data_4rcc_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 4rcc _Structure_validation_residue.Date_analyzed 2016-10-12 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 ' 5' ' ' GLN . . . . . 0.494 ' N ' ' O ' ' A' ' 105' ' ' HOH . 1.6 mt-30 . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 114.547 1.314 . . . . 47.8 114.547 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.5 t 168.82 -33.26 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 131.326 3.85 . . . . 44.13 105.872 -8.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.5 mt -91.03 -39.69 12.06 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.441 -0.799 . . . . 30.62 109.615 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -49.0 -48.01 43.91 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 115.226 1.565 . . . . 26.96 115.226 177.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 91.9 m-20 -68.41 -50.99 25.41 Favored Pre-proline 0 C--O 1.22 -0.481 0 CA-C-N 115.624 -0.716 . . . . 45.43 111.856 -167.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -59.6 -35.91 93.99 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 115.524 -2.517 . . . . 23.94 114.934 172.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -65.92 -52.27 51.38 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.445 -0.502 . . . . 23.7 110.94 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.9 mt -67.19 -37.59 83.95 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.162 0.431 . . . . 20.91 112.162 -179.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASN . . . . . 0.411 ' OD1' ' NH2' ' A' ' 16' ' ' ARG . 23.0 m-20 -62.17 -37.35 84.92 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.257 0.836 . . . . 32.04 113.257 176.109 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.79 85.7 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 109.434 -0.58 . . . . 22.17 109.434 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.98 -41.49 96.52 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.08 -0.509 . . . . 20.55 111.72 175.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ARG . . . . . 0.411 ' NH2' ' OD1' ' A' ' 13' ' ' ASN . 58.8 ttp85 -67.98 -49.19 63.13 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 109.498 -0.556 . . . . 36.56 109.498 -175.283 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -64.82 -41.02 96.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.553 -0.749 . . . . 47.18 112.613 -177.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -83.33 -5.96 59.31 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 122.453 -0.155 . . . . 44.89 111.213 -178.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 41.7 mtp85 53.41 46.55 26.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.976 0.893 . . . . 29.82 110.391 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 72.9 t -79.11 125.31 83.85 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 114.909 -1.041 . . . . 27.19 110.859 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -57.59 133.28 55.59 Favored 'Trans proline' 0 CA--C 1.532 0.42 0 O-C-N 122.624 0.802 . . . . 23.76 110.617 170.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.0 m -125.12 161.74 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 CA-C-O 121.478 0.656 . . . . 21.85 111.335 177.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.3 m -110.02 127.27 54.72 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 105.637 -1.986 . . . . 22.73 105.637 166.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 42.6 mt -106.61 120.51 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 N-CA-C 106.385 -1.709 . . . . 20.05 106.385 172.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 -98.72 132.34 44.18 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.404 -0.591 . . . . 31.13 109.404 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 65.9 mt -91.95 170.55 9.77 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.359 -0.382 . . . . 21.72 110.835 -175.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.9 m -69.05 -6.56 6.3 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 N-CA-C 113.034 0.753 . . . . 31.13 113.034 -176.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASN . . . . . 0.783 ' ND2' ' O ' ' A' ' 115' ' ' HOH . 31.9 p30 -105.33 10.14 33.61 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.332 0.493 . . . . 31.9 112.332 176.39 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.56 -4.17 86.4 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 116.963 1.545 . . . . 27.44 116.963 -177.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 36.4 mm -76.8 134.9 27.8 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 CA-C-N 118.312 1.056 . . . . 29.39 110.794 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.1 ttpt -99.77 127.0 45.93 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.533 -0.758 . . . . 37.15 112.148 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 70.6 mt -106.41 150.59 25.88 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.228 -1.027 . . . . 24.33 108.228 172.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -134.39 153.04 52.12 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 120.844 0.354 . . . . 40.33 110.167 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 151.03 -167.98 30.65 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 108.945 -1.662 . . . . 22.2 108.945 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -112.32 142.61 44.63 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.999 -0.741 . . . . 33.35 108.999 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 51.3 mt -73.56 114.76 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 109.361 -0.607 . . . . 22.4 109.361 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -86.2 -43.9 12.61 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.966 -0.561 . . . . 37.62 111.142 -177.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.7 p -165.9 173.24 10.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.817 -0.629 . . . . 27.85 110.189 170.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -157.82 158.78 35.83 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.632 -0.507 . . . . 24.28 109.632 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -133.39 -155.21 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.208 -1.405 . . . . 31.73 107.208 161.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -81.3 -3.24 51.94 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.146 -1.022 . . . . 29.79 112.932 -174.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -117.62 -35.47 3.95 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.032 0.753 . . . . 36.89 113.032 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.3 m -134.61 161.01 41.14 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.536 0 N-CA-C 113.279 0.844 . . . . 20.52 113.279 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.2 mt -120.06 132.13 70.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.713 0 CA-C-N 114.56 -1.2 . . . . 19.37 109.326 167.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 mt -92.47 119.03 31.58 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.203 0.525 . . . . 29.48 109.767 172.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.7 tp -113.9 121.69 44.71 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.229 -0.896 . . . . 22.9 109.339 -172.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . 0.455 ' NZ ' ' O ' ' A' ' 112' ' ' HOH . 10.1 tptm -104.25 129.81 52.06 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.545 0.572 . . . . 36.74 112.545 -170.957 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . 0.664 ' O ' ' O ' ' A' ' 114' ' ' HOH . 2.7 t30 -139.34 -107.12 0.17 Allowed 'General case' 0 C--O 1.188 -2.172 0 C-N-CA 125.498 1.519 . . . . 53.37 110.968 156.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.6 m -70.74 -41.23 72.1 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 120.283 1.401 . . . . 47.57 111.327 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 34.7 m -123.64 163.89 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 108.151 -1.055 . . . . 30.95 108.151 170.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 71.6 m -82.41 123.58 29.25 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.08 -1.452 . . . . 33.25 107.08 170.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -110.86 149.11 31.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 119.439 -0.905 . . . . 25.69 109.547 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 62.3 ttp -103.02 113.26 26.58 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 120.195 -0.602 . . . . 22.37 109.969 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.4 t -100.83 126.66 54.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 CA-C-N 115.645 -0.707 . . . . 16.21 111.932 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -79.58 124.01 28.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.631 0.253 . . . . 23.31 110.353 177.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -57.21 -29.77 64.02 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 112.959 0.726 . . . . 29.06 112.959 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -66.94 -15.34 63.62 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 119.127 -1.029 . . . . 17.34 111.11 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -103.9 4.01 34.33 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.145 0.497 . . . . 15.32 111.993 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 77.8 mt -92.67 134.2 31.44 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 CA-C-O 121.07 0.462 . . . . 17.03 111.511 176.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.7 p -97.42 -45.45 6.45 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.26 -0.576 . . . . 25.74 112.38 171.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.7 t -151.38 142.44 23.11 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.016 0.747 . . . . 24.96 113.016 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 63.3 t -110.72 119.35 59.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.623 0 N-CA-C 108.563 -0.903 . . . . 19.02 108.563 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 24.1 t -119.22 105.25 44.8 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.146 -0.933 . . . . 18.87 111.114 -171.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -63.77 146.8 92.39 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 120.415 0.743 . . . . 21.42 110.81 177.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 55.5 p -77.55 -11.45 59.86 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.878 0.371 . . . . 26.48 110.556 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.3 ptt85 -154.75 161.48 29.29 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 119.966 -0.694 . . . . 37.27 109.272 174.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -60.24 133.9 52.48 Favored 'Trans proline' 0 C--N 1.354 0.816 0 O-C-N 122.808 0.899 . . . . 35.96 112.615 -174.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 43.9 t -134.28 131.33 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 N-CA-C 107.086 -1.449 . . . . 41.38 107.086 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 30.9 t -86.66 143.38 27.63 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 123.234 0.334 . . . . 45.1 111.314 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.0 p80 . . . . . 0 C--O 1.24 0.584 0 CA-C-O 120.937 0.398 . . . . 43.34 111.979 179.307 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . 0.494 ' O ' ' N ' ' A' ' 5' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . 0.455 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . 0.664 ' O ' ' O ' ' A' ' 48' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . 0.783 ' O ' ' ND2' ' A' ' 28' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLN . . . . . 0.62 ' HA ' ' HB2' ' A' ' 6' ' ' SER . 1.6 mt-30 . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 114.547 1.314 . . . . 47.799999999999997 114.547 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' SER . . . . . 0.62 ' HB2' ' HA ' ' A' ' 5' ' ' GLN . 11.5 t 168.82 -33.26 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 131.326 3.85 . . . . 44.130000000000003 105.872 -8.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.5 mt -91.03 -39.69 12.06 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.441 -0.799 . . . . 30.620000000000001 109.615 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -49.0 -48.01 43.91 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 115.226 1.565 . . . . 26.960000000000001 115.226 177.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 91.9 m-20 -68.41 -50.99 25.41 Favored Pre-proline 0 C--O 1.22 -0.481 0 CA-C-N 115.624 -0.716 . . . . 45.43 111.856 -167.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -59.6 -35.91 93.99 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 115.524 -2.517 . . . . 23.940000000000001 114.934 172.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -65.92 -52.27 51.38 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.445 -0.502 . . . . 23.699999999999999 110.94 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.9 mt -67.19 -37.59 83.95 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.162 0.431 . . . . 20.91 112.162 -179.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.0 m-20 -62.17 -37.35 84.92 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.257 0.836 . . . . 32.039999999999999 113.257 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.79 85.7 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 109.434 -0.58 . . . . 22.170000000000002 109.434 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . 0.46 HD13 HG11 ' A' ' 22' ' ' VAL . 81.6 mt -60.98 -41.49 96.52 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.08 -0.509 . . . . 20.550000000000001 111.72 175.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 58.8 ttp85 -67.98 -49.19 63.13 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 109.498 -0.556 . . . . 36.560000000000002 109.498 -175.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -64.82 -41.02 96.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.553 -0.749 . . . . 47.18 112.613 -177.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . 0.435 ' HB2' HG23 ' A' ' 20' ' ' VAL . 74.1 mm-40 -83.33 -5.96 59.31 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 122.453 -0.155 . . . . 44.890000000000001 111.213 -178.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 41.7 mtp85 53.41 46.55 26.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.976 0.893 . . . . 29.82 110.391 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . 0.435 HG23 ' HB2' ' A' ' 18' ' ' GLU . 72.9 t -79.11 125.31 83.85 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 114.909 -1.041 . . . . 27.190000000000001 110.859 177.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -57.59 133.28 55.59 Favored 'Trans proline' 0 CA--C 1.532 0.42 0 O-C-N 122.624 0.802 . . . . 23.760000000000002 110.617 170.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . 0.46 HG11 HD13 ' A' ' 15' ' ' LEU . 31.0 m -125.12 161.74 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 CA-C-O 121.478 0.656 . . . . 21.850000000000001 111.335 177.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.3 m -110.02 127.27 54.72 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 105.637 -1.986 . . . . 22.73 105.637 166.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 42.6 mt -106.61 120.51 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 N-CA-C 106.385 -1.709 . . . . 20.050000000000001 106.385 172.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 -98.72 132.34 44.18 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.404 -0.591 . . . . 31.129999999999999 109.404 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 65.9 mt -91.95 170.55 9.77 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.359 -0.382 . . . . 21.719999999999999 110.835 -175.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.9 m -69.05 -6.56 6.3 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 N-CA-C 113.034 0.753 . . . . 31.129999999999999 113.034 -176.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 31.9 p30 -105.33 10.14 33.61 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.332 0.493 . . . . 31.899999999999999 112.332 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.56 -4.17 86.4 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 116.963 1.545 . . . . 27.440000000000001 116.963 -177.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 36.4 mm -76.8 134.9 27.8 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 CA-C-N 118.312 1.056 . . . . 29.390000000000001 110.794 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.1 ttpt -99.77 127.0 45.93 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.533 -0.758 . . . . 37.149999999999999 112.148 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 70.6 mt -106.41 150.59 25.88 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.228 -1.027 . . . . 24.329999999999998 108.228 172.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -134.39 153.04 52.12 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 120.844 0.354 . . . . 40.329999999999998 110.167 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 151.03 -167.98 30.65 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 108.945 -1.662 . . . . 22.199999999999999 108.945 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -112.32 142.61 44.63 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.999 -0.741 . . . . 33.350000000000001 108.999 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 51.3 mt -73.56 114.76 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 109.361 -0.607 . . . . 22.399999999999999 109.361 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -86.2 -43.9 12.61 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.966 -0.561 . . . . 37.619999999999997 111.142 -177.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.7 p -165.9 173.24 10.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.817 -0.629 . . . . 27.850000000000001 110.189 170.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -157.82 158.78 35.83 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.632 -0.507 . . . . 24.280000000000001 109.632 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -133.39 -155.21 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.208 -1.405 . . . . 31.73 107.208 161.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -81.3 -3.24 51.94 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.146 -1.022 . . . . 29.789999999999999 112.932 -174.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -117.62 -35.47 3.95 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.032 0.753 . . . . 36.890000000000001 113.032 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.3 m -134.61 161.01 41.14 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.536 0 N-CA-C 113.279 0.844 . . . . 20.52 113.279 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.2 mt -120.06 132.13 70.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.713 0 CA-C-N 114.56 -1.2 . . . . 19.370000000000001 109.326 167.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 mt -92.47 119.03 31.58 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.203 0.525 . . . . 29.48 109.767 172.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.7 tp -113.9 121.69 44.71 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.229 -0.896 . . . . 22.899999999999999 109.339 -172.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . 0.455 ' NZ ' ' O ' ' A' ' 112' ' ' HOH . 10.1 tptm -104.25 129.81 52.06 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.545 0.572 . . . . 36.740000000000002 112.545 -170.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . 0.664 ' O ' ' O ' ' A' ' 114' ' ' HOH . 2.7 t30 -139.34 -107.12 0.17 Allowed 'General case' 0 C--O 1.188 -2.172 0 C-N-CA 125.498 1.519 . . . . 53.369999999999997 110.968 156.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.6 m -70.74 -41.23 72.1 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 120.283 1.401 . . . . 47.57 111.327 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 34.7 m -123.64 163.89 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 108.151 -1.055 . . . . 30.949999999999999 108.151 170.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 71.6 m -82.41 123.58 29.25 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.08 -1.452 . . . . 33.25 107.08 170.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -110.86 149.11 31.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 119.439 -0.905 . . . . 25.690000000000001 109.547 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 62.3 ttp -103.02 113.26 26.58 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 120.195 -0.602 . . . . 22.370000000000001 109.969 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.4 t -100.83 126.66 54.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 CA-C-N 115.645 -0.707 . . . . 16.210000000000001 111.932 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -79.58 124.01 28.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.631 0.253 . . . . 23.309999999999999 110.353 177.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -57.21 -29.77 64.02 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 112.959 0.726 . . . . 29.059999999999999 112.959 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -66.94 -15.34 63.62 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 119.127 -1.029 . . . . 17.34 111.11 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -103.9 4.01 34.33 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.145 0.497 . . . . 15.32 111.993 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 77.8 mt -92.67 134.2 31.44 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 CA-C-O 121.07 0.462 . . . . 17.030000000000001 111.511 176.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.7 p -97.42 -45.45 6.45 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.26 -0.576 . . . . 25.739999999999998 112.38 171.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.7 t -151.38 142.44 23.11 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.016 0.747 . . . . 24.960000000000001 113.016 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 63.3 t -110.72 119.35 59.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.623 0 N-CA-C 108.563 -0.903 . . . . 19.02 108.563 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 24.1 t -119.22 105.25 44.8 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.146 -0.933 . . . . 18.870000000000001 111.114 -171.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -63.77 146.8 92.39 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 120.415 0.743 . . . . 21.420000000000002 110.81 177.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 55.5 p -77.55 -11.45 59.86 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.878 0.371 . . . . 26.48 110.556 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.3 ptt85 -154.75 161.48 29.29 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 119.966 -0.694 . . . . 37.270000000000003 109.272 174.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -60.24 133.9 52.48 Favored 'Trans proline' 0 C--N 1.354 0.816 0 O-C-N 122.808 0.899 . . . . 35.960000000000001 112.615 -174.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 43.9 t -134.28 131.33 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 N-CA-C 107.086 -1.449 . . . . 41.380000000000003 107.086 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 30.9 t -86.66 143.38 27.63 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 123.234 0.334 . . . . 45.100000000000001 111.314 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.0 p80 . . . . . 0 C--O 1.24 0.584 0 CA-C-O 120.937 0.398 . . . . 43.340000000000003 111.979 179.307 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . 0.494 ' O ' ' N ' ' A' ' 5' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . 0.455 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . 0.664 ' O ' ' O ' ' A' ' 48' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.62 ' HA ' ' HB2' ' A' ' 6' ' ' SER . 1.6 mt-30 . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 114.547 1.314 . . . . 47.799999999999997 114.547 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' SER . . . . . 0.62 ' HB2' ' HA ' ' A' ' 5' ' ' GLN . 11.5 t 168.82 -33.26 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 131.326 3.85 . . . . 44.130000000000003 105.872 -8.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.5 mt -91.03 -39.69 12.06 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.441 -0.799 . . . . 30.620000000000001 109.615 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -49.0 -48.01 43.91 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 115.226 1.565 . . . . 26.960000000000001 115.226 177.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 91.9 m-20 -68.41 -50.99 25.41 Favored Pre-proline 0 C--O 1.22 -0.481 0 CA-C-N 115.624 -0.716 . . . . 45.43 111.856 -167.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -59.6 -35.91 93.99 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 115.524 -2.517 . . . . 23.940000000000001 114.934 172.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -65.92 -52.27 51.38 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.445 -0.502 . . . . 23.699999999999999 110.94 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.9 mt -67.19 -37.59 83.95 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.162 0.431 . . . . 20.91 112.162 -179.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.0 m-20 -62.17 -37.35 84.92 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.257 0.836 . . . . 32.039999999999999 113.257 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.79 85.7 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 109.434 -0.58 . . . . 22.170000000000002 109.434 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.46 HD13 HG11 ' A' ' 22' ' ' VAL . 81.6 mt -60.98 -41.49 96.52 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.08 -0.509 . . . . 20.550000000000001 111.72 175.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 58.8 ttp85 -67.98 -49.19 63.13 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 109.498 -0.556 . . . . 36.560000000000002 109.498 -175.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -64.82 -41.02 96.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.553 -0.749 . . . . 47.18 112.613 -177.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.435 ' HB2' HG23 ' A' ' 20' ' ' VAL . 74.1 mm-40 -83.33 -5.96 59.31 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 122.453 -0.155 . . . . 44.890000000000001 111.213 -178.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 41.7 mtp85 53.41 46.55 26.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.976 0.893 . . . . 29.82 110.391 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.435 HG23 ' HB2' ' A' ' 18' ' ' GLU . 72.9 t -79.11 125.31 83.85 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 114.909 -1.041 . . . . 27.190000000000001 110.859 177.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -57.59 133.28 55.59 Favored 'Trans proline' 0 CA--C 1.532 0.42 0 O-C-N 122.624 0.802 . . . . 23.760000000000002 110.617 170.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.46 HG11 HD13 ' A' ' 15' ' ' LEU . 31.0 m -125.12 161.74 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 CA-C-O 121.478 0.656 . . . . 21.850000000000001 111.335 177.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.3 m -110.02 127.27 54.72 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 105.637 -1.986 . . . . 22.73 105.637 166.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 42.6 mt -106.61 120.51 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 N-CA-C 106.385 -1.709 . . . . 20.050000000000001 106.385 172.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 -98.72 132.34 44.18 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.404 -0.591 . . . . 31.129999999999999 109.404 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 65.9 mt -91.95 170.55 9.77 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.359 -0.382 . . . . 21.719999999999999 110.835 -175.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.9 m -69.05 -6.56 6.3 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 N-CA-C 113.034 0.753 . . . . 31.129999999999999 113.034 -176.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 31.9 p30 -105.33 10.14 33.61 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.332 0.493 . . . . 31.899999999999999 112.332 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.56 -4.17 86.4 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 116.963 1.545 . . . . 27.440000000000001 116.963 -177.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 36.4 mm -76.8 134.9 27.8 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 CA-C-N 118.312 1.056 . . . . 29.390000000000001 110.794 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.1 ttpt -99.77 127.0 45.93 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.533 -0.758 . . . . 37.149999999999999 112.148 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 70.6 mt -106.41 150.59 25.88 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.228 -1.027 . . . . 24.329999999999998 108.228 172.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -134.39 153.04 52.12 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 120.844 0.354 . . . . 40.329999999999998 110.167 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 151.03 -167.98 30.65 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 108.945 -1.662 . . . . 22.199999999999999 108.945 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -112.32 142.61 44.63 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.999 -0.741 . . . . 33.350000000000001 108.999 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 51.3 mt -73.56 114.76 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 109.361 -0.607 . . . . 22.399999999999999 109.361 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -86.2 -43.9 12.61 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.966 -0.561 . . . . 37.619999999999997 111.142 -177.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.7 p -165.9 173.24 10.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.817 -0.629 . . . . 27.850000000000001 110.189 170.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -157.82 158.78 35.83 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.632 -0.507 . . . . 24.280000000000001 109.632 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -133.39 -155.21 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.208 -1.405 . . . . 31.73 107.208 161.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -81.3 -3.24 51.94 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.146 -1.022 . . . . 29.789999999999999 112.932 -174.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -117.62 -35.47 3.95 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.032 0.753 . . . . 36.890000000000001 113.032 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.3 m -134.61 161.01 41.14 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.536 0 N-CA-C 113.279 0.844 . . . . 20.52 113.279 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.2 mt -120.06 132.13 70.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.713 0 CA-C-N 114.56 -1.2 . . . . 19.370000000000001 109.326 167.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 mt -92.47 119.03 31.58 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.203 0.525 . . . . 29.48 109.767 172.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.7 tp -113.9 121.69 44.71 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.229 -0.896 . . . . 22.899999999999999 109.339 -172.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.455 ' NZ ' ' O ' ' A' ' 112' ' ' HOH . 10.1 tptm -104.25 129.81 52.06 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.545 0.572 . . . . 36.740000000000002 112.545 -170.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.664 ' O ' ' O ' ' A' ' 114' ' ' HOH . 2.7 t30 -139.34 -107.12 0.17 Allowed 'General case' 0 C--O 1.188 -2.172 0 C-N-CA 125.498 1.519 . . . . 53.369999999999997 110.968 156.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.6 m -70.74 -41.23 72.1 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 120.283 1.401 . . . . 47.57 111.327 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 34.7 m -123.64 163.89 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 108.151 -1.055 . . . . 30.949999999999999 108.151 170.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 71.6 m -82.41 123.58 29.25 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.08 -1.452 . . . . 33.25 107.08 170.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -110.86 149.11 31.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 119.439 -0.905 . . . . 25.690000000000001 109.547 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 62.3 ttp -103.02 113.26 26.58 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 120.195 -0.602 . . . . 22.370000000000001 109.969 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.4 t -100.83 126.66 54.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 CA-C-N 115.645 -0.707 . . . . 16.210000000000001 111.932 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -79.58 124.01 28.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.631 0.253 . . . . 23.309999999999999 110.353 177.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -57.21 -29.77 64.02 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 112.959 0.726 . . . . 29.059999999999999 112.959 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -66.94 -15.34 63.62 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 119.127 -1.029 . . . . 17.34 111.11 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -103.9 4.01 34.33 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.145 0.497 . . . . 15.32 111.993 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 77.8 mt -92.67 134.2 31.44 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 CA-C-O 121.07 0.462 . . . . 17.030000000000001 111.511 176.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.7 p -97.42 -45.45 6.45 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.26 -0.576 . . . . 25.739999999999998 112.38 171.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.7 t -151.38 142.44 23.11 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.016 0.747 . . . . 24.960000000000001 113.016 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 63.3 t -110.72 119.35 59.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.623 0 N-CA-C 108.563 -0.903 . . . . 19.02 108.563 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 24.1 t -119.22 105.25 44.8 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.146 -0.933 . . . . 18.870000000000001 111.114 -171.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -63.77 146.8 92.39 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 120.415 0.743 . . . . 21.420000000000002 110.81 177.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 55.5 p -77.55 -11.45 59.86 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.878 0.371 . . . . 26.48 110.556 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.3 ptt85 -154.75 161.48 29.29 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 119.966 -0.694 . . . . 37.270000000000003 109.272 174.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -60.24 133.9 52.48 Favored 'Trans proline' 0 C--N 1.354 0.816 0 O-C-N 122.808 0.899 . . . . 35.960000000000001 112.615 -174.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 43.9 t -134.28 131.33 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 N-CA-C 107.086 -1.449 . . . . 41.380000000000003 107.086 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 30.9 t -86.66 143.38 27.63 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 123.234 0.334 . . . . 45.100000000000001 111.314 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.0 p80 . . . . . 0 C--O 1.24 0.584 0 CA-C-O 120.937 0.398 . . . . 43.340000000000003 111.979 179.307 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . 0.494 ' O ' ' N ' ' A' ' 5' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . 0.455 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . 0.664 ' O ' ' O ' ' A' ' 48' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_