data_5lis_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5lis _Structure_validation_residue.Date_analyzed 2016-10-13 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.72 0 N-CA-C 110.415 -1.074 . . . . 73.629999999999995 110.415 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.2 tp -55.94 -42.88 72.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 114.295 1.22 . . . . 62.969999999999999 114.295 -174.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.8 t -67.04 -42.48 88.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.636 -0.505 . . . . 70.900000000000006 109.636 -174.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 59.9 mp0 -64.83 -45.09 87.62 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.174 -0.466 . . . . 92.129999999999995 111.129 175.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -61.47 -43.63 98.53 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 115.029 1.492 . . . . 82.730000000000004 115.029 175.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.9 m -114.52 -25.95 8.13 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 118.062 2.616 . . . . 61.409999999999997 118.062 -166.959 -67.129 -98.837 50.377 101.955 2.035 107.708 77.237 -161.914 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.4 t -94.23 -70.42 0.71 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.919 0.762 . . . . 61.200000000000003 109.853 178.751 175.759 54.384 94.669 105.79 2.052 103.822 -86.953 -55.064 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.3 p -65.26 -35.14 80.12 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.479 0.548 . . . . 75.280000000000001 112.479 -178.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.3 m -104.46 172.06 7.0 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 122.404 0.282 . . . . 77.060000000000002 110.414 167.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.4 mt -80.99 133.25 29.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 108.023 -1.103 . . . . 74.560000000000002 108.023 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.0 t -86.37 166.82 15.28 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.106 0.962 . . . . 60.289999999999999 111.031 -175.354 -161.914 77.237 50.377 107.708 2.035 101.955 -98.837 -67.129 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.1 p -138.89 158.31 44.44 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.545 1.138 . . . . 53.299999999999997 111.39 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.8 tp -54.08 -45.86 71.89 Favored 'General case' 0 C--O 1.266 1.946 0 N-CA-C 113.491 0.922 . . . . 48.450000000000003 113.491 171.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -51.17 -46.66 62.14 Favored 'General case' 0 C--O 1.261 1.667 0 CA-C-N 113.511 -1.677 . . . . 66.5 112.003 178.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -74.86 -41.35 60.01 Favored 'General case' 0 CA--C 1.513 -0.475 0 O-C-N 124.249 0.968 . . . . 76.299999999999997 112.713 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.0 mt -56.35 -41.26 75.83 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 118.466 0.575 . . . . 45.479999999999997 111.204 176.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -72.09 -19.17 61.85 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 113.335 0.865 . . . . 50.810000000000002 113.335 -175.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.04 -18.31 57.12 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.134 1.161 . . . . 55.920000000000002 114.134 167.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -100.44 -0.2 38.51 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 114.167 1.173 . . . . 57.32 114.167 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.3 m -70.85 158.5 36.27 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.591 -0.892 . . . . 51.649999999999999 108.591 170.542 -54.304 -47.301 -76.919 107.719 2.062 102.747 -67.532 -52.328 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 . . . . . 0 N--CA 1.477 0.894 0 C-N-CA 122.845 0.458 . . . . 67.099999999999994 110.571 179.425 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.507 2.405 0 CA-C-O 119.906 -0.092 . . . . 121.56999999999999 111.015 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.9 m -165.19 -45.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 N-CA-C 114.054 1.131 . . . . 96.680000000000007 114.054 -176.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.74 16.52 0.11 Allowed 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 119.196 3.035 . . . . 110.13 119.196 -176.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -117.79 172.32 7.45 Favored 'General case' 0 C--O 1.259 1.56 0 CA-C-O 122.015 0.912 . . . . 99.969999999999999 111.346 -177.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -60.53 120.29 9.7 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 113.751 -1.568 . . . . 75.390000000000001 108.955 157.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.1 mt -127.12 110.19 12.65 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.515 1.126 . . . . 52.619999999999997 108.241 -175.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 59.0 m -126.96 152.42 47.21 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.882 -0.784 . . . . 61.509999999999998 108.882 -177.514 -55.064 -86.953 94.669 103.822 2.052 105.79 54.384 175.759 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.4 -134.37 48.01 Favored Glycine 0 CA--C 1.5 -0.88 0 C-N-CA 123.091 0.376 . . . . 47.130000000000003 112.901 170.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 64.4 p -56.22 -28.9 60.02 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 113.412 0.893 . . . . 40.0 113.412 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 m170 -66.58 -42.38 87.1 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-O 121.75 0.785 . . . . 53.399999999999999 111.3 -179.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.34 -47.14 77.54 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.168 -0.469 . . . . 44.219999999999999 110.932 176.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 31.8 t -57.88 -44.4 86.39 Favored 'Isoleucine or valine' 0 C--O 1.244 0.77 0 CA-C-O 122.041 0.924 . . . . 43.840000000000003 111.992 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -59.39 -45.29 91.87 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.312 -0.858 . . . . 58.049999999999997 110.85 176.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.33 -44.03 95.88 Favored 'General case' 0 C--O 1.254 1.342 0 C-N-CA 120.505 -0.478 . . . . 42.119999999999997 110.521 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.16 -42.29 96.8 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 124.367 1.042 . . . . 42.229999999999997 110.78 -178.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -55.87 -53.24 59.17 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.296 -0.866 . . . . 41.020000000000003 109.293 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.0 mt -61.89 -45.26 94.51 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.455 0.645 . . . . 52.170000000000002 111.238 -174.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.71 -47.45 56.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.992 0 CA-C-N 115.291 -0.868 . . . . 45.380000000000003 111.655 -174.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 39.3 m -80.65 154.35 27.41 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 104.422 -2.436 . . . . 48.270000000000003 104.422 -177.109 -52.328 -67.532 -76.919 102.747 2.062 107.719 -47.301 -54.304 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -104.18 -126.67 5.86 Favored Glycine 0 C--N 1.279 -2.622 1 C-N-CA 112.431 -4.7 . . . . 54.479999999999997 111.59 -170.98 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -56.39 -14.72 3.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 112.488 -1.856 . . . . 81.150000000000006 110.909 152.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -62.05 -31.81 72.26 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.263 0.483 . . . . 60.890000000000001 111.887 173.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.01 -164.48 13.6 Favored Glycine 0 C--O 1.222 -0.621 0 N-CA-C 112.189 -0.365 . . . . 49.689999999999998 112.189 -167.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -161.2 172.19 17.13 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.073 1.138 . . . . 51.840000000000003 114.073 -170.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -116.61 118.01 31.42 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 105.719 -1.956 . . . . 84.730000000000004 105.719 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -105.9 108.33 19.79 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 107.756 -1.202 . . . . 56.890000000000001 107.756 171.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.0 p -127.14 79.14 73.51 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.644 1.178 . . . . 73.959999999999994 109.619 -170.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -53.69 -41.07 77.06 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.735 2.29 . . . . 72.930000000000007 113.546 -173.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 54.9 mttt -75.49 10.52 1.64 Allowed 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 115.251 1.575 . . . . 100.26000000000001 115.251 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.649 0 C-N-CA 123.148 0.579 . . . . 99.0 111.434 175.137 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.72 0 N-CA-C 110.415 -1.074 . . . . 73.629999999999995 110.415 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . 0.513 HD13 ' CD2' ' A' ' 19' ' ' TYR . 8.2 tp -55.94 -42.88 72.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 114.295 1.22 . . . . 62.969999999999999 114.295 -174.311 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.8 t -67.04 -42.48 88.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.636 -0.505 . . . . 70.900000000000006 109.636 -174.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . 0.447 ' HA ' ' OG1' ' A' ' 8' ' ' THR . 59.9 mp0 -64.83 -45.09 87.62 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.174 -0.466 . . . . 92.129999999999995 111.129 175.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -61.47 -43.63 98.53 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 115.029 1.492 . . . . 82.730000000000004 115.029 175.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.9 m -114.52 -25.95 8.13 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 118.062 2.616 . . . . 61.409999999999997 118.062 -166.959 -67.129 -98.837 50.377 101.955 2.035 107.708 77.237 -161.914 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.4 t -94.23 -70.42 0.71 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.919 0.762 . . . . 61.200000000000003 109.853 178.751 175.759 54.384 94.669 105.79 2.052 103.822 -86.953 -55.064 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . 0.447 ' OG1' ' HA ' ' A' ' 4' ' ' GLU . 6.3 p -65.26 -35.14 80.12 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.479 0.548 . . . . 75.280000000000001 112.479 -178.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.3 m -104.46 172.06 7.0 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 122.404 0.282 . . . . 77.060000000000002 110.414 167.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.4 mt -80.99 133.25 29.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 108.023 -1.103 . . . . 74.560000000000002 108.023 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.0 t -86.37 166.82 15.28 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.106 0.962 . . . . 60.289999999999999 111.031 -175.354 -161.914 77.237 50.377 107.708 2.035 101.955 -98.837 -67.129 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.1 p -138.89 158.31 44.44 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.545 1.138 . . . . 53.299999999999997 111.39 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.8 tp -54.08 -45.86 71.89 Favored 'General case' 0 C--O 1.266 1.946 0 N-CA-C 113.491 0.922 . . . . 48.450000000000003 113.491 171.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -51.17 -46.66 62.14 Favored 'General case' 0 C--O 1.261 1.667 0 CA-C-N 113.511 -1.677 . . . . 66.5 112.003 178.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -74.86 -41.35 60.01 Favored 'General case' 0 CA--C 1.513 -0.475 0 O-C-N 124.249 0.968 . . . . 76.299999999999997 112.713 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . 0.554 HD12 HG12 ' B' ' 2' ' ' VAL . 56.0 mt -56.35 -41.26 75.83 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 118.466 0.575 . . . . 45.479999999999997 111.204 176.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -72.09 -19.17 61.85 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 113.335 0.865 . . . . 50.810000000000002 113.335 -175.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.04 -18.31 57.12 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.134 1.161 . . . . 55.920000000000002 114.134 167.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . 0.513 ' CD2' HD13 ' A' ' 2' ' ' ILE . 98.0 m-85 -100.44 -0.2 38.51 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 114.167 1.173 . . . . 57.32 114.167 178.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.3 m -70.85 158.5 36.27 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.591 -0.892 . . . . 51.649999999999999 108.591 170.542 -54.304 -47.301 -76.919 107.719 2.062 102.747 -67.532 -52.328 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 . . . . . 0 N--CA 1.477 0.894 0 C-N-CA 122.845 0.458 . . . . 67.099999999999994 110.571 179.425 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' PHE . . . . . 0.522 ' O ' HG13 ' B' ' 2' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.507 2.405 0 CA-C-O 119.906 -0.092 . . . . 121.56999999999999 111.015 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . 0.554 HG12 HD12 ' A' ' 16' ' ' LEU . 1.9 m -165.19 -45.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 N-CA-C 114.054 1.131 . . . . 96.680000000000007 114.054 -176.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -71.74 16.52 0.11 Allowed 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 119.196 3.035 . . . . 110.13 119.196 -176.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -117.79 172.32 7.45 Favored 'General case' 0 C--O 1.259 1.56 0 CA-C-O 122.015 0.912 . . . . 99.969999999999999 111.346 -177.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -60.53 120.29 9.7 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 113.751 -1.568 . . . . 75.390000000000001 108.955 157.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.1 mt -127.12 110.19 12.65 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.515 1.126 . . . . 52.619999999999997 108.241 -175.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 59.0 m -126.96 152.42 47.21 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.882 -0.784 . . . . 61.509999999999998 108.882 -177.514 -55.064 -86.953 94.669 103.822 2.052 105.79 54.384 175.759 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.4 -134.37 48.01 Favored Glycine 0 CA--C 1.5 -0.88 0 C-N-CA 123.091 0.376 . . . . 47.130000000000003 112.901 170.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 64.4 p -56.22 -28.9 60.02 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 113.412 0.893 . . . . 40.0 113.412 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 m170 -66.58 -42.38 87.1 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-O 121.75 0.785 . . . . 53.399999999999999 111.3 -179.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.34 -47.14 77.54 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.168 -0.469 . . . . 44.219999999999999 110.932 176.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 31.8 t -57.88 -44.4 86.39 Favored 'Isoleucine or valine' 0 C--O 1.244 0.77 0 CA-C-O 122.041 0.924 . . . . 43.840000000000003 111.992 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -59.39 -45.29 91.87 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.312 -0.858 . . . . 58.049999999999997 110.85 176.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.33 -44.03 95.88 Favored 'General case' 0 C--O 1.254 1.342 0 C-N-CA 120.505 -0.478 . . . . 42.119999999999997 110.521 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.16 -42.29 96.8 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 124.367 1.042 . . . . 42.229999999999997 110.78 -178.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -55.87 -53.24 59.17 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.296 -0.866 . . . . 41.020000000000003 109.293 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.0 mt -61.89 -45.26 94.51 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.455 0.645 . . . . 52.170000000000002 111.238 -174.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.71 -47.45 56.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.992 0 CA-C-N 115.291 -0.868 . . . . 45.380000000000003 111.655 -174.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 39.3 m -80.65 154.35 27.41 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 104.422 -2.436 . . . . 48.270000000000003 104.422 -177.109 -52.328 -67.532 -76.919 102.747 2.062 107.719 -47.301 -54.304 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -104.18 -126.67 5.86 Favored Glycine 0 C--N 1.279 -2.622 1 C-N-CA 112.431 -4.7 . . . . 54.479999999999997 111.59 -170.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -56.39 -14.72 3.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 112.488 -1.856 . . . . 81.150000000000006 110.909 152.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -62.05 -31.81 72.26 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.263 0.483 . . . . 60.890000000000001 111.887 173.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.01 -164.48 13.6 Favored Glycine 0 C--O 1.222 -0.621 0 N-CA-C 112.189 -0.365 . . . . 49.689999999999998 112.189 -167.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -161.2 172.19 17.13 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.073 1.138 . . . . 51.840000000000003 114.073 -170.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -116.61 118.01 31.42 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 105.719 -1.956 . . . . 84.730000000000004 105.719 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -105.9 108.33 19.79 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 107.756 -1.202 . . . . 56.890000000000001 107.756 171.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.0 p -127.14 79.14 73.51 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.644 1.178 . . . . 73.959999999999994 109.619 -170.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -53.69 -41.07 77.06 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.735 2.29 . . . . 72.930000000000007 113.546 -173.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 54.9 mttt -75.49 10.52 1.64 Allowed 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 115.251 1.575 . . . . 100.26000000000001 115.251 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.649 0 C-N-CA 123.148 0.579 . . . . 99.0 111.434 175.137 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.72 0 N-CA-C 110.415 -1.074 . . . . 73.629999999999995 110.415 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.513 HD13 ' CD2' ' A' ' 19' ' ' TYR . 8.2 tp -55.94 -42.88 72.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 N-CA-C 114.295 1.22 . . . . 62.969999999999999 114.295 -174.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.8 t -67.04 -42.48 88.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.636 -0.505 . . . . 70.900000000000006 109.636 -174.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.447 ' HA ' ' OG1' ' A' ' 8' ' ' THR . 59.9 mp0 -64.83 -45.09 87.62 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.174 -0.466 . . . . 92.129999999999995 111.129 175.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -61.47 -43.63 98.53 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 115.029 1.492 . . . . 82.730000000000004 115.029 175.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.9 m -114.52 -25.95 8.13 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 118.062 2.616 . . . . 61.409999999999997 118.062 -166.959 -67.129 -98.837 50.377 101.955 2.035 107.708 77.237 -161.914 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.4 t -94.23 -70.42 0.71 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.919 0.762 . . . . 61.200000000000003 109.853 178.751 175.759 54.384 94.669 105.79 2.052 103.822 -86.953 -55.064 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . 0.447 ' OG1' ' HA ' ' A' ' 4' ' ' GLU . 6.3 p -65.26 -35.14 80.12 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.479 0.548 . . . . 75.280000000000001 112.479 -178.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.3 m -104.46 172.06 7.0 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 122.404 0.282 . . . . 77.060000000000002 110.414 167.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.4 mt -80.99 133.25 29.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 108.023 -1.103 . . . . 74.560000000000002 108.023 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.0 t -86.37 166.82 15.28 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.106 0.962 . . . . 60.289999999999999 111.031 -175.354 -161.914 77.237 50.377 107.708 2.035 101.955 -98.837 -67.129 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.1 p -138.89 158.31 44.44 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.545 1.138 . . . . 53.299999999999997 111.39 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.8 tp -54.08 -45.86 71.89 Favored 'General case' 0 C--O 1.266 1.946 0 N-CA-C 113.491 0.922 . . . . 48.450000000000003 113.491 171.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -51.17 -46.66 62.14 Favored 'General case' 0 C--O 1.261 1.667 0 CA-C-N 113.511 -1.677 . . . . 66.5 112.003 178.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -74.86 -41.35 60.01 Favored 'General case' 0 CA--C 1.513 -0.475 0 O-C-N 124.249 0.968 . . . . 76.299999999999997 112.713 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.554 HD12 HG12 ' B' ' 2' ' ' VAL . 56.0 mt -56.35 -41.26 75.83 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 118.466 0.575 . . . . 45.479999999999997 111.204 176.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -72.09 -19.17 61.85 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 113.335 0.865 . . . . 50.810000000000002 113.335 -175.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.04 -18.31 57.12 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.134 1.161 . . . . 55.920000000000002 114.134 167.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.513 ' CD2' HD13 ' A' ' 2' ' ' ILE . 98.0 m-85 -100.44 -0.2 38.51 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 114.167 1.173 . . . . 57.32 114.167 178.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.3 m -70.85 158.5 36.27 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.591 -0.892 . . . . 51.649999999999999 108.591 170.542 -54.304 -47.301 -76.919 107.719 2.062 102.747 -67.532 -52.328 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 . . . . . 0 N--CA 1.477 0.894 0 C-N-CA 122.845 0.458 . . . . 67.099999999999994 110.571 179.425 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' PHE . . . . . 0.522 ' O ' HG13 ' B' ' 2' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.507 2.405 0 CA-C-O 119.906 -0.092 . . . . 121.56999999999999 111.015 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.554 HG12 HD12 ' A' ' 16' ' ' LEU . 1.9 m -165.19 -45.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 N-CA-C 114.054 1.131 . . . . 96.680000000000007 114.054 -176.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.74 16.52 0.11 Allowed 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 119.196 3.035 . . . . 110.13 119.196 -176.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -117.79 172.32 7.45 Favored 'General case' 0 C--O 1.259 1.56 0 CA-C-O 122.015 0.912 . . . . 99.969999999999999 111.346 -177.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -60.53 120.29 9.7 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 113.751 -1.568 . . . . 75.390000000000001 108.955 157.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.1 mt -127.12 110.19 12.65 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.515 1.126 . . . . 52.619999999999997 108.241 -175.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 59.0 m -126.96 152.42 47.21 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.882 -0.784 . . . . 61.509999999999998 108.882 -177.514 -55.064 -86.953 94.669 103.822 2.052 105.79 54.384 175.759 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.4 -134.37 48.01 Favored Glycine 0 CA--C 1.5 -0.88 0 C-N-CA 123.091 0.376 . . . . 47.130000000000003 112.901 170.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 64.4 p -56.22 -28.9 60.02 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 113.412 0.893 . . . . 40.0 113.412 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 m170 -66.58 -42.38 87.1 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-O 121.75 0.785 . . . . 53.399999999999999 111.3 -179.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.34 -47.14 77.54 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.168 -0.469 . . . . 44.219999999999999 110.932 176.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 31.8 t -57.88 -44.4 86.39 Favored 'Isoleucine or valine' 0 C--O 1.244 0.77 0 CA-C-O 122.041 0.924 . . . . 43.840000000000003 111.992 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -59.39 -45.29 91.87 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.312 -0.858 . . . . 58.049999999999997 110.85 176.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.33 -44.03 95.88 Favored 'General case' 0 C--O 1.254 1.342 0 C-N-CA 120.505 -0.478 . . . . 42.119999999999997 110.521 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.16 -42.29 96.8 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 124.367 1.042 . . . . 42.229999999999997 110.78 -178.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -55.87 -53.24 59.17 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.296 -0.866 . . . . 41.020000000000003 109.293 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.0 mt -61.89 -45.26 94.51 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.455 0.645 . . . . 52.170000000000002 111.238 -174.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.71 -47.45 56.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.992 0 CA-C-N 115.291 -0.868 . . . . 45.380000000000003 111.655 -174.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 39.3 m -80.65 154.35 27.41 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 104.422 -2.436 . . . . 48.270000000000003 104.422 -177.109 -52.328 -67.532 -76.919 102.747 2.062 107.719 -47.301 -54.304 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -104.18 -126.67 5.86 Favored Glycine 0 C--N 1.279 -2.622 1 C-N-CA 112.431 -4.7 . . . . 54.479999999999997 111.59 -170.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -56.39 -14.72 3.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 112.488 -1.856 . . . . 81.150000000000006 110.909 152.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -62.05 -31.81 72.26 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.263 0.483 . . . . 60.890000000000001 111.887 173.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.01 -164.48 13.6 Favored Glycine 0 C--O 1.222 -0.621 0 N-CA-C 112.189 -0.365 . . . . 49.689999999999998 112.189 -167.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.7 p90 -161.2 172.19 17.13 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.073 1.138 . . . . 51.840000000000003 114.073 -170.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -116.61 118.01 31.42 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 105.719 -1.956 . . . . 84.730000000000004 105.719 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -105.9 108.33 19.79 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 107.756 -1.202 . . . . 56.890000000000001 107.756 171.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.0 p -127.14 79.14 73.51 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.644 1.178 . . . . 73.959999999999994 109.619 -170.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -53.69 -41.07 77.06 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.735 2.29 . . . . 72.930000000000007 113.546 -173.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 54.9 mttt -75.49 10.52 1.64 Allowed 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 115.251 1.575 . . . . 100.26000000000001 115.251 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.649 0 C-N-CA 123.148 0.579 . . . . 99.0 111.434 175.137 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_