data_6msi_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 6msi _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 ' 0' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.538 1 N-CA-C 98.39 -4.67 . . . . 41.979999999999997 98.39 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . -134.16 -24.94 1.6 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.021 -0.733 . . . . 37.039999999999999 109.021 177.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -72.17 128.75 36.65 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 119.876 -1.765 . . . . 34.460000000000001 109.908 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -96.94 144.83 26.48 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 113.838 -1.528 . . . . 16.629999999999999 108.734 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.0 m -115.25 165.3 13.09 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 122.371 1.081 . . . . 12.69 110.504 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.8 t -77.56 127.99 38.18 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 106.45 -1.685 . . . . 10.9 106.45 173.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 55.3 t -127.83 136.99 58.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.045 -1.465 . . . . 11.82 107.045 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.92 123.32 18.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 122.079 0.943 . . . . 9.6799999999999997 111.093 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -89.28 -5.73 57.35 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 123.598 0.759 . . . . 18.379999999999999 111.584 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -158.99 171.71 19.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 105.934 -1.876 . . . . 27.899999999999999 105.934 175.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.4 126.75 30.71 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.457 -2.053 . . . . 18.609999999999999 105.457 175.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.3 mt -102.67 108.06 56.53 Favored Pre-proline 0 N--CA 1.444 -0.75 0 N-CA-C 104.9 -2.259 . . . . 10.81 104.9 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -61.93 154.35 62.18 Favored 'Trans proline' 0 C--O 1.246 0.88 0 C-N-CA 123.496 2.797 . . . . 12.44 111.176 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.1 tt -56.77 139.74 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-O 123.207 1.479 . . . . 13.720000000000001 108.88 178.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.0 m120 70.65 10.24 7.05 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 115.832 1.79 . . . . 25.489999999999998 115.832 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.6 m -72.77 139.87 47.37 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.027 -1.045 . . . . 19.059999999999999 113.071 173.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 87.3 mtt-85 -82.25 130.06 35.0 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 104.581 -2.377 . . . . 41.109999999999999 104.581 173.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.9 mt -68.05 136.99 54.67 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 121.098 -1.001 . . . . 16.289999999999999 113.545 -175.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.2 p -118.84 164.34 15.55 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 107.45 -1.315 . . . . 13.710000000000001 107.45 172.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 26.6 mt -57.91 -34.43 69.83 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 115.446 1.647 . . . . 20.98 115.446 -179.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.93 -10.75 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-N 120.5 1.5 . . . . 21.68 112.309 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 66.3 mtt -84.65 -6.86 59.38 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 120.519 -1.363 . . . . 12.24 114.151 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 57.7 mtm -128.3 123.05 33.08 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 120.876 -1.14 . . . . 15.130000000000001 113.473 -169.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -115.02 172.36 7.1 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.091 -1.078 . . . . 30.600000000000001 108.091 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.1 t -112.64 132.98 54.91 Favored 'General case' 0 N--CA 1.44 -0.925 0 N-CA-C 106.214 -1.773 . . . . 17.23 106.214 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.9 tt0 -155.28 146.31 22.57 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 117.63 -1.176 . . . . 23.57 111.688 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 22.1 m -91.58 114.63 29.1 Favored 'Isoleucine or valine' 0 C--N 1.344 0.369 0 N-CA-C 103.265 -2.865 . . . . 23.25 103.265 -179.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.5 m -136.95 159.64 36.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 107.277 -1.379 . . . . 15.380000000000001 107.277 -173.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.6 m -129.17 133.13 24.83 Favored Pre-proline 0 N--CA 1.449 -0.48 0 N-CA-C 105.414 -2.069 . . . . 24.920000000000002 105.414 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -64.34 164.21 54.97 Favored 'Cis proline' 0 CA--C 1.535 0.533 0 CA-C-N 122.969 2.096 . . . . 18.07 116.653 -8.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.2 t -79.29 144.54 10.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 106.905 -1.517 . . . . 18.780000000000001 106.905 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -115.58 -145.88 8.66 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.135 -1.186 . . . . 12.0 110.135 176.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 86.4 mt -63.8 133.78 95.68 Favored Pre-proline 0 C--N 1.324 -0.537 0 O-C-N 119.153 -2.38 . . . . 15.34 108.922 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -58.17 135.66 69.76 Favored 'Trans proline' 0 CA--C 1.509 -0.744 1 C-N-CA 125.357 4.038 . . . . 17.420000000000002 109.797 -176.916 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.54 -29.4 36.6 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 123.086 1.422 . . . . 17.91 113.581 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -60.47 -29.43 69.05 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 113.942 -1.481 . . . . 38.789999999999999 112.277 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -79.84 -1.47 39.13 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 116.775 -1.583 . . . . 31.109999999999999 115.0 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.2 mt -49.86 -45.82 80.44 Favored Pre-proline 0 N--CA 1.471 0.613 0 CA-C-N 122.368 2.349 . . . . 17.539999999999999 112.561 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -42.43 -50.61 5.54 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 124.307 3.338 . . . . 20.280000000000001 116.901 169.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.4 -10.35 59.49 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 114.425 -1.261 . . . . 20.210000000000001 114.371 -176.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 84.2 mt -92.04 -19.16 22.65 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 116.051 1.871 . . . . 18.420000000000002 116.051 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.54 132.68 26.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 O-C-N 120.547 -1.346 . . . . 20.640000000000001 108.698 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.2 m 79.1 -0.28 2.35 Favored 'General case' 0 CA--C 1.498 -1.022 0 C-N-CA 126.916 2.086 . . . . 29.59 113.728 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 65.5 mtp -87.01 148.69 25.19 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.261 -1.385 . . . . 30.32 107.261 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -96.29 137.97 34.58 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 113.614 0.968 . . . . 30.0 113.614 -174.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.7 m -88.17 145.23 7.73 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 O-C-N 120.821 -1.174 . . . . 14.119999999999999 108.851 175.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.2 p30 -96.86 6.41 48.7 Favored 'General case' 0 C--O 1.239 0.532 0 O-C-N 120.25 -1.531 . . . . 20.73 113.75 -175.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.0 ptt-85 -155.12 162.39 41.01 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 123.939 0.896 . . . . 41.189999999999998 109.958 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.59 132.66 45.81 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 107.262 -1.385 . . . . 11.07 107.262 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.7 t -114.45 106.32 52.68 Favored Pre-proline 0 N--CA 1.45 -0.427 0 N-CA-C 106.461 -1.681 . . . . 11.27 106.461 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.64 151.09 86.68 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.643 2.895 . . . . 13.16 113.644 175.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 23.7 tp -45.61 130.75 8.96 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-O 123.213 1.482 . . . . 15.32 111.16 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.59 1.25 87.71 Favored Glycine 0 N--CA 1.442 -0.952 0 CA-C-O 117.119 -1.934 . . . . 9.5800000000000001 112.825 177.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.6 m -85.41 139.47 31.51 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 121.696 2.748 . . . . 11.68 110.434 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.4 m -71.53 130.1 40.4 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 123.556 0.535 . . . . 11.0 110.507 174.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.9 mp -77.19 122.52 25.14 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.862 0.839 . . . . 23.039999999999999 109.018 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.2 mmt -101.94 156.67 34.93 Favored Pre-proline 0 C--O 1.247 0.971 0 CA-C-O 118.479 -0.772 . . . . 19.100000000000001 110.836 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -50.14 -42.91 44.98 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 124.596 3.531 . . . . 11.9 115.077 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -70.8 -4.05 22.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 115.543 1.683 . . . . 18.890000000000001 115.543 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 64.7 mtt -95.48 -10.75 28.92 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 120.303 -1.498 . . . . 15.02 112.265 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 46.8 t -112.12 121.59 64.83 Favored 'Isoleucine or valine' 0 C--O 1.242 0.681 0 O-C-N 119.838 -1.789 . . . . 17.98 108.602 -175.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -68.61 125.62 27.1 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.565 -0.743 . . . . 34.530000000000001 110.295 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.42 -0.06 85.01 Favored Glycine 0 CA--C 1.52 0.367 0 O-C-N 120.718 -1.239 . . . . 21.079999999999998 113.672 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -77.91 124.2 27.71 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 119.904 1.852 . . . . 31.309999999999999 109.461 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -148.4 126.46 12.06 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 100.653 -3.832 . . . . 45.990000000000002 100.653 171.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 101.285 -3.598 . . . . 51.060000000000002 101.285 -177.318 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.538 1 N-CA-C 98.39 -4.67 . . . . 41.98 98.39 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . -134.16 -24.94 1.6 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.021 -0.733 . . . . 37.04 109.021 177.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -72.17 128.75 36.65 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 119.876 -1.765 . . . . 34.46 109.908 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -96.94 144.83 26.48 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 113.838 -1.528 . . . . 16.63 108.734 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.0 m -115.25 165.3 13.09 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 122.371 1.081 . . . . 12.69 110.504 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.8 t -77.56 127.99 38.18 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 106.45 -1.685 . . . . 10.9 106.45 173.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 55.3 t -127.83 136.99 58.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.045 -1.465 . . . . 11.82 107.045 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.92 123.32 18.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 122.079 0.943 . . . . 9.68 111.093 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -89.28 -5.73 57.35 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 123.598 0.759 . . . . 18.38 111.584 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -158.99 171.71 19.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 105.934 -1.876 . . . . 27.9 105.934 175.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . 0.533 HD23 ' HA ' ' A' ' 50' ' ' PRO . 1.9 tm? -69.4 126.75 30.71 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.457 -2.053 . . . . 18.61 105.457 175.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.3 mt -102.67 108.06 56.53 Favored Pre-proline 0 N--CA 1.444 -0.75 0 N-CA-C 104.9 -2.259 . . . . 10.81 104.9 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -61.93 154.35 62.18 Favored 'Trans proline' 0 C--O 1.246 0.88 0 C-N-CA 123.496 2.797 . . . . 12.44 111.176 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.1 tt -56.77 139.74 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-O 123.207 1.479 . . . . 13.72 108.88 178.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.0 m120 70.65 10.24 7.05 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 115.832 1.79 . . . . 25.49 115.832 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.6 m -72.77 139.87 47.37 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.027 -1.045 . . . . 19.06 113.071 173.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 87.3 mtt-85 -82.25 130.06 35.0 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 104.581 -2.377 . . . . 41.11 104.581 173.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.9 mt -68.05 136.99 54.67 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 121.098 -1.001 . . . . 16.29 113.545 -175.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.2 p -118.84 164.34 15.55 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 107.45 -1.315 . . . . 13.71 107.45 172.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 26.6 mt -57.91 -34.43 69.83 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 115.446 1.647 . . . . 20.98 115.446 -179.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.93 -10.75 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-N 120.5 1.5 . . . . 21.68 112.309 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 66.3 mtt -84.65 -6.86 59.38 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 120.519 -1.363 . . . . 12.24 114.151 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 57.7 mtm -128.3 123.05 33.08 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 120.876 -1.14 . . . . 15.13 113.473 -169.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -115.02 172.36 7.1 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.091 -1.078 . . . . 30.6 108.091 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.1 t -112.64 132.98 54.91 Favored 'General case' 0 N--CA 1.44 -0.925 0 N-CA-C 106.214 -1.773 . . . . 17.23 106.214 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.9 tt0 -155.28 146.31 22.57 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 117.63 -1.176 . . . . 23.57 111.688 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 22.1 m -91.58 114.63 29.1 Favored 'Isoleucine or valine' 0 C--N 1.344 0.369 0 N-CA-C 103.265 -2.865 . . . . 23.25 103.265 -179.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.5 m -136.95 159.64 36.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 107.277 -1.379 . . . . 15.38 107.277 -173.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.6 m -129.17 133.13 24.83 Favored Pre-proline 0 N--CA 1.449 -0.48 0 N-CA-C 105.414 -2.069 . . . . 24.92 105.414 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -64.34 164.21 54.97 Favored 'Cis proline' 0 CA--C 1.535 0.533 0 CA-C-N 122.969 2.096 . . . . 18.07 116.653 -8.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.2 t -79.29 144.54 10.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 106.905 -1.517 . . . . 18.78 106.905 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -115.58 -145.88 8.66 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.135 -1.186 . . . . 12.0 110.135 176.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 86.4 mt -63.8 133.78 95.68 Favored Pre-proline 0 C--N 1.324 -0.537 0 O-C-N 119.153 -2.38 . . . . 15.34 108.922 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -58.17 135.66 69.76 Favored 'Trans proline' 0 CA--C 1.509 -0.744 1 C-N-CA 125.357 4.038 . . . . 17.42 109.797 -176.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.54 -29.4 36.6 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 123.086 1.422 . . . . 17.91 113.581 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -60.47 -29.43 69.05 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 113.942 -1.481 . . . . 38.79 112.277 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -79.84 -1.47 39.13 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 116.775 -1.583 . . . . 31.11 115.0 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.2 mt -49.86 -45.82 80.44 Favored Pre-proline 0 N--CA 1.471 0.613 0 CA-C-N 122.368 2.349 . . . . 17.54 112.561 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -42.43 -50.61 5.54 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 124.307 3.338 . . . . 20.28 116.901 169.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.4 -10.35 59.49 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 114.425 -1.261 . . . . 20.21 114.371 -176.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 84.2 mt -92.04 -19.16 22.65 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 116.051 1.871 . . . . 18.42 116.051 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.54 132.68 26.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 O-C-N 120.547 -1.346 . . . . 20.64 108.698 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.2 m 79.1 -0.28 2.35 Favored 'General case' 0 CA--C 1.498 -1.022 0 C-N-CA 126.916 2.086 . . . . 29.59 113.728 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 65.5 mtp -87.01 148.69 25.19 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.261 -1.385 . . . . 30.32 107.261 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -96.29 137.97 34.58 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 113.614 0.968 . . . . 30.0 113.614 -174.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.7 m -88.17 145.23 7.73 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 O-C-N 120.821 -1.174 . . . . 14.12 108.851 175.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.2 p30 -96.86 6.41 48.7 Favored 'General case' 0 C--O 1.239 0.532 0 O-C-N 120.25 -1.531 . . . . 20.73 113.75 -175.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.0 ptt-85 -155.12 162.39 41.01 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 123.939 0.896 . . . . 41.19 109.958 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.59 132.66 45.81 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 107.262 -1.385 . . . . 11.07 107.262 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.7 t -114.45 106.32 52.68 Favored Pre-proline 0 N--CA 1.45 -0.427 0 N-CA-C 106.461 -1.681 . . . . 11.27 106.461 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PRO . . . . . 0.533 ' HA ' HD23 ' A' ' 10' ' ' LEU . 31.4 Cg_exo -63.64 151.09 86.68 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.643 2.895 . . . . 13.16 113.644 175.121 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 23.7 tp -45.61 130.75 8.96 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-O 123.213 1.482 . . . . 15.32 111.16 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.59 1.25 87.71 Favored Glycine 0 N--CA 1.442 -0.952 0 CA-C-O 117.119 -1.934 . . . . 9.58 112.825 177.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.6 m -85.41 139.47 31.51 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 121.696 2.748 . . . . 11.68 110.434 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.4 m -71.53 130.1 40.4 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 123.556 0.535 . . . . 11.0 110.507 174.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.9 mp -77.19 122.52 25.14 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.862 0.839 . . . . 23.04 109.018 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.2 mmt -101.94 156.67 34.93 Favored Pre-proline 0 C--O 1.247 0.971 0 CA-C-O 118.479 -0.772 . . . . 19.1 110.836 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -50.14 -42.91 44.98 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 124.596 3.531 . . . . 11.9 115.077 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -70.8 -4.05 22.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 115.543 1.683 . . . . 18.89 115.543 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 64.7 mtt -95.48 -10.75 28.92 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 120.303 -1.498 . . . . 15.02 112.265 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 46.8 t -112.12 121.59 64.83 Favored 'Isoleucine or valine' 0 C--O 1.242 0.681 0 O-C-N 119.838 -1.789 . . . . 17.98 108.602 -175.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -68.61 125.62 27.1 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.565 -0.743 . . . . 34.53 110.295 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.42 -0.06 85.01 Favored Glycine 0 CA--C 1.52 0.367 0 O-C-N 120.718 -1.239 . . . . 21.08 113.672 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -77.91 124.2 27.71 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 119.904 1.852 . . . . 31.31 109.461 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -148.4 126.46 12.06 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 100.653 -3.832 . . . . 45.99 100.653 171.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 101.285 -3.598 . . . . 51.06 101.285 -177.318 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.538 1 N-CA-C 98.39 -4.67 . . . . 41.979999999999997 98.39 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . -134.16 -24.94 1.6 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.021 -0.733 . . . . 37.039999999999999 109.021 177.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -72.17 128.75 36.65 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 119.876 -1.765 . . . . 34.460000000000001 109.908 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -96.94 144.83 26.48 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 113.838 -1.528 . . . . 16.629999999999999 108.734 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.0 m -115.25 165.3 13.09 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 122.371 1.081 . . . . 12.69 110.504 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.8 t -77.56 127.99 38.18 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 106.45 -1.685 . . . . 10.9 106.45 173.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 55.3 t -127.83 136.99 58.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.045 -1.465 . . . . 11.82 107.045 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.92 123.32 18.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 122.079 0.943 . . . . 9.6799999999999997 111.093 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.43 HD22 HH11 ' A' ' 23' ' ' ARG . 11.4 t-20 -89.28 -5.73 57.35 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 123.598 0.759 . . . . 18.379999999999999 111.584 -179.303 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -158.99 171.71 19.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 105.934 -1.876 . . . . 27.899999999999999 105.934 175.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.533 HD23 ' HA ' ' A' ' 50' ' ' PRO . 1.9 tm? -69.4 126.75 30.71 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.457 -2.053 . . . . 18.609999999999999 105.457 175.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.3 mt -102.67 108.06 56.53 Favored Pre-proline 0 N--CA 1.444 -0.75 0 N-CA-C 104.9 -2.259 . . . . 10.81 104.9 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -61.93 154.35 62.18 Favored 'Trans proline' 0 C--O 1.246 0.88 0 C-N-CA 123.496 2.797 . . . . 12.44 111.176 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.1 tt -56.77 139.74 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-O 123.207 1.479 . . . . 13.720000000000001 108.88 178.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.0 m120 70.65 10.24 7.05 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 115.832 1.79 . . . . 25.489999999999998 115.832 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.6 m -72.77 139.87 47.37 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.027 -1.045 . . . . 19.059999999999999 113.071 173.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 87.3 mtt-85 -82.25 130.06 35.0 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 104.581 -2.377 . . . . 41.109999999999999 104.581 173.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.9 mt -68.05 136.99 54.67 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 121.098 -1.001 . . . . 16.289999999999999 113.545 -175.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.2 p -118.84 164.34 15.55 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 107.45 -1.315 . . . . 13.710000000000001 107.45 172.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 26.6 mt -57.91 -34.43 69.83 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 115.446 1.647 . . . . 20.98 115.446 -179.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.93 -10.75 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-N 120.5 1.5 . . . . 21.68 112.309 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 66.3 mtt -84.65 -6.86 59.38 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 120.519 -1.363 . . . . 12.24 114.151 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 57.7 mtm -128.3 123.05 33.08 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 120.876 -1.14 . . . . 15.130000000000001 113.473 -169.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.43 HH11 HD22 ' A' ' 8' ' ' ASN . 18.7 ptt180 -115.02 172.36 7.1 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.091 -1.078 . . . . 30.600000000000001 108.091 173.862 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.1 t -112.64 132.98 54.91 Favored 'General case' 0 N--CA 1.44 -0.925 0 N-CA-C 106.214 -1.773 . . . . 17.23 106.214 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.9 tt0 -155.28 146.31 22.57 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 117.63 -1.176 . . . . 23.57 111.688 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 22.1 m -91.58 114.63 29.1 Favored 'Isoleucine or valine' 0 C--N 1.344 0.369 0 N-CA-C 103.265 -2.865 . . . . 23.25 103.265 -179.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.5 m -136.95 159.64 36.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 107.277 -1.379 . . . . 15.380000000000001 107.277 -173.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.6 m -129.17 133.13 24.83 Favored Pre-proline 0 N--CA 1.449 -0.48 0 N-CA-C 105.414 -2.069 . . . . 24.920000000000002 105.414 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -64.34 164.21 54.97 Favored 'Cis proline' 0 CA--C 1.535 0.533 0 CA-C-N 122.969 2.096 . . . . 18.07 116.653 -8.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.2 t -79.29 144.54 10.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 106.905 -1.517 . . . . 18.780000000000001 106.905 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -115.58 -145.88 8.66 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.135 -1.186 . . . . 12.0 110.135 176.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 86.4 mt -63.8 133.78 95.68 Favored Pre-proline 0 C--N 1.324 -0.537 0 O-C-N 119.153 -2.38 . . . . 15.34 108.922 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -58.17 135.66 69.76 Favored 'Trans proline' 0 CA--C 1.509 -0.744 1 C-N-CA 125.357 4.038 . . . . 17.420000000000002 109.797 -176.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.54 -29.4 36.6 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 123.086 1.422 . . . . 17.91 113.581 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -60.47 -29.43 69.05 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 113.942 -1.481 . . . . 38.789999999999999 112.277 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -79.84 -1.47 39.13 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 116.775 -1.583 . . . . 31.109999999999999 115.0 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.2 mt -49.86 -45.82 80.44 Favored Pre-proline 0 N--CA 1.471 0.613 0 CA-C-N 122.368 2.349 . . . . 17.539999999999999 112.561 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -42.43 -50.61 5.54 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 124.307 3.338 . . . . 20.280000000000001 116.901 169.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.4 -10.35 59.49 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 114.425 -1.261 . . . . 20.210000000000001 114.371 -176.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 84.2 mt -92.04 -19.16 22.65 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 116.051 1.871 . . . . 18.420000000000002 116.051 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.54 132.68 26.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 O-C-N 120.547 -1.346 . . . . 20.640000000000001 108.698 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.2 m 79.1 -0.28 2.35 Favored 'General case' 0 CA--C 1.498 -1.022 0 C-N-CA 126.916 2.086 . . . . 29.59 113.728 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 65.5 mtp -87.01 148.69 25.19 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.261 -1.385 . . . . 30.32 107.261 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -96.29 137.97 34.58 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 113.614 0.968 . . . . 30.0 113.614 -174.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.7 m -88.17 145.23 7.73 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 O-C-N 120.821 -1.174 . . . . 14.119999999999999 108.851 175.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.2 p30 -96.86 6.41 48.7 Favored 'General case' 0 C--O 1.239 0.532 0 O-C-N 120.25 -1.531 . . . . 20.73 113.75 -175.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.0 ptt-85 -155.12 162.39 41.01 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 123.939 0.896 . . . . 41.189999999999998 109.958 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.59 132.66 45.81 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 107.262 -1.385 . . . . 11.07 107.262 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.7 t -114.45 106.32 52.68 Favored Pre-proline 0 N--CA 1.45 -0.427 0 N-CA-C 106.461 -1.681 . . . . 11.27 106.461 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.533 ' HA ' HD23 ' A' ' 10' ' ' LEU . 31.4 Cg_exo -63.64 151.09 86.68 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 123.643 2.895 . . . . 13.16 113.644 175.121 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 23.7 tp -45.61 130.75 8.96 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-O 123.213 1.482 . . . . 15.32 111.16 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.59 1.25 87.71 Favored Glycine 0 N--CA 1.442 -0.952 0 CA-C-O 117.119 -1.934 . . . . 9.5800000000000001 112.825 177.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.6 m -85.41 139.47 31.51 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 121.696 2.748 . . . . 11.68 110.434 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.4 m -71.53 130.1 40.4 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 123.556 0.535 . . . . 11.0 110.507 174.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.9 mp -77.19 122.52 25.14 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.862 0.839 . . . . 23.039999999999999 109.018 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.2 mmt -101.94 156.67 34.93 Favored Pre-proline 0 C--O 1.247 0.971 0 CA-C-O 118.479 -0.772 . . . . 19.100000000000001 110.836 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -50.14 -42.91 44.98 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 124.596 3.531 . . . . 11.9 115.077 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -70.8 -4.05 22.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 115.543 1.683 . . . . 18.890000000000001 115.543 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 64.7 mtt -95.48 -10.75 28.92 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 120.303 -1.498 . . . . 15.02 112.265 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 46.8 t -112.12 121.59 64.83 Favored 'Isoleucine or valine' 0 C--O 1.242 0.681 0 O-C-N 119.838 -1.789 . . . . 17.98 108.602 -175.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -68.61 125.62 27.1 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.565 -0.743 . . . . 34.530000000000001 110.295 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.42 -0.06 85.01 Favored Glycine 0 CA--C 1.52 0.367 0 O-C-N 120.718 -1.239 . . . . 21.079999999999998 113.672 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -77.91 124.2 27.71 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 119.904 1.852 . . . . 31.309999999999999 109.461 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -148.4 126.46 12.06 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 100.653 -3.832 . . . . 45.990000000000002 100.653 171.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 101.285 -3.598 . . . . 51.060000000000002 101.285 -177.318 . . . . . . . . 0 0 . 1 stop_ save_