '-0.114658', '-7983.12', '49.5536', '-1.82689', '-17117.6', '161018', '-0.106308', '-16453.9', '98.3347', '-6.74895', '-41431.6', '530078', '-0.0781613', '0', '0', '0'], 'RNAkb': ['1.99797e+04', '2.06672e+04', '9.75154e+03', '3.58193e+01', '0.00000e+00', '0.00000e+00', '-1.06647e-04', '0.00000e+00', '5.04343e+04', '1.83301e-09', '5.04343e+04'], 'RNAkb_all': ['1.99797e+04', '2.06672e+04', '9.75154e+03', '3.58193e+01', '0.00000e+00', '0.00000e+00', '-7.55880e-04', '0.00000e+00', '5.04343e+04', '1.83301e-09', '5.04343e+04'], 'SSAgreement': 'error'} [------------------------------------------------------------ ] 25 75.76 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-000001_AA.pdb {'AnalyzeGeometry': 26.0, 'eSCORE': 1.83186, 'FARNA': ['-40.414', '-15.289', '-24.77', '-143.126', '-21.29', '-346.019', '35.43', '122.784', '-42.624', '-450.095', '0.0', '0.0', '25.223', '0.0'], 'ClashScore': 162.213141, 'length': 100, 'SimRNA_0': ['0', '-715.897912', '-285.167', '-77.179', '-0.494', '-430.236996', '-50.048', '-83.246', '-50.364', '-32.481', '-214.099', '', '-715.897912'], 'FARNA_hires': ['0.0', '-417.033', '-4.121', '0.0', '3.348', '12.568', '-359.542', '18.714', '-254.461', '2.984', '-151.017', '49.343', '-10.711', '262.508', '13.354'], 'RNAscore': 21.0824, 'RASP': ['0.8184', '1082', '0.000756377', '10.0132', '3.62694', '-2.53513', '-9034.84', '65313', '-0.138331', '-8637.59', '41.7121', '-9.52356', '-19785.7', '149481', '-0.132363', '-18645.1', '96.9549', '-11.7651', '-49470.7', '508718', '-0.0972458', '0', '0', '0'], 'RNAkb': ['1.65497e+04', '1.62560e+04', '9.68718e+03', '2.70414e+01', '0.00000e+00', '0.00000e+00', '-1.14214e-03', '0.00000e+00', '4.25199e+04', '1.74268e-09', '4.25199e+04'], 'RNAkb_all': ['1.65497e+04', '1.62560e+04', '9.68718e+03', '2.70414e+01', '0.00000e+00', '0.00000e+00', '-9.45320e-04', '0.00000e+00', '4.25199e+04', '1.74268e-09', '4.25199e+04'], 'SSAgreement': 'error'} [--------------------------------------------------------------- ] 26 78.79 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-000001_AA.pdb {'AnalyzeGeometry': 19.0, 'eSCORE': 1.92376, 'FARNA': ['-36.341', '-10.304', '-26.413', '-138.695', '-22.836', '-328.932', '50.879', '75.978', '-28.936', '-441.568', '0.0', '0.0', '24.031', '0.0'], 'ClashScore': 132.075472, 'length': 100, 'SimRNA_0': ['0', '-703.330477', '-315.438', '-86.932', '-1.398', '-386.495366', '2.170', '-84.897', '-54.938', '-40.077', '-208.754', '', '-703.330477'], 'FARNA_hires': ['0.0', '-470.782', '-1.973', '0.0', '3.391', '12.444', '-420.954', '17.55', '-248.008', '2.401', '-141.679', '42.307', '-11.172', '265.675', '9.238'], 'RNAscore': 21.1758, 'RASP': ['2.2243', '1096', '0.00202947', '10.5289', '3.84727', '-2.15857', '-8473.93', '67339', '-0.12584', '-8259.97', '50.8028', '-4.21164', '-18780.8', '153205', '-0.122586', '-18151.8', '104.112', '-6.04209', '-46244.3', '514855', '-0.08982', '0', '0', '0'], 'RNAkb': ['2.70157e+04', '1.76909e+04', '9.50479e+03', '2.22846e+01', '0.00000e+00', '0.00000e+00', '-1.95097e-03', '0.00000e+00', '5.42337e+04', '1.87690e-09', '5.42337e+04'], 'RNAkb_all': ['2.70157e+04', '1.76909e+04', '9.50479e+03', '2.22846e+01', '0.00000e+00', '0.00000e+00', '-1.02949e-03', '0.00000e+00', '5.42337e+04', '1.87690e-09', '5.42337e+04'], 'SSAgreement': 'error'} [----------------------------------------------------------------- ] 27 81.82 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-000001_AA.pdb {'AnalyzeGeometry': 29.0, 'eSCORE': 1.95668, 'FARNA': ['-41.078', '-3.341', '-25.043', '-144.203', '-22.952', '-372.403', '42.508', '114.375', '-27.297', '-457.272', '0.0', '0.0', '22.163', '0.0'], 'ClashScore': 144.479495, 'length': 100, 'SimRNA_0': ['0', '-749.131356', '-338.682', '-101.454', '-0.928', '-409.521087', '-29.480', '-82.284', '-52.279', '-43.454', '-202.024', '', '-749.131356'], 'FARNA_hires': ['0.0', '-297.02', '-1.149', '0.0', '4.456', '20.023', '-131.187', '29.567', '-224.335', '3.701', '-174.253', '37.43', '-77.007', '198.855', '16.878'], 'RNAscore': 21.3176, 'RASP': ['1.0536', '1270', '0.000829606', '10.2873', '3.6559', '-2.52571', '-8019.56', '78600', '-0.10203', '-7705.66', '55.702', '-5.63525', '-17158.3', '179909', '-0.0953723', '-16477.6', '92.9777', '-7.32194', '-44282.7', '591797', '-0.0748276', '0', '0', '0'], 'RNAkb': ['2.46223e+04', '1.70082e+04', '9.70330e+03', '3.56378e+01', '0.00000e+00', '0.00000e+00', '-2.29153e-03', '0.00000e+00', '5.13694e+04', '1.90483e-09', '5.13694e+04'], 'RNAkb_all': ['2.46223e+04', '1.70082e+04', '9.70330e+03', '3.56378e+01', '0.00000e+00', '0.00000e+00', '-1.19030e-03', '0.00000e+00', '5.13694e+04', '1.90483e-09', '5.13694e+04'], 'SSAgreement': 'error'} [------------------------------------------------------------------- ] 28 84.85 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-000001_AA.pdb {'AnalyzeGeometry': 25.0, 'eSCORE': 1.91107, 'FARNA': ['-42.227', '-1.778', '-24.431', '-157.114', '-20.933', '-379.987', '64.076', '109.552', '-23.44', '-452.901', '0.0', '0.0', '23.38', '0.0'], 'ClashScore': 170.540201, 'length': 100, 'SimRNA_0': ['0', '-694.630607', '-294.670', '-56.450', '0.684', '-400.644826', '-30.411', '-84.812', '-52.009', '-45.695', '-187.718', '', '-694.630607'], 'FARNA_hires': ['0.0', '-485.665', '-5.502', '0.0', '3.019', '14.414', '-438.378', '17.999', '-249.472', '2.841', '-148.796', '49.202', '-13.027', '265.935', '16.098'], 'RNAscore': 21.0893, 'RASP': ['10.14', '1154', '0.00878683', '9.12785', '3.68917', '0.274358', '-7766.55', '70957', '-0.109454', '-7678.54', '46.1977', '-1.90492', '-16892.7', '162237', '-0.104124', '-16310', '102.16', '-5.70407', '-41481.2', '540336', '-0.0767693', '0', '0', '0'], 'RNAkb': ['2.61379e+04', '1.70836e+04', '9.78716e+03', '4.31432e+01', '0.00000e+00', '0.00000e+00', '-2.49828e-03', '0.00000e+00', '5.30518e+04', '1.92607e-09', '5.30518e+04'], 'RNAkb_all': ['2.61379e+04', '1.70836e+04', '9.78716e+03', '4.31432e+01', '0.00000e+00', '0.00000e+00', '-9.00223e-04', '0.00000e+00', '5.30518e+04', '1.92607e-09', '5.30518e+04'], 'SSAgreement': 'error'} [---------------------------------------------------------------------- ] 29 87.88 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-000001_AA.pdb {'AnalyzeGeometry': 30.0, 'eSCORE': 1.94362, 'FARNA': ['-41.062', '-6.703', '-23.238', '-138.517', '-20.521', '-357.267', '58.542', '95.819', '-24.904', '-437.133', '0.0', '0.0', '20.718', '0.0'], 'ClashScore': 138.224181, 'length': 100, 'SimRNA_0': ['0', '-753.913817', '-336.337', '-109.503', '-1.342', '-416.234308', '-39.377', '-85.858', '-59.100', '-47.287', '-184.611', '', '-753.913817'], 'FARNA_hires': ['0.0', '-511.845', '-1.432', '0.0', '3.288', '14.567', '-382.808', '17.081', '-240.706', '2.824', '-154.067', '22.756', '-27.711', '221.257', '13.107'], 'RNAscore': 21.4921, 'RASP': ['-0.5995', '1291', '-0.000464369', '11.1574', '4.34111', '-2.70827', '-8049.8', '80533', '-0.0999565', '-7888.2', '51.098', '-3.16257', '-17983.9', '182701', '-0.0984336', '-17268.4', '98.6231', '-7.25496', '-43953.3', '596922', '-0.0736332', '0', '0', '0'], 'RNAkb': ['1.60677e+04', '1.72182e+04', '9.82224e+03', '2.80593e+01', '0.00000e+00', '0.00000e+00', '-1.94599e-03', '0.00000e+00', '4.31362e+04', '1.70874e-09', '4.31362e+04'], 'RNAkb_all': ['1.60677e+04', '1.72182e+04', '9.82224e+03', '2.80593e+01', '0.00000e+00', '0.00000e+00', '-1.17750e-03', '0.00000e+00', '4.31362e+04', '1.70874e-09', '4.31362e+04'], 'SSAgreement': 'error'} [------------------------------------------------------------------------ ] 30 90.91 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-000001_AA.pdb {'AnalyzeGeometry': 27.0, 'eSCORE': 1.87413, 'FARNA': ['-40.355', '-9.641', '-28.251', '-149.107', '-22.524', '-364.767', '29.647', '120.386', '-40.063', '-477.914', '0.0', '0.0', '26.761', '0.0'], 'ClashScore': 173.803526, 'length': 100, 'SimRNA_0': ['0', '-717.627636', '-293.947', '-36.330', '-3.008', '-420.672657', '-43.927', '-82.288', '-50.987', '-41.882', '-201.588', '', '-717.627636'], 'FARNA_hires': ['0.0', '-455.237', '-1.985', '0.0', '3.17', '12.908', '-403.509', '16.11', '-249.553', '2.972', '-148.308', '48.808', '-13.517', '265.612', '12.055'], 'RNAscore': 21.1474, 'RASP': ['2.8997', '1137', '0.00255031', '9.53492', '3.60741', '-1.83933', '-8236.76', '70574', '-0.116711', '-7990.81', '48.1421', '-5.10887', '-17687.9', '160476', '-0.110221', '-17040.8', '87.8007', '-7.36962', '-44006.7', '536012', '-0.0821002', '0', '0', '0'], 'RNAkb': ['3.34439e+04', '1.67555e+04', '9.72202e+03', '2.09047e+01', '0.00000e+00', '0.00000e+00', '-2.33468e-03', '0.00000e+00', '5.99423e+04', '2.11862e-09', '5.99423e+04'], 'RNAkb_all': ['3.34439e+04', '1.67555e+04', '9.72202e+03', '2.09047e+01', '0.00000e+00', '0.00000e+00', '-1.10773e-03', '0.00000e+00', '5.99423e+04', '2.11862e-09', '5.99423e+04'], 'SSAgreement': 'error'} [--------------------------------------------------------------------------- ] 31 93.94 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-000001_AA.pdb {'AnalyzeGeometry': 29.0, 'eSCORE': 1.84343, 'FARNA': ['-39.534', '-4.37', '-15.687', '-143.453', '-15.048', '-362.547', '21.206', '70.655', '-18.974', '-481.369', '0.0', '0.0', '26.383', '0.0'], 'ClashScore': 132.051686, 'length': 100, 'SimRNA_0': ['0', '-785.940157', '-351.776', '-110.145', '-1.295', '-432.869223', '-50.597', '-81.545', '-57.733', '-33.826', '-209.168', '', '-785.940157'], 'FARNA_hires': ['0.0', '-462.068', '-2.34', '0.0', '3.591', '13.041', '-375.229', '14.841', '-242.949', '0.42', '-151.171', '31.661', '0.0', '230.607', '15.459'], 'RNAscore': 20.8732, 'RASP': ['2.8736', '1057', '0.00271864', '8.85577', '3.20424', '-1.86695', '-7819.55', '65116', '-0.120087', '-7680.92', '43.9968', '-3.15095', '-17639.6', '147397', '-0.119674', '-17144.3', '82.2647', '-6.02116', '-45618', '487653', '-0.093546', '0', '0', '0'], 'RNAkb': ['3.32170e+04', '2.05750e+04', '9.88815e+03', '2.13836e+01', '0.00000e+00', '0.00000e+00', '-2.31870e-03', '0.00000e+00', '6.37015e+04', '2.14723e-09', '6.37015e+04'], 'RNAkb_all': ['3.32170e+04', '2.05750e+04', '9.88815e+03', '2.13836e+01', '0.00000e+00', '0.00000e+00', '-1.19342e-03', '0.00000e+00', '6.37015e+04', '2.14723e-09', '6.37015e+04'], 'SSAgreement': 'error'} [----------------------------------------------------------------------------- ] 32 96.97 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-000001_AA.pdb {'AnalyzeGeometry': 29.0, 'eSCORE': 1.93349, 'FARNA': ['-41.173', '-4.965', '-19.138', '-147.416', '-16.054', '-359.367', '14.541', '106.414', '-16.671', '-457.786', '0.0', '0.0', '26.043', '0.0'], 'ClashScore': 146.233848, 'length': 100, 'SimRNA_0': ['0', '-807.286566', '-376.237', '-109.410', '0.776', '-431.826102', '-42.794', '-88.511', '-53.898', '-45.042', '-201.581', '', '-807.286566'], 'FARNA_hires': ['0.0', '-486.586', '-1.715', '0.0', '3.796', '14.412', '-428.9', '18.086', '-241.619', '0.819', '-151.3', '38.599', '-4.392', '241.503', '24.124'], 'RNAscore': 20.8779, 'RASP': ['4.2334', '1001', '0.00422917', '9.56624', '3.65435', '-1.45931', '-8494.86', '62370', '-0.136201', '-8395.8', '38.2781', '-2.58804', '-18570.8', '141492', '-0.13125', '-18098.7', '90.5396', '-5.21371', '-46802.7', '468060', '-0.099993', '0', '0', '0'], 'RNAkb': ['1.62076e+04', '2.02593e+04', '9.93646e+03', '3.58470e+01', '0.00000e+00', '0.00000e+00', '-2.88917e-03', '0.00000e+00', '4.64392e+04', '1.74856e-09', '4.64392e+04'], 'RNAkb_all': ['1.62076e+04', '2.02593e+04', '9.93646e+03', '3.58470e+01', '0.00000e+00', '0.00000e+00', '-1.07494e-03', '0.00000e+00', '4.64392e+04', '1.74856e-09', '4.64392e+04'], 'SSAgreement': 'error'} [--------------------------------------------------------------------------------] 33 100.0 % 33 10 True UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-000001_AA.pdb {'AnalyzeGeometry': 33.0, 'eSCORE': 1.92306, 'FARNA': ['-40.559', '-6.72', '-21.253', '-140.536', '-17.263', '-366.908', '72.768', '109.133', '-18.048', '-408.359', '0.0', '0.0', '21.028', '0.0'], 'ClashScore': 156.535433, 'length': 100, 'SimRNA_0': ['0', '-736.052688', '-321.584', '-77.843', '-1.089', '-413.379855', '-30.048', '-82.630', '-51.865', '-43.345', '-205.493', '', '-736.052688'], 'FARNA_hires': ['0.0', '-466.635', '-2.802', '0.0', '3.851', '23.907', '-450.706', '17.536', '-249.697', '2.915', '-156.37', '62.662', '-17.465', '280.066', '19.469'], 'RNAscore': 21.3783, 'RASP': ['2.9562', '1240', '0.00238403', '9.62521', '3.54054', '-1.88362', '-7885.47', '76320', '-0.103321', '-7676.53', '45.3761', '-4.60477', '-17118.1', '173995', '-0.0983825', '-16300.3', '93.7296', '-8.72441', '-42819.8', '566894', '-0.0755341', '0', '0', '0'], 'RNAkb': ['1.74966e+04', '1.96217e+04', '9.91754e+03', '3.73537e+01', '0.00000e+00', '0.00000e+00', '-1.36894e-03', '0.00000e+00', '4.70732e+04', '1.74725e-09', '4.70732e+04'], 'RNAkb_all': ['1.74966e+04', '1.96217e+04', '9.91754e+03', '3.73537e+01', '0.00000e+00', '0.00000e+00', '-1.10020e-03', '0.00000e+00', '4.70732e+04', '1.74725e-09', '4.70732e+04'], 'SSAgreement': 'error'} Cmd: mqaprna.py -s /home/mqapRNA/mqapRNAweb/media/jobs/70e1e318-b1a1-46a7-bcb7-f945758bf660/ss.txt -m 6 -f -o /home/mqapRNA/mqapRNAweb/media/jobs/70e1e318-b1a1-46a7-bcb7-f945758bf660/70e1e31_raw.csv input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-000001_AA.pdb input/UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-000001_AA.pdb Execution time: 0:43:41.233 process: 6 start: 09:50:12 end: 10:33:54 Output: /home/mqapRNA/mqapRNAweb/media/jobs/70e1e318-b1a1-46a7-bcb7-f945758bf660/70e1e31_raw.csv logging: /home/mqapRNA/mqapRNAweb/media/jobs/70e1e318-b1a1-46a7-bcb7-f945758bf660/70e1e31_raw.log logging wrappers /home/mqapRNA/mqaprna_env/log/ in: /home/mqapRNA/mqapRNAweb/media/jobs/70e1e318-b1a1-46a7-bcb7-f945758bf660/70e1e31_raw.csv model_key: grid-8a6dfea4-1f6e-4354-9396-f727a5bd937a_model_14 Checking whether there is an H2O instance running at http://localhost:54321..... not found. Attempting to start a local H2O server... Java Version: java version "1.8.0_131"; Java(TM) SE Runtime Environment (build 1.8.0_131-b11); Java HotSpot(TM) 64-Bit Server VM (build 25.131-b11, mixed mode) Starting server from /usr/local/lib/python2.7/dist-packages/h2o/backend/bin/h2o.jar Ice root: /tmp/tmp5FrZ_T JVM stdout: /tmp/tmp5FrZ_T/h2o_magnus_started_from_python.out JVM stderr: /tmp/tmp5FrZ_T/h2o_magnus_started_from_python.err Server is running at http://127.0.0.1:54321 Connecting to H2O server at http://127.0.0.1:54321... successful. Warning: Your H2O cluster version is too old (7 months and 13 days)! Please download and install the latest version from http://h2o.ai/download/ -------------------------- ------------------------------ H2O cluster uptime: 03 secs H2O cluster version: 3.10.4.5 H2O cluster version age: 7 months and 13 days !!! H2O cluster name: H2O_from_python_magnus_pad78y H2O cluster total nodes: 1 H2O cluster free memory: 1.742 Gb H2O cluster total cores: 8 H2O cluster allowed cores: 8 H2O cluster status: accepting new members, healthy H2O connection url: http://127.0.0.1:54321 H2O connection proxy: H2O internal security: False Python version: 2.7.6 final -------------------------- ------------------------------ Parse progress: [#########################################################] 100% fn clash_score analyze_geometry farna_rna_base_axis farna_rna_backbone_backbone farna_rna_base_stack_axis farna_rna_base_stagger farna_rna_base_stack farna_rna_base_pair farna_rna_repulsive farna_rna_vdw farna_rna_base_backbone farna_score_lowres farna_rna_data_backbone farna_linear_chainbreak farna_rna_rg farna_atom_pair_constraint simrna_steps simrna_total_energy simrna_base_base simrna_short_stacking simrna_base_backbone simrna_local_geometry simrna_bonds_dist_cp simrna_bonds_dist_pc simrna_flat_angles_cpc simrna_flat_angles_pcp simrna_tors_eta_theta simrna_sphere_penalty simrna_chain_energy x3rnascore escore rnakb_bond rnakb_angle rnakb_proper_dih rnakb_improper_dih rnakb_lj14 rnakb_coulomb14 rnakb_lj_sr rnakb_coulomb_sr rnakb_potential rnakb_kinetic_en rnakb_total_energy ss_disagreement farna_atom_pair_constraint_hires farna_score_hires farna_hbond_sr_bb_sc farna_linear_chainbreak_hires farna_fa_intra_rep farna_rna_sugar_close farna_hbond_sc farna_lk_nonpolar farna_fa_atr farna_fa_elec_rna_phos_phos farna_ch_bond farna_fa_rep farna_hbond_lr_bb_sc farna_geom_sol farna_rna_torsion rasp_c3_pdb_energy rasp_c3_no_contacts rasp_c3_norm_energy rasp_c3_mean_energy rasp_c3_sd_energy rasp_c3_zscore rasp_bb_pdb_energy rasp_bb_no_contacts rasp_bb_norm_energy rasp_bb_mean_energy rasp_bb_sd_energy rasp_bb_zscore rasp_bbr_pdb_energy rasp_bbr_no_contacts rasp_bbr_norm_energy rasp_bbr_mean_energy rasp_bbr_sd_energy rasp_bbr_zscore rasp_all_pdb_energy rasp_all_no_contacts rasp_all_norm_energy rasp_all_mean_energy rasp_all_sd_energy rasp_all_zscore rnakb_bond_all rnakb_angle_all rnakb_proper_dih_all rnakb_improper_dih_all rnakb_lj14_all rnakb_coulomb14_all rnakb_lj_sr_all rnakb_coulomb_sr_all rnakb_potential_all rnakb_kinetic_en_all rnakb_total_energy_all ---------------------------------------------------------- ------------- ------------------ --------------------- ----------------------------- --------------------------- ------------------------ ---------------------- --------------------- --------------------- --------------- ------------------------- -------------------- ------------------------- ------------------------- -------------- ---------------------------- -------------- --------------------- ------------------ ----------------------- ---------------------- ----------------------- ---------------------- ---------------------- ------------------------ ------------------------ ----------------------- ----------------------- --------------------- ------------ 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---------------------- -------------------- ----------------- ---------------- ----------------- ---------------------- ------------------------ ---------------- --------------------- ----------------- ---------------------- --------------------- ---------------------- ------------------------ UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-000001_AA.pdb 116.074 23 -39.853 0 -18.92 -163.094 -16.275 -356.213 23.497 43.771 -9.404 -511.954 0 0 24.536 0 0 -796.184 -364.249 -90.721 -1.576 -430.359 -48.357 -87.769 -55.527 -43.695 -195.011 nan -796.184 21.051 1.93736 31506.1 18586 9678.57 26.3022 0 0 -0.00251349 0 59797 2.0958e-09 59797 error 0 -452.71 -3.586 0 2.626 13.495 -439.84 16.575 -240.749 2.46 -136.6 47.006 -7.136 279.364 13.675 1.6922 1028 0.00164611 9.99177 3.0445 -2.72608 -8406.25 63435 -0.132517 -8281.36 41.5362 -3.0068 -19033.8 143509 -0.132632 -18399.1 73.9254 -8.586 -47448.7 480735 -0.0987004 0 0 0 31506.1 18586 9678.57 26.3022 0 0 -0.000987002 0 59797 2.0958e-09 59797 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-000001_AA.pdb 150.142 35 -44.148 -3.611 -22.723 -156.163 -19.231 -367.724 44.166 97.76 -11.219 -460.269 0 0 22.624 0 0 -848.603 -384.575 -95.381 -1.433 -462.595 -57.479 -87.653 -57.714 -44.694 -215.055 nan -848.603 21.1534 2.09669 19358.4 15920.7 9895.72 35.3958 0 0 -0.00281315 0 45210.2 1.80149e-09 45210.2 error 0 -454.213 -4.545 0 3.778 14.863 -400.571 18.767 -232.557 1.242 -146.001 25.377 0 251.144 14.29 3.7135 1168 0.00317937 11.0992 3.50152 -2.10928 -8602.74 72052 -0.119396 -8355.68 45.3831 -5.44388 -18891.9 162757 -0.116074 -18162.1 89.5405 -8.15097 -46599.2 538302 -0.086567 0 0 0 19358.4 15920.7 9895.72 35.3958 0 0 -0.00115317 0 45210.2 1.80149e-09 45210.2 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-000001_AA.pdb 160.252 29 -39.139 -1.732 -22.544 -133.789 -20.528 -365.572 35.318 174.416 -30.077 -381.226 0 0 22.42 0 0 -729.917 -297.316 -65.729 -1.409 -431.191 -47.78 -87.924 -54.963 -46.265 -194.26 nan -729.917 21.0334 1.86071 16408.2 19035.5 9736.79 37.7857 0 0 -0.0025305 0 45218.3 1.72618e-09 45218.3 error 0 -437.826 -2.549 0 3.032 14.068 -367.308 16.957 -250.829 0.734 -150.649 49.363 -9.384 245.563 13.176 3.5091 1155 0.00303818 10.3448 3.70368 -1.84566 -8413.26 70360 -0.119574 -8262.32 40.548 -3.72243 -18197.1 160876 -0.113113 -17469.6 89.8578 -8.09618 -44195.1 539310 -0.0819474 0 0 0 16408.2 19035.5 9736.79 37.7857 0 0 -0.0010729 0 45218.3 1.72618e-09 45218.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-000001_AA.pdb 138.137 33 -42.432 -16.413 -29.364 -151.01 -24.77 -369.342 80.849 117.713 -41.532 -454.268 0 0 22.032 0 0 -776.392 -366.341 -86.961 -1.021 -409.03 -45.022 -81.649 -50.494 -37.595 -194.27 nan -776.392 21.475 2.09032 25949.5 20169.7 9911.7 36.9293 0 0 -0.00187484 0 56067.8 1.97189e-09 56067.8 error 0 -490.878 -2.69 0 3.351 14.609 -447.891 19.739 -250.731 0.827 -152.355 44.051 -3.358 268.432 15.139 0.2802 1194 0.000234673 9.4958 4.04831 -2.27641 -7765.66 74414 -0.104358 -7571.14 58.0458 -3.35123 -17260.1 169473 -0.101846 -16461.1 102.36 -7.80627 -43132.5 572198 -0.0753804 0 0 0 25949.5 20169.7 9911.7 36.9293 0 0 -0.00129562 0 56067.8 1.97189e-09 56067.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-000001_AA.pdb 174.448 32 -39.11 -1.321 -24.608 -147.719 -21.743 -365.988 23.822 118.683 -27.169 -458.891 0 0 26.263 0 0 -739.213 -329.671 -61.78 0.694 -410.236 -46.219 -85.158 -47.172 -38.773 -192.915 nan -739.213 21.411 1.9201 24131.7 20577.3 9796.61 29.728 0 0 -0.00218682 0 54535.3 1.9294e-09 54535.3 error 0 -486.402 -1.336 0 4.176 12.641 -412.113 21.992 -238.901 2.787 -149.531 30.839 -20.847 249.137 14.755 -5.5144 1110 -0.00496793 11.1256 4.10256 -4.056 -7319 68896 -0.106233 -6975.97 61.6065 -5.568 -16272.1 156980 -0.103657 -15081.9 108.355 -10.9846 -39101.6 530837 -0.0736604 0 0 0 24131.7 20577.3 9796.61 29.728 0 0 -0.00108453 0 54535.3 1.9294e-09 54535.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-000001_AA.pdb 189.981 28 -39.644 -2.258 -23.221 -149.426 -19.473 -380.776 39.548 197.124 -20.496 -375.143 0 0 23.478 0 0 -726.398 -316.346 -91.307 0.073 -410.125 -46.628 -85.588 -50.461 -34.518 -192.93 nan -726.398 20.6376 1.95265 19021.1 17894.5 9783.19 34.926 0 0 -0.00218659 0 46733.7 1.79871e-09 46733.7 error 0 -408.691 -3.021 0 3.215 13.774 -340.797 14.244 -243.152 0.748 -148.575 49.324 -7.35 241.709 11.189 3.8814 1121 0.00346244 10.223 3.68608 -1.72042 -8105.39 68724 -0.117941 -7840.33 49.9315 -5.30847 -17722.7 157303 -0.112666 -16928 92.721 -8.57056 -45633.6 518817 -0.0879571 0 0 0 19021.1 17894.5 9783.19 34.926 0 0 -0.00104711 0 46733.7 1.79871e-09 46733.7 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-000001_AA.pdb 160.529 28 -40.661 -0.642 -21.103 -134.008 -18.27 -380.554 58.256 123.151 -14.33 -403.859 0 0 24.302 0 0 -722.055 -333.438 -90.795 -0.456 -388.16 -21.537 -82.051 -46.8 -35.187 -202.585 nan -722.055 21.1475 1.92592 17340.4 17340.7 9771.69 21.2609 0 0 -0.00211056 0 44474 1.71393e-09 44474 error 0 -465.761 -3.442 0 2.808 20.477 -444.9 15.81 -240.797 2.747 -144.752 38.101 -6.889 280.614 14.462 5.7438 1178 0.00487589 12.3191 4.05674 -1.62084 -7655.16 71765 -0.10667 -7474.25 46.3664 -3.90175 -16693.4 164815 -0.101286 -15958.2 110.281 -6.66712 -43157.1 554403 -0.0778443 0 0 0 17340.4 17340.7 9771.69 21.2609 0 0 -0.00114107 0 44474 1.71393e-09 44474 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-000001_AA.pdb 172.283 32 -43.537 -8.372 -23.507 -152.345 -19.657 -379.354 43.339 117.135 -22.204 -467.387 0 0 21.114 0 0 -732.03 -332.713 -76.938 -3.692 -395.625 -45.25 -78.711 -55.277 -28.341 -188.047 nan -732.03 21.1272 1.97792 28297 19390.9 9985.95 37.9233 0 0 -0.00135939 0 57711.8 2.00758e-09 57711.8 error 0 -403.205 -2.816 0 3.448 15.482 -388.697 16.33 -235.779 2.392 -141.921 57.814 -10.981 269.624 11.899 4.5434 1234 0.00368185 12.1002 4.3389 -1.74163 -8011.26 76260 -0.105052 -7742.5 46.9673 -5.72226 -17586.5 174551 -0.100753 -16554.4 100.585 -10.2613 -44439.6 574309 -0.0773793 0 0 0 28297 19390.9 9985.95 37.9233 0 0 -0.00116135 0 57711.8 2.00758e-09 57711.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-000001_AA.pdb 119.22 32 -39.397 -3.363 -23.289 -142.266 -19.091 -371.445 78.117 117.848 -26.273 -403.555 0 0 25.604 0 0 -773.464 -368.907 -110.731 -0.869 -403.689 -38.691 -85.172 -53.839 -38.047 -187.94 nan -773.464 20.9799 1.95247 32294.8 20266.6 9701.51 21.9065 0 0 -0.00216649 0 62284.8 2.10709e-09 62284.8 error 0 -226.988 -2.468 0 4.947 10.713 -60.758 35.721 -226.019 3.7 -184.241 25.783 -58.149 208.536 15.246 4.6165 1097 0.0042083 9.74188 4.17534 -1.22753 -8184.99 67422 -0.121399 -7913.9 44.5691 -6.08253 -17884.8 154391 -0.115841 -16976.1 102.531 -8.86298 -45403.9 522955 -0.0868218 0 0 0 32294.8 20266.6 9701.51 21.9065 0 0 -0.00121094 0 62284.8 2.10709e-09 62284.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-000001_AA.pdb 105.66 20 -39.581 -15.72 -19.781 -144.144 -16.287 -348.811 69.504 72.513 -22.5 -440.835 0 0 23.971 0 0 -790.515 -366.325 -117.93 0.734 -424.923 -51.68 -80.335 -55.876 -41.701 -195.332 nan -790.515 21.3342 1.86576 20702.8 18076.5 9755.34 31.6731 0 0 -0.000766088 0 48566.3 1.82302e-09 48566.3 error 0 -501.327 -2.171 0 3.195 21.679 -397.991 22.162 -244.425 3.049 -159.202 22.942 -21.26 237.197 13.498 2.2537 1164 0.00193617 10.9065 3.88207 -2.22891 -7903.34 71794 -0.110084 -7725.09 48.3755 -3.68481 -17743 162193 -0.109395 -17073.3 92.6453 -7.22881 -42475 535959 -0.0792505 0 0 0 20702.8 18076.5 9755.34 31.6731 0 0 -0.00103255 0 48566.3 1.82302e-09 48566.3 [33 rows x 94 columns] deeplearning prediction progress: [#######################################] 100% deeplearning prediction progress: [#######################################] 100% mqapRNA --------- 2.00635 1.78346 1.53609 1.7572 1.63664 1.41422 2.03233 1.75789 1.72628 2.21019 [33 rows x 1 column] fn ---------------------------------------------------------- UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-000001_AA.pdb UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-000001_AA.pdb UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-000001_AA.pdb UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-000001_AA.pdb UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-000001_AA.pdb UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-000001_AA.pdb UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-000001_AA.pdb UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-000001_AA.pdb UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-000001_AA.pdb UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-000001_AA.pdb [10 rows x 1 column] Exporting to /home/mqapRNA/mqapRNAweb/media/jobs/70e1e318-b1a1-46a7-bcb7-f945758bf660/70e1e31_raw_mqapRNA.csv Export File progress: [###################################################] 100% clash_score \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 162.21 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 114.09 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 189.98 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 144.48 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 152.25 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 160.25 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 155.37 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 132.08 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 163.57 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 119.11 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 174.45 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 158.64 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 169.50 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 142.86 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 138.22 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 119.22 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 146.23 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 140.21 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 133.59 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 138.14 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 172.28 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 173.80 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 150.14 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 156.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 132.05 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 185.65 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 151.45 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 141.28 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 116.07 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 122.44 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 160.53 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 170.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 105.66 analyze_geometry \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 26 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 23 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 28 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 29 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 27 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 29 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 31 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 19 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 25 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 26 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 32 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 32 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 32 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 33 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 30 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 32 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 29 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 29 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 31 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 33 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 32 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 27 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 35 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 33 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 29 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 27 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 27 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 26 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 23 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 23 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 28 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 25 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 20 farna_rna_base_axis \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... -40.41 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... -40.62 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... -39.64 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... -41.08 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... -38.75 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... -39.14 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... -38.11 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... -36.34 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... -38.99 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... -40.74 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... -39.11 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... -40.11 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... -40.90 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... -39.87 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... -41.06 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... -39.40 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... -41.17 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... -38.19 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... -42.10 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... -42.43 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... -43.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... -40.35 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... -44.15 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... -40.56 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... -39.53 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... -45.26 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... -42.11 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... -40.90 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... -39.85 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... -38.87 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... -40.66 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... -42.23 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... -39.58 farna_rna_backbone_backbone \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... -15.29 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... -0.94 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... -2.26 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... -3.34 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... -0.37 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... -1.73 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... -7.02 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... -10.30 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... -0.99 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... -15.05 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... -1.32 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... -0.27 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... -8.81 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... -19.15 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... -6.70 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... -3.36 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... -4.96 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... -4.44 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... -16.29 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... -16.41 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... -8.37 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... -9.64 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... -3.61 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... -6.72 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... -4.37 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... -10.97 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... -3.15 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... -12.60 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 0.00 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... -0.20 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... -0.64 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... -1.78 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... -15.72 farna_rna_base_stack_axis \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... -24.77 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... -27.47 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... -23.22 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... -25.04 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... -19.48 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... -22.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... -19.18 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... -26.41 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... -21.75 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... -32.07 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... -24.61 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... -23.51 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... -14.59 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... -24.99 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... -23.24 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... -23.29 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... -19.14 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... -24.25 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... -27.33 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... -29.36 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... -23.51 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... -28.25 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... -22.72 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... -21.25 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... -15.69 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... -24.88 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... -27.49 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... -22.11 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... -18.92 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... -24.59 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... -21.10 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... -24.43 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... -19.78 farna_rna_base_stagger \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... -143.13 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... -144.14 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... -149.43 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... -144.20 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... -155.99 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... -133.79 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... -145.79 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... -138.70 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... -145.65 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... -145.86 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... -147.72 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... -144.66 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... -135.48 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... -143.31 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... -138.52 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... -142.27 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... -147.42 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... -148.08 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... -156.41 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... -151.01 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... -152.34 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... -149.11 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... -156.16 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... -140.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... -143.45 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... -147.73 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... -156.30 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... -145.16 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... -163.09 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... -151.53 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... -134.01 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... -157.11 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... -144.14 farna_rna_base_stack \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... -21.29 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... -21.96 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... -19.47 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... -22.95 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... -16.40 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... -20.53 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... -17.19 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... -22.84 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... -19.34 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... -26.42 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... -21.74 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... -20.22 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... -12.51 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... -20.11 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... -20.52 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... -19.09 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... -16.05 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... -22.10 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... -22.69 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... -24.77 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... -19.66 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... -22.52 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... -19.23 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... -17.26 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... -15.05 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... -22.59 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... -23.72 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... -18.34 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... -16.27 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... -21.05 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... -18.27 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... -20.93 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... -16.29 farna_rna_base_pair \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... -346.02 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... -356.23 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... -380.78 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... -372.40 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... -360.19 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... -365.57 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... -365.90 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... -328.93 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... -360.86 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... -352.23 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... -365.99 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... -355.03 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... -350.57 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... -357.70 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... -357.27 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... -371.44 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... -359.37 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... -336.37 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... -390.03 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... -369.34 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... -379.35 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... -364.77 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... -367.72 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... -366.91 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... -362.55 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... -382.43 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... -372.91 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... -353.01 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... -356.21 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... -364.26 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... -380.55 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... -379.99 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... -348.81 farna_rna_repulsive \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 35.43 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 28.94 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 39.55 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 42.51 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 31.24 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 35.32 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 38.88 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 50.88 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 34.87 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 48.15 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 23.82 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 26.00 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 85.22 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 68.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 58.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 78.12 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 14.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 31.62 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 38.09 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 80.85 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 43.34 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 29.65 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 44.17 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 72.77 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 21.21 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 35.01 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 51.52 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 51.92 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 23.50 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 59.76 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 58.26 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 64.08 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 69.50 farna_rna_vdw ... \ fn ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 122.78 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 89.40 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 197.12 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 114.38 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 122.83 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 174.42 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 114.78 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 75.98 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 109.10 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 71.56 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 118.68 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 97.91 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 141.29 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 115.80 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 95.82 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 117.85 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 106.41 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 77.79 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 179.73 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 117.71 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 117.14 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 120.39 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 97.76 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 109.13 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 70.66 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 98.28 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 121.36 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 188.79 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 43.77 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 66.12 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 123.15 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 109.55 ... UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 72.51 ... rnakb_proper_dih_all \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 9687.18 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 9759.90 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 9783.19 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 9703.30 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 9870.68 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 9736.79 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 10011.00 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 9504.79 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 9714.79 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 9717.20 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 9796.61 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 9814.17 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 9867.33 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 9988.38 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 9822.24 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 9701.51 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 9936.46 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 9742.56 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 10000.40 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 9911.70 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 9985.95 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 9722.02 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 9895.72 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 9917.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 9888.15 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 9822.57 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 9926.11 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 9751.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 9678.57 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 9570.62 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 9771.69 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 9787.16 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 9755.34 rnakb_improper_dih_all \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 27.04 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 34.22 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 34.93 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 35.64 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 36.10 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 37.79 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 36.43 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 22.28 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 31.39 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 34.95 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 29.73 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 29.09 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 35.96 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 43.14 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 28.06 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 21.91 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 35.85 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 39.96 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 45.15 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 36.93 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 37.92 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 20.90 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 35.40 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 37.35 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 21.38 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 29.18 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 37.09 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 35.82 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 26.30 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 29.95 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 21.26 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 43.14 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 31.67 rnakb_lj14_all \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 0 rnakb_coulomb14_all \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 0 rnakb_lj_sr_all \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... -0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... -0.0 rnakb_coulomb_sr_all \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 0 rnakb_potential_all \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 42519.9 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 47634.7 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 46733.7 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 51369.4 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 61961.6 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 45218.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 58392.1 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 54233.7 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 43715.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 54385.7 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 54535.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 46572.9 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 54411.1 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 46395.7 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 43136.2 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 62284.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 46439.2 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 50108.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 56916.6 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 56067.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 57711.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 59942.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 45210.2 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 47073.2 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 63701.5 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 50308.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 68199.5 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 50434.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 59797.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 40122.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 44474.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 53051.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 48566.3 rnakb_kinetic_en_all \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 0.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 0.0 rnakb_total_energy_all \ fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 42519.9 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 47634.7 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 46733.7 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 51369.4 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 61961.6 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 45218.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 58392.1 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 54233.7 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 43715.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 54385.7 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 54535.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 46572.9 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 54411.1 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 46395.7 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 43136.2 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 62284.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 46439.2 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 50108.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 56916.6 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 56067.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 57711.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 59942.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 45210.2 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 47073.2 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 63701.5 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 50308.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 68199.5 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 50434.3 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 59797.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 40122.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 44474.0 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 53051.8 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 48566.3 mqapRNA fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 1.14 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 1.37 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 1.41 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 1.49 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 1.51 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 1.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 1.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 1.61 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 1.61 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 1.63 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 1.64 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 1.67 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 1.68 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 1.71 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 1.72 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 1.73 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 1.73 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 1.75 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 1.75 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 1.76 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 1.76 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 1.78 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 1.78 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 1.89 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 1.92 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 1.94 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 1.97 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 2.00 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 2.01 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 2.03 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 2.03 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 2.12 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 2.21 [33 rows x 94 columns] mqapRNA fn UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust27-00... 1.14 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust21-00... 1.37 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust08-00... 1.41 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust14-00... 1.49 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust23-00... 1.51 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust03-00... 1.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust13-00... 1.54 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust31-00... 1.61 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust19-00... 1.61 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust16-00... 1.63 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust09-00... 1.64 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust25-00... 1.67 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust15-00... 1.68 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust17-00... 1.71 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust29-00... 1.72 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust11-00... 1.73 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust32-00... 1.73 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust12-00... 1.75 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust22-00... 1.75 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust05-00... 1.76 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust04-00... 1.76 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust28-00... 1.78 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust01-00... 1.78 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust30-00... 1.89 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust33-00... 1.92 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust20-00... 1.94 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust10-00... 1.97 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust24-00... 2.00 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust07-00... 2.01 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust18-00... 2.03 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust02-00... 2.03 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust26-00... 2.12 UR5_1764_yjdF-dcc0f00f_ALL_thrs8.00A_clust06-00... 2.21 saved /home/mqapRNA/mqapRNAweb/media/jobs/70e1e318-b1a1-46a7-bcb7-f945758bf660/70e1e31_mqapRNA.csv H2O session _sid_9121 closed.