data_2erg_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 2erg _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 ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O5'-C5'-C4' 113.032 2.023 . . . . 118.7 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 N19-C1'-C2' 117.44 2.025 . . . . 88.07 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.407 -2.061 0 P-O5'-C5' 117.642 -2.036 . . . . 56.94 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.717 0 O4'-C1'-N19 105.686 -2.642 . . . . 84.87 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.419 -1.29 0 N19-C1'-C2' 117.461 2.038 . . . . 78.92 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.171 0 C5'-C4'-C3' 111.039 -2.441 . . . . 90.37 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.595 -0.992 0 N19-C1'-C2' 116.635 1.522 . . . . 106.52 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' ' DT' . . . . . 0.568 " C2'" ' C8 ' ' C' ' 9' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.403 -2.333 1 C5'-C4'-C3' 108.606 -4.063 . . . . 104.05 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' ' DA' . . . . . 0.568 ' C8 ' " C2'" ' C' ' 8' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.412 -1.478 0 P-O3'-C3' 117.505 -1.829 . . . . 59.95 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.657 0 O4'-C1'-N19 106.177 -2.029 . . . . 59.45 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ' DC' . . . . . 0.675 ' OP1' ' N ' ' B' ' 79' ' ' ARG . . . . . . . . 0 O5'--C5' 1.412 -1.729 0 C4'-C3'-O3' 104.049 -2.842 . . . . 56.03 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ' DG' . . . . . 0.568 ' N7 ' ' NZ ' ' B' ' 44' ' ' LYS . . . . . . . . 0 O5'--C5' 1.42 -1.251 0 C5'-C4'-C3' 111.379 -2.214 . . . . 76.58 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.41 " C5'" " C2'" ' C' ' 12' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.409 -1.955 0 C5'-C4'-C3' 111.751 -1.966 . . . . 87.23 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.416 -1.516 0 C4'-C3'-O3' 106.874 -1.557 . . . . 89.46 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C5'-C4'-C3' 112.332 -1.578 . . . . 74.96 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.098 0 C5'-C4'-C3' 112.4 -1.533 . . . . 116.72 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' ' DT' . . . . . 0.414 " C2'" ' C8 ' ' D' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.401 -2.407 0 C5'-C4'-C3' 110.342 -2.905 . . . . 82.83 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' ' DG' . . . . . 0.414 ' C8 ' " C2'" ' D' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.397 -2.681 0 C5'-C4'-C3' 111.746 -1.97 . . . . 64.48 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.404 -2.247 0 O4'-C1'-N19 105.78 -2.526 . . . . 76.49 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.591 -1.31 0 N19-C1'-C2' 118.325 2.578 . . . . 82.16 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.943 0 O3'-P-O5' 101.43 -1.353 . . . . 87.74 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-C2' 107.385 1.168 . . . . 115.7 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' ' DT' . . . . . 0.556 " C2'" ' C8 ' ' D' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.402 -2.403 0 C5'-C4'-C3' 109.442 -3.505 . . . . 93.17 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' ' DA' . . . . . 0.556 ' C8 ' " C2'" ' D' ' 23' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.416 -1.116 0 P-O3'-C3' 117.766 -1.612 . . . . 63.16 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' ' DC' . . . . . 0.451 ' OP2' ' NE2' ' A' ' 43' ' ' GLN . . . . . . . . 0 O5'--C5' 1.409 -1.925 0 O4'-C1'-N19 106.488 -1.641 . . . . 58.87 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' ' DC' . . . . . 0.657 ' OP1' ' N ' ' A' ' 79' ' ' ARG . . . . . . . . 0 O5'--C5' 1.41 -1.89 0 C4'-C3'-O3' 104.921 -2.445 . . . . 58.62 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' ' DG' . . . . . 0.461 ' N7 ' ' NZ ' ' A' ' 44' ' ' LYS . . . . . . . . 0 O5'--C5' 1.417 -1.427 0 C5'-C4'-C3' 110.429 -2.847 . . . . 79.26 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' ' DG' . . . . . 0.435 " C5'" " C2'" ' D' ' 27' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.411 -1.827 0 C5'-C4'-C3' 111.448 -2.168 . . . . 87.21 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.417 -1.432 0 C5'-C4'-C3' 110.498 -2.802 . . . . 82.15 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.001 0 C2'-C3'-O3' 106.09 -1.67 . . . . 75.6 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PHE . . . . . 0.544 ' N ' ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.545 0 CA-C-O 120.811 0.339 . . . . 118.43 111.789 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -125.87 132.54 52.16 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 117.224 2.305 . . . . 73.72 117.224 -177.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 27.4 p -62.23 140.89 58.45 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 108.394 -0.965 . . . . 81.06 108.394 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 t -36.99 -61.73 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.755 0 N-CA-C 112.676 0.621 . . . . 80.88 112.676 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -49.74 -54.63 17.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 113.859 1.059 . . . . 96.34 113.859 -179.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.6 m -54.83 -37.94 66.76 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 119.299 -0.96 . . . . 73.29 110.454 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -61.6 -38.41 87.46 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.302 -0.863 . . . . 61.92 108.854 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -59.72 -52.97 63.21 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.825 -0.625 . . . . 56.48 110.706 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . 0.451 ' NE2' ' OP2' ' D' ' 25' ' ' ' DC' . 4.9 mp0 -89.17 11.33 18.97 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.925 0.713 . . . . 78.59 112.925 -179.432 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . 0.461 ' NZ ' ' N7 ' ' D' ' 27' ' ' ' DG' . 89.1 mttt 45.64 48.35 11.37 Favored 'General case' 0 CA--C 1.48 -1.743 0 N-CA-C 108.691 -0.855 . . . . 54.84 108.691 179.516 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.2 p -116.34 150.28 37.94 Favored 'General case' 0 CA--C 1.505 -0.774 0 C-N-CA 119.551 -0.86 . . . . 90.46 110.311 -177.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -49.5 120.78 4.42 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.058 -0.657 . . . . 91.0 109.242 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 16.5 t -111.0 133.46 53.37 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 102.699 -3.074 . . . . 72.97 102.699 178.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . . . -118.3 67.72 0.77 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.053 -0.659 . . . . 99.62 110.641 -179.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . 0.605 ' O ' ' C ' ' A' ' 50' ' ' CYS . . . -77.28 -84.11 0.07 Allowed 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.168 0.803 . . . . 99.0 113.168 -179.104 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' CYS . . . . . 0.605 ' C ' ' O ' ' A' ' 49' ' ' ALA . . . -25.29 -64.88 0.06 Allowed 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 106.525 -1.657 . . . . 119.5 106.525 179.836 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . 0.6 ' O ' ' N ' ' A' ' 53' ' ' ALA . 54.7 mp0 -37.81 -96.16 0.0 OUTLIER 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.29 -0.868 . . . . 173.67 109.852 179.469 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ARG . . . . . 0.445 ' O ' ' O ' ' A' ' 53' ' ' ALA . . . -54.07 76.85 0.0 OUTLIER 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.538 0.685 . . . . 116.79 111.059 -179.746 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . 0.6 ' N ' ' O ' ' A' ' 51' ' ' GLU . . . 0.2 -146.02 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 120.794 3.628 . . . . 128.9 120.794 179.609 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . . . -56.94 -20.39 36.33 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 122.191 1.927 . . . . 118.03 111.631 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . . . -65.37 124.87 88.28 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.567 -0.742 . . . . 130.41 109.443 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -40.92 153.22 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 124.489 3.459 . . . . 109.98 112.528 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' CYS . . . . . 0.433 ' SG ' ' N ' ' A' ' 60' ' ' CYS . 0.1 OUTLIER -48.7 146.69 2.97 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.775 -0.37 . . . . 95.03 110.794 -179.275 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . 0.516 ' O ' ' CB ' ' A' ' 61' ' ' ALA . 19.9 m -51.8 -63.85 1.0 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.66 0.985 . . . . 103.31 113.66 -179.21 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . . . -49.17 -39.28 28.63 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 109.716 -0.476 . . . . 112.52 109.716 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' CYS . . . . . 0.433 ' N ' ' SG ' ' A' ' 57' ' ' CYS . 28.6 m -64.44 -3.99 3.52 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.864 0.84 . . . . 94.28 110.451 179.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . 0.596 ' O ' ' N ' ' A' ' 64' ' ' ASN . . . -83.38 -72.66 0.44 Allowed 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 104.417 -2.438 . . . . 94.17 104.417 177.555 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . 0.537 ' C ' ' O ' ' A' ' 61' ' ' ALA . . . -35.18 -45.7 0.31 Allowed 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.635 -1.246 . . . . 88.13 107.635 179.622 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . . . -75.61 -33.19 60.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.771 -0.65 . . . . 79.07 112.279 -179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . 0.596 ' N ' ' O ' ' A' ' 61' ' ' ALA . 18.6 t-20 55.45 76.74 0.25 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 105.646 -1.983 . . . . 98.0 105.646 -177.977 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.4 m -143.5 163.12 38.56 Favored Pre-proline 0 N--CA 1.447 -0.587 0 N-CA-C 107.336 -1.357 . . . . 102.03 107.336 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -64.53 101.89 0.38 Allowed 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.168 1.912 . . . . 100.72 109.244 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.5 t -74.85 78.34 2.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.748 -0.66 . . . . 91.47 110.602 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . . . -75.37 155.54 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 112.357 0.503 . . . . 66.07 112.357 179.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.18 79.51 1.91 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.473 -0.33 . . . . 74.32 110.503 179.874 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . 0.552 ' O ' ' N ' ' A' ' 72' ' ' ASP . . . -102.4 78.91 1.78 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 120.103 -0.639 . . . . 81.63 111.511 -180.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . . . -31.44 -23.69 0.0 OUTLIER 'General case' 0 C--O 1.239 0.509 0 N-CA-C 115.254 1.575 . . . . 81.94 115.254 -179.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASP . . . . . 0.552 ' N ' ' O ' ' A' ' 70' ' ' LYS . 11.8 p-10 -99.88 26.46 6.31 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 112.164 0.431 . . . . 129.93 112.164 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PHE . . . . . 0.421 ' N ' ' O ' ' A' ' 70' ' ' LYS . 46.2 t80 -97.32 148.59 22.98 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.272 1.212 . . . . 104.37 114.272 -179.475 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -140.29 118.69 12.16 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.901 -0.591 . . . . 132.93 109.485 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -41.05 145.56 0.21 Allowed 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 114.189 1.181 . . . . 67.0 114.189 -178.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.9 m -91.2 136.61 32.97 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 106.697 -1.594 . . . . 86.02 106.697 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -86.96 67.94 9.93 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 119.855 -0.738 . . . . 53.2 111.048 179.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -26.83 -70.52 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 116.033 1.864 . . . . 78.58 116.033 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . 0.657 ' N ' ' OP1' ' D' ' 26' ' ' ' DC' . 3.0 tpp180 -41.2 -85.14 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 108.719 -0.845 . . . . 111.58 108.719 179.336 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -37.75 -46.45 0.91 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.491 0.922 . . . . 85.0 113.491 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . 0.463 ' O ' ' N ' ' A' ' 84' ' ' ALA . 0.0 OUTLIER -54.17 -76.2 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.943 -0.572 . . . . 97.96 110.704 -179.924 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASN . . . . . 0.443 ' N ' ' CD ' ' A' ' 81' ' ' ARG . 7.1 m120 -42.74 -33.61 0.77 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.724 -0.671 . . . . 106.99 110.9 -179.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -62.81 -39.56 94.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.426 0.631 . . . . 120.11 110.092 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' A' ' 81' ' ' ARG . . . -66.15 -58.39 5.53 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 104.898 -2.26 . . . . 78.54 104.898 177.938 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.6 mm -35.48 -67.43 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 CA-C-N 115.551 -0.75 . . . . 79.24 109.386 178.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -47.18 -45.36 22.9 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.09 -0.505 . . . . 110.49 112.36 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.9 tttm -58.22 -50.2 74.4 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.295 -0.962 . . . . 104.05 109.295 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -57.25 -67.58 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.845 -0.428 . . . . 125.54 109.845 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -38.11 -35.11 0.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.354 -0.384 . . . . 95.34 111.143 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . 0.504 ' O ' ' C ' ' A' ' 91' ' ' GLU . . . -57.73 -78.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.382 -0.599 . . . . 93.63 109.382 179.641 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . 0.531 ' O ' ' N ' ' A' ' 94' ' ' ARG . . . -28.35 -63.75 0.1 Allowed 'General case' 0 C--N 1.332 -0.192 0 O-C-N 123.358 0.411 . . . . 81.24 110.679 179.894 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . 0.467 ' C ' ' O ' ' A' ' 91' ' ' GLU . . . -33.23 -49.76 0.28 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.201 -0.454 . . . . 104.77 110.624 -179.848 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 90' ' ' LYS . 15.2 p -61.92 -51.13 69.4 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.764 -0.828 . . . . 114.87 108.764 178.849 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' A' ' 91' ' ' GLU . . . -56.88 -17.34 9.11 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.439 -0.578 . . . . 110.78 109.439 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . . . -76.21 -51.08 12.84 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 104.089 -2.56 . . . . 96.22 104.089 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . . . -58.21 -16.11 12.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.997 -1.001 . . . . 97.85 109.724 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.4 m -73.89 -4.76 36.98 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 106.642 -1.614 . . . . 122.0 106.642 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . . . -127.54 -82.64 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.257 -0.883 . . . . 125.1 110.059 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.192 0 CA-C-O 116.886 -1.531 . . . . 84.39 110.233 -179.679 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' PHE . . . . . 0.597 ' CD2' ' N ' ' B' ' 35' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 111.404 0.149 . . . . 106.06 111.404 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -126.72 132.87 51.03 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 116.963 2.208 . . . . 72.27 116.963 -178.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 28.7 p -62.46 140.58 58.59 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.312 -0.996 . . . . 72.13 108.312 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.9 t -36.61 -61.5 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.599 0 N-CA-C 112.795 0.665 . . . . 76.76 112.795 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -50.16 -54.68 19.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.979 1.103 . . . . 110.37 113.979 -179.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 8.3 m -54.61 -38.34 66.66 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 119.291 -0.963 . . . . 94.04 110.523 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -61.27 -38.21 85.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.467 -0.938 . . . . 63.79 108.467 177.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -60.08 -53.09 61.86 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 116.387 -0.369 . . . . 59.44 110.761 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLN . . . . . 0.53 ' NE2' ' O ' ' B' ' 5' ' ' HOH . 5.0 mp0 -88.86 11.03 19.07 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.482 0.919 . . . . 84.92 113.482 -179.837 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LYS . . . . . 0.568 ' NZ ' ' N7 ' ' C' ' 12' ' ' ' DG' . 90.2 mttt 46.28 49.04 13.13 Favored 'General case' 0 CA--C 1.483 -1.62 0 N-CA-C 107.53 -1.285 . . . . 60.02 107.53 178.846 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 42.4 p -117.01 150.22 38.98 Favored 'General case' 0 CA--C 1.502 -0.892 0 C-N-CA 119.89 -0.724 . . . . 96.65 110.151 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . . . -49.37 120.34 4.01 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.144 -0.622 . . . . 103.21 109.372 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' CYS . . . . . . . . . . . . . 15.3 t -110.8 133.98 52.9 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 102.608 -3.108 . . . . 81.82 102.608 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . . . -118.63 67.42 0.77 Allowed 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.19 -0.604 . . . . 101.12 110.544 -179.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ALA . . . . . 0.614 ' O ' ' C ' ' B' ' 50' ' ' CYS . . . -77.12 -83.87 0.07 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.311 0.856 . . . . 93.65 113.311 -179.467 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' CYS . . . . . 0.614 ' C ' ' O ' ' B' ' 49' ' ' ALA . . . -25.57 -64.78 0.06 Allowed 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 106.469 -1.678 . . . . 114.27 106.469 179.964 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLU . . . . . 0.598 ' O ' ' N ' ' B' ' 53' ' ' ALA . 54.7 mp0 -37.82 -96.29 0.0 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.295 -0.866 . . . . 179.5 109.698 179.523 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ARG . . . . . 0.431 ' O ' ' O ' ' B' ' 53' ' ' ALA . . . -53.87 76.62 0.0 OUTLIER 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.337 0.589 . . . . 96.79 111.173 -179.653 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ALA . . . . . 0.598 ' N ' ' O ' ' B' ' 51' ' ' GLU . . . 0.22 -146.11 0.0 OUTLIER Pre-proline 0 N--CA 1.466 0.369 0 N-CA-C 120.813 3.635 . . . . 130.03 120.813 179.719 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' PRO . . . . . . . . . . . . . . . -56.78 -20.47 35.53 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.082 1.855 . . . . 128.6 111.715 -179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . . . -65.44 124.98 88.65 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 115.592 -0.731 . . . . 127.05 109.521 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -40.83 153.03 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 124.592 3.528 . . . . 106.24 112.557 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' CYS . . . . . 0.412 ' SG ' ' N ' ' B' ' 60' ' ' CYS . 0.1 OUTLIER -48.5 146.43 2.95 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.812 0.339 . . . . 95.34 110.839 -179.397 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' THR . . . . . 0.526 ' O ' ' N ' ' B' ' 61' ' ' ALA . 19.3 m -51.46 -64.13 0.91 Allowed 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.64 0.978 . . . . 109.13 113.64 -179.177 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . . . -49.03 -38.93 25.29 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 109.875 -0.417 . . . . 101.7 109.875 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' CYS . . . . . 0.412 ' N ' ' SG ' ' B' ' 57' ' ' CYS . 25.5 m -64.81 -4.35 4.29 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.843 0.83 . . . . 95.61 110.163 179.127 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ALA . . . . . 0.602 ' O ' ' N ' ' B' ' 64' ' ' ASN . . . -83.12 -72.84 0.43 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 104.446 -2.427 . . . . 105.59 104.446 177.471 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LYS . . . . . 0.537 ' C ' ' O ' ' B' ' 61' ' ' ALA . . . -35.12 -45.67 0.3 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.585 -1.265 . . . . 94.99 107.585 179.752 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . . . -75.77 -32.98 60.17 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.804 -0.635 . . . . 88.28 112.314 -179.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ASN . . . . . 0.602 ' N ' ' O ' ' B' ' 61' ' ' ALA . 18.6 t-20 55.19 76.67 0.25 Allowed 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 105.647 -1.983 . . . . 111.23 105.647 -178.174 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.9 m -143.26 163.04 39.66 Favored Pre-proline 0 C--O 1.24 0.586 0 N-CA-C 107.514 -1.291 . . . . 94.76 107.514 179.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_exo -64.53 101.72 0.38 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.235 1.956 . . . . 93.6 109.154 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' CYS . . . . . . . . . . . . . 49.8 t -74.91 78.5 2.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.723 -0.671 . . . . 97.54 110.357 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . . . -75.43 155.43 6.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 112.306 0.484 . . . . 67.57 112.306 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.05 79.45 1.9 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.363 -0.38 . . . . 88.91 110.323 179.931 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' B' ' 72' ' ' ASP . . . -102.16 79.26 1.85 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 120.102 -0.639 . . . . 80.42 111.346 179.897 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . . . -31.79 -23.86 0.0 OUTLIER 'General case' 0 C--O 1.233 0.219 0 N-CA-C 115.253 1.575 . . . . 88.66 115.253 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ASP . . . . . 0.554 ' N ' ' O ' ' B' ' 70' ' ' LYS . 11.7 p-10 -99.68 26.82 5.84 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 112.19 0.441 . . . . 121.91 112.19 -179.753 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' PHE . . . . . 0.414 ' N ' ' O ' ' B' ' 70' ' ' LYS . 45.9 t80 -97.85 148.74 23.11 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.094 1.146 . . . . 108.94 114.094 -179.376 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -140.54 118.9 12.13 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.769 -0.651 . . . . 123.71 109.494 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -41.66 145.89 0.27 Allowed 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 113.855 1.057 . . . . 85.01 113.855 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 86.1 m -91.61 138.2 31.76 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 106.873 -1.528 . . . . 92.77 106.873 178.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -91.34 69.71 6.0 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.392 -0.923 . . . . 64.7 110.899 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LYS . . . . . 0.418 ' O ' ' C ' ' B' ' 79' ' ' ARG . 2.8 mmmm -27.21 -70.57 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.97 1.841 . . . . 70.43 115.97 -179.982 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ARG . . . . . 0.675 ' N ' ' OP1' ' C' ' 11' ' ' ' DC' . 3.0 tpp180 -41.08 -85.15 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.549 -0.908 . . . . 112.34 108.549 179.346 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -37.72 -46.58 0.91 Allowed 'General case' 0 C--O 1.234 0.257 0 N-CA-C 113.517 0.932 . . . . 82.12 113.517 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ARG . . . . . 0.456 ' O ' ' N ' ' B' ' 84' ' ' ALA . 0.0 OUTLIER -54.34 -75.82 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.842 -0.617 . . . . 84.89 110.889 -179.992 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ASN . . . . . 0.445 ' N ' ' CD ' ' B' ' 81' ' ' ARG . 7.0 m120 -42.9 -33.42 0.78 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.864 -0.607 . . . . 95.66 110.783 -179.936 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -62.96 -39.79 95.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.356 0.598 . . . . 118.19 110.049 179.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ALA . . . . . 0.456 ' N ' ' O ' ' B' ' 81' ' ' ARG . . . -66.13 -57.78 6.89 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.982 -2.229 . . . . 75.9 104.982 177.979 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ILE . . . . . . . . . . . . . 3.7 mm -35.96 -67.31 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 CA-C-N 115.702 -0.681 . . . . 83.96 109.439 178.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -47.36 -45.42 24.87 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.014 -0.539 . . . . 112.34 112.444 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -57.96 -50.38 73.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.299 -0.96 . . . . 104.68 109.18 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -57.11 -67.71 0.29 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.828 -0.434 . . . . 129.71 109.828 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -37.89 -34.99 0.13 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.255 -0.43 . . . . 83.29 111.118 178.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LYS . . . . . 0.491 ' O ' ' C ' ' B' ' 91' ' ' GLU . . . -57.85 -78.5 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.386 -0.598 . . . . 103.68 109.386 179.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' GLU . . . . . 0.524 ' O ' ' N ' ' B' ' 94' ' ' ARG . . . -28.53 -63.52 0.1 Allowed 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.436 0.46 . . . . 77.98 110.687 179.993 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' LEU . . . . . 0.458 ' C ' ' O ' ' B' ' 91' ' ' GLU . . . -33.37 -49.57 0.28 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.207 -0.451 . . . . 106.59 110.695 -179.948 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' THR . . . . . 0.431 ' N ' ' O ' ' B' ' 90' ' ' LYS . 15.6 p -62.17 -50.94 69.84 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 119.69 -0.804 . . . . 115.68 108.837 178.822 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' B' ' 91' ' ' GLU . . . -57.0 -17.46 9.9 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.541 -0.54 . . . . 110.28 109.541 179.048 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . . . -75.96 -50.98 13.4 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 104.261 -2.496 . . . . 95.68 104.261 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . . . -58.53 -16.05 13.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.022 -0.99 . . . . 108.7 109.585 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' THR . . . . . . . . . . . . . 27.4 m -73.82 -4.85 37.3 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 106.557 -1.645 . . . . 116.96 106.557 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . . . -127.47 -83.0 0.6 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.352 -0.84 . . . . 117.67 110.007 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.166 -1.397 . . . . 91.32 110.354 179.968 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' HOH . . . . . 0.53 ' O ' ' NE2' ' B' ' 43' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' HOH . . . . . 0.479 ' O ' ' N ' ' B' ' 58' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' ' DT' . . . . . 0.439 " H1'" " H5'" ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O5'-C5'-C4' 113.032 2.023 . . . . 118.7 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 2' ' ' ' DT' . . . . . 0.442 H2'' ' OP2' ' C' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 N19-C1'-C2' 117.44 2.025 . . . . 88.07 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ' DG' . . . . . 0.681 H2'' " H5'" ' C' ' 4' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.407 -2.061 0 P-O5'-C5' 117.642 -2.036 . . . . 56.94 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ' DC' . . . . . 0.681 " H5'" H2'' ' C' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.413 -1.717 0 O4'-C1'-N19 105.686 -2.642 . . . . 84.87 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ' DC' . . . . . 0.616 H2'' ' C8 ' ' C' ' 6' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.419 -1.29 0 N19-C1'-C2' 117.461 2.038 . . . . 78.92 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' ' DG' . . . . . 0.616 ' C8 ' H2'' ' C' ' 5' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.421 -1.171 0 C5'-C4'-C3' 111.039 -2.441 . . . . 90.37 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' ' DG' . . . . . 0.569 ' OP2' H2'' ' C' ' 6' ' ' ' DG' . . . . . . . . 0 P--O3' 1.595 -0.992 0 N19-C1'-C2' 116.635 1.522 . . . . 106.52 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' ' DT' . . . . . 0.806 H2'' ' H8 ' ' C' ' 9' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.403 -2.333 1 C5'-C4'-C3' 108.606 -4.063 . . . . 104.05 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 9' ' ' ' DA' . . . . . 0.806 ' H8 ' H2'' ' C' ' 8' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.412 -1.478 0 P-O3'-C3' 117.505 -1.829 . . . . 59.95 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ' DC' . . . . . 0.789 H2'' " H5'" ' C' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.413 -1.657 0 O4'-C1'-N19 106.177 -2.029 . . . . 59.45 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ' DC' . . . . . 0.789 " H5'" H2'' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.412 -1.729 0 C4'-C3'-O3' 104.049 -2.842 . . . . 56.03 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ' DG' . . . . . 1.032 H2'' H5'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.42 -1.251 0 C5'-C4'-C3' 111.379 -2.214 . . . . 76.58 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ' DG' . . . . . 1.032 H5'' H2'' ' C' ' 12' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.409 -1.955 0 C5'-C4'-C3' 111.751 -1.966 . . . . 87.23 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.416 -1.516 0 C4'-C3'-O3' 106.874 -1.557 . . . . 89.46 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C5'-C4'-C3' 112.332 -1.578 . . . . 74.96 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 16' ' ' ' DT' . . . . . 0.473 H2'' " O5'" ' D' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.422 -1.098 0 C5'-C4'-C3' 112.4 -1.533 . . . . 116.72 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' ' DT' . . . . . 0.862 H2'' ' C8 ' ' D' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.401 -2.407 0 C5'-C4'-C3' 110.342 -2.905 . . . . 82.83 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' ' DG' . . . . . 0.862 ' C8 ' H2'' ' D' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.397 -2.681 0 C5'-C4'-C3' 111.746 -1.97 . . . . 64.48 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' ' DC' . . . . . 0.82 " H5'" H2'' ' D' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.404 -2.247 0 O4'-C1'-N19 105.78 -2.526 . . . . 76.49 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' ' DC' . . . . . 0.597 H2'' ' C8 ' ' D' ' 21' ' ' ' DG' . . . . . . . . 0 P--O3' 1.591 -1.31 0 N19-C1'-C2' 118.325 2.578 . . . . 82.16 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' ' DG' . . . . . 0.597 ' C8 ' H2'' ' D' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.943 0 O3'-P-O5' 101.43 -1.353 . . . . 87.74 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ' DG' . . . . . 0.544 ' OP2' H2'' ' D' ' 21' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-C2' 107.385 1.168 . . . . 115.7 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' ' DT' . . . . . 0.715 H2'' ' C8 ' ' D' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.402 -2.403 0 C5'-C4'-C3' 109.442 -3.505 . . . . 93.17 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' ' DA' . . . . . 0.715 ' C8 ' H2'' ' D' ' 23' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.416 -1.116 0 P-O3'-C3' 117.766 -1.612 . . . . 63.16 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' ' DC' . . . . . 0.726 H2'' " H5'" ' D' ' 26' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.409 -1.925 0 O4'-C1'-N19 106.488 -1.641 . . . . 58.87 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' ' DC' . . . . . 0.726 " H5'" H2'' ' D' ' 25' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.41 -1.89 0 C4'-C3'-O3' 104.921 -2.445 . . . . 58.62 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' ' DG' . . . . . 0.954 H2'' H5'' ' D' ' 28' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.417 -1.427 0 C5'-C4'-C3' 110.429 -2.847 . . . . 79.26 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' ' DG' . . . . . 0.954 H5'' H2'' ' D' ' 27' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.411 -1.827 0 C5'-C4'-C3' 111.448 -2.168 . . . . 87.21 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.417 -1.432 0 C5'-C4'-C3' 110.498 -2.802 . . . . 82.15 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 30' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.001 0 C2'-C3'-O3' 106.09 -1.67 . . . . 75.6 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PHE . . . . . 0.544 ' N ' ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.545 0 CA-C-O 120.811 0.339 . . . . 118.43 111.789 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -125.87 132.54 52.16 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 117.224 2.305 . . . . 73.72 117.224 -177.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' A' ' 40' ' ' CYS . 27.4 p -62.23 140.89 58.45 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 108.394 -0.965 . . . . 81.06 108.394 179.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . 0.586 HG13 ' CD2' ' A' ' 73' ' ' PHE . 4.0 t -36.99 -61.73 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.755 0 N-CA-C 112.676 0.621 . . . . 80.88 112.676 -178.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . 0.495 ' O ' ' HB3' ' A' ' 42' ' ' GLN . 41.9 tp10 -49.74 -54.63 17.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 113.859 1.059 . . . . 96.34 113.859 -179.774 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' CYS . . . . . 0.792 ' CB ' ' HB2' ' A' ' 47' ' ' CYS . 7.6 m -54.83 -37.94 66.76 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 119.299 -0.96 . . . . 73.29 110.454 179.517 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 38' ' ' VAL . 77.8 mtt180 -61.6 -38.41 87.46 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.302 -0.863 . . . . 61.92 108.854 177.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLN . . . . . 0.495 ' HB3' ' O ' ' A' ' 39' ' ' GLU . 56.1 tp60 -59.72 -52.97 63.21 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.825 -0.625 . . . . 56.48 110.706 179.818 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . 0.486 ' OE1' ' HG3' ' A' ' 42' ' ' GLN . 3.0 mp0 -89.17 11.33 18.97 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.925 0.713 . . . . 78.59 112.925 -179.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . 0.403 ' NZ ' ' N7 ' ' D' ' 27' ' ' ' DG' . 89.1 mttt 45.64 48.35 11.37 Favored 'General case' 0 CA--C 1.48 -1.743 0 N-CA-C 108.691 -0.855 . . . . 54.84 108.691 179.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.2 p -116.34 150.28 37.94 Favored 'General case' 0 CA--C 1.505 -0.774 0 C-N-CA 119.551 -0.86 . . . . 90.46 110.311 -177.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -49.5 120.78 4.42 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.058 -0.657 . . . . 91.0 109.242 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' CYS . . . . . 0.792 ' HB2' ' CB ' ' A' ' 40' ' ' CYS . 16.5 t -111.0 133.46 53.37 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 102.699 -3.074 . . . . 72.97 102.699 178.532 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . . . -118.3 67.72 0.77 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.053 -0.659 . . . . 99.62 110.641 -179.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . 0.605 ' O ' ' C ' ' A' ' 50' ' ' CYS . . . -77.28 -84.11 0.07 Allowed 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.168 0.803 . . . . 99.0 113.168 -179.104 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' CYS . . . . . 0.605 ' C ' ' O ' ' A' ' 49' ' ' ALA . . . -25.29 -64.88 0.06 Allowed 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 106.525 -1.657 . . . . 119.5 106.525 179.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . 0.6 ' O ' ' N ' ' A' ' 53' ' ' ALA . 54.7 mp0 -37.81 -96.16 0.0 OUTLIER 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.29 -0.868 . . . . 173.67 109.852 179.469 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ARG . . . . . 0.445 ' O ' ' O ' ' A' ' 53' ' ' ALA . . . -54.07 76.85 0.0 OUTLIER 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.538 0.685 . . . . 116.79 111.059 -179.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . 0.6 ' N ' ' O ' ' A' ' 51' ' ' GLU . . . 0.2 -146.02 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 120.794 3.628 . . . . 128.9 120.794 179.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . . . -56.94 -20.39 36.33 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 122.191 1.927 . . . . 118.03 111.631 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . . . -65.37 124.87 88.28 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.567 -0.742 . . . . 130.41 109.443 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -40.92 153.22 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 124.489 3.459 . . . . 109.98 112.528 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 60' ' ' CYS . 0.1 OUTLIER -48.7 146.69 2.97 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.775 -0.37 . . . . 95.03 110.794 -179.275 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . 0.546 ' O ' ' HB3' ' A' ' 61' ' ' ALA . 19.9 m -51.8 -63.85 1.0 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.66 0.985 . . . . 103.31 113.66 -179.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . . . -49.17 -39.28 28.63 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 109.716 -0.476 . . . . 112.52 109.716 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' CYS . . . . . 0.409 ' HB2' ' SG ' ' A' ' 57' ' ' CYS . 28.6 m -64.44 -3.99 3.52 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.864 0.84 . . . . 94.28 110.451 179.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . 0.596 ' O ' ' N ' ' A' ' 64' ' ' ASN . . . -83.38 -72.66 0.44 Allowed 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 104.417 -2.438 . . . . 94.17 104.417 177.555 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . 0.537 ' C ' ' O ' ' A' ' 61' ' ' ALA . . . -35.18 -45.7 0.31 Allowed 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.635 -1.246 . . . . 88.13 107.635 179.622 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . . . -75.61 -33.19 60.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.771 -0.65 . . . . 79.07 112.279 -179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . 0.596 ' N ' ' O ' ' A' ' 61' ' ' ALA . 18.6 t-20 55.45 76.74 0.25 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 105.646 -1.983 . . . . 98.0 105.646 -177.977 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.4 m -143.5 163.12 38.56 Favored Pre-proline 0 N--CA 1.447 -0.587 0 N-CA-C 107.336 -1.357 . . . . 102.03 107.336 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -64.53 101.89 0.38 Allowed 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.168 1.912 . . . . 100.72 109.244 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.5 t -74.85 78.34 2.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.748 -0.66 . . . . 91.47 110.602 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . 0.479 ' O ' HD22 ' A' ' 69' ' ' LEU . . . -75.37 155.54 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 112.357 0.503 . . . . 66.07 112.357 179.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . 0.479 HD22 ' O ' ' A' ' 68' ' ' ILE . 0.4 OUTLIER -128.18 79.51 1.91 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.473 -0.33 . . . . 74.32 110.503 179.874 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . 0.552 ' O ' ' N ' ' A' ' 72' ' ' ASP . . . -102.4 78.91 1.78 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 120.103 -0.639 . . . . 81.63 111.511 -180.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . . . -31.44 -23.69 0.0 OUTLIER 'General case' 0 C--O 1.239 0.509 0 N-CA-C 115.254 1.575 . . . . 81.94 115.254 -179.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASP . . . . . 0.552 ' N ' ' O ' ' A' ' 70' ' ' LYS . 11.8 p-10 -99.88 26.46 6.31 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 112.164 0.431 . . . . 129.93 112.164 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PHE . . . . . 0.586 ' CD2' HG13 ' A' ' 38' ' ' VAL . 46.2 t80 -97.32 148.59 22.98 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.272 1.212 . . . . 104.37 114.272 -179.475 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . 0.409 ' HG2' ' C ' ' A' ' 73' ' ' PHE . 4.0 mtt180 -140.29 118.69 12.16 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.901 -0.591 . . . . 132.93 109.485 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . 0.683 ' HG3' HH11 ' A' ' 75' ' ' ARG . 4.3 ptm180 -41.05 145.56 0.21 Allowed 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 114.189 1.181 . . . . 67.0 114.189 -178.768 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.9 m -91.2 136.61 32.97 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 106.697 -1.594 . . . . 86.02 106.697 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -86.96 67.94 9.93 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 119.855 -0.738 . . . . 53.2 111.048 179.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . 0.506 ' HZ3' ' P ' ' D' ' 25' ' ' ' DC' . 2.8 mmmm -26.83 -70.52 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 116.033 1.864 . . . . 78.58 116.033 179.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . 0.657 ' N ' ' OP1' ' D' ' 26' ' ' ' DC' . 3.0 tpp180 -41.2 -85.14 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 108.719 -0.845 . . . . 111.58 108.719 179.336 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -37.75 -46.45 0.91 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.491 0.922 . . . . 85.0 113.491 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . 0.739 ' HD3' ' N ' ' A' ' 82' ' ' ASN . 0.0 OUTLIER -54.17 -76.2 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.943 -0.572 . . . . 97.96 110.704 -179.924 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASN . . . . . 0.739 ' N ' ' HD3' ' A' ' 81' ' ' ARG . 2.1 m-80 -42.74 -33.61 0.77 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.724 -0.671 . . . . 106.99 110.9 -179.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -62.81 -39.56 94.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.426 0.631 . . . . 120.11 110.092 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 81' ' ' ARG . . . -66.15 -58.39 5.53 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 104.898 -2.26 . . . . 78.54 104.898 177.938 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.6 mm -35.48 -67.43 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 CA-C-N 115.551 -0.75 . . . . 79.24 109.386 178.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -47.18 -45.36 22.9 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.09 -0.505 . . . . 110.49 112.36 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.9 tttm -58.22 -50.2 74.4 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.295 -0.962 . . . . 104.05 109.295 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -57.25 -67.58 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.845 -0.428 . . . . 125.54 109.845 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -38.11 -35.11 0.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.354 -0.384 . . . . 95.34 111.143 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . 0.504 ' O ' ' C ' ' A' ' 91' ' ' GLU . . . -57.73 -78.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.382 -0.599 . . . . 93.63 109.382 179.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . 0.531 ' O ' ' N ' ' A' ' 94' ' ' ARG . . . -28.35 -63.75 0.1 Allowed 'General case' 0 C--N 1.332 -0.192 0 O-C-N 123.358 0.411 . . . . 81.24 110.679 179.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . 0.467 ' C ' ' O ' ' A' ' 91' ' ' GLU . . . -33.23 -49.76 0.28 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.201 -0.454 . . . . 104.77 110.624 -179.848 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 90' ' ' LYS . 15.2 p -61.92 -51.13 69.4 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.764 -0.828 . . . . 114.87 108.764 178.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' A' ' 91' ' ' GLU . . . -56.88 -17.34 9.11 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.439 -0.578 . . . . 110.78 109.439 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . . . -76.21 -51.08 12.84 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 104.089 -2.56 . . . . 96.22 104.089 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . . . -58.21 -16.11 12.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.997 -1.001 . . . . 97.85 109.724 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . 0.523 ' OG1' ' HA ' ' A' ' 94' ' ' ARG . 27.4 m -73.89 -4.76 36.98 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 106.642 -1.614 . . . . 122.0 106.642 179.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . . . -127.54 -82.64 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.257 -0.883 . . . . 125.1 110.059 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.192 0 CA-C-O 116.886 -1.531 . . . . 84.39 110.233 -179.679 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 35' ' ' PHE . . . . . 0.597 ' CD2' ' N ' ' B' ' 35' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 111.404 0.149 . . . . 106.06 111.404 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -126.72 132.87 51.03 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 116.963 2.208 . . . . 72.27 116.963 -178.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' B' ' 40' ' ' CYS . 28.7 p -62.46 140.58 58.59 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.312 -0.996 . . . . 72.13 108.312 179.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' VAL . . . . . 0.587 HG13 ' CD2' ' B' ' 73' ' ' PHE . 3.9 t -36.61 -61.5 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.599 0 N-CA-C 112.795 0.665 . . . . 76.76 112.795 -178.713 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLU . . . . . 0.493 ' O ' ' HB3' ' B' ' 42' ' ' GLN . 41.3 tp10 -50.16 -54.68 19.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.979 1.103 . . . . 110.37 113.979 -179.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' CYS . . . . . 0.809 ' CB ' ' HB2' ' B' ' 47' ' ' CYS . 8.3 m -54.61 -38.34 66.66 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 119.291 -0.963 . . . . 94.04 110.523 179.069 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' B' ' 38' ' ' VAL . 76.0 mtt180 -61.27 -38.21 85.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.467 -0.938 . . . . 63.79 108.467 177.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLN . . . . . 0.495 ' HG3' ' OE1' ' B' ' 43' ' ' GLN . 56.1 tp60 -60.08 -53.09 61.86 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 116.387 -0.369 . . . . 59.44 110.761 179.994 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLN . . . . . 0.495 ' OE1' ' HG3' ' B' ' 42' ' ' GLN . 3.0 mp0 -88.86 11.03 19.07 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.482 0.919 . . . . 84.92 113.482 -179.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LYS . . . . . 0.564 ' NZ ' ' N7 ' ' C' ' 12' ' ' ' DG' . 90.2 mttt 46.28 49.04 13.13 Favored 'General case' 0 CA--C 1.483 -1.62 0 N-CA-C 107.53 -1.285 . . . . 60.02 107.53 178.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 42.4 p -117.01 150.22 38.98 Favored 'General case' 0 CA--C 1.502 -0.892 0 C-N-CA 119.89 -0.724 . . . . 96.65 110.151 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . . . -49.37 120.34 4.01 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.144 -0.622 . . . . 103.21 109.372 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' CYS . . . . . 0.809 ' HB2' ' CB ' ' B' ' 40' ' ' CYS . 15.3 t -110.8 133.98 52.9 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 102.608 -3.108 . . . . 81.82 102.608 178.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . . . -118.63 67.42 0.77 Allowed 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.19 -0.604 . . . . 101.12 110.544 -179.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ALA . . . . . 0.614 ' O ' ' C ' ' B' ' 50' ' ' CYS . . . -77.12 -83.87 0.07 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.311 0.856 . . . . 93.65 113.311 -179.467 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' CYS . . . . . 0.614 ' C ' ' O ' ' B' ' 49' ' ' ALA . . . -25.57 -64.78 0.06 Allowed 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 106.469 -1.678 . . . . 114.27 106.469 179.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLU . . . . . 0.598 ' O ' ' N ' ' B' ' 53' ' ' ALA . 54.7 mp0 -37.82 -96.29 0.0 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.295 -0.866 . . . . 179.5 109.698 179.523 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ARG . . . . . 0.431 ' O ' ' O ' ' B' ' 53' ' ' ALA . . . -53.87 76.62 0.0 OUTLIER 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.337 0.589 . . . . 96.79 111.173 -179.653 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ALA . . . . . 0.598 ' N ' ' O ' ' B' ' 51' ' ' GLU . . . 0.22 -146.11 0.0 OUTLIER Pre-proline 0 N--CA 1.466 0.369 0 N-CA-C 120.813 3.635 . . . . 130.03 120.813 179.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' PRO . . . . . . . . . . . . . . . -56.78 -20.47 35.53 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.082 1.855 . . . . 128.6 111.715 -179.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . . . -65.44 124.98 88.65 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 115.592 -0.731 . . . . 127.05 109.521 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -40.83 153.03 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 124.592 3.528 . . . . 106.24 112.557 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.5 146.43 2.95 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.812 0.339 . . . . 95.34 110.839 -179.397 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' THR . . . . . 0.555 ' O ' ' HB3' ' B' ' 61' ' ' ALA . 19.3 m -51.46 -64.13 0.91 Allowed 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.64 0.978 . . . . 109.13 113.64 -179.177 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . . . -49.03 -38.93 25.29 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 109.875 -0.417 . . . . 101.7 109.875 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 25.5 m -64.81 -4.35 4.29 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.843 0.83 . . . . 95.61 110.163 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ALA . . . . . 0.602 ' O ' ' N ' ' B' ' 64' ' ' ASN . . . -83.12 -72.84 0.43 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 104.446 -2.427 . . . . 105.59 104.446 177.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LYS . . . . . 0.537 ' C ' ' O ' ' B' ' 61' ' ' ALA . . . -35.12 -45.67 0.3 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.585 -1.265 . . . . 94.99 107.585 179.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . . . -75.77 -32.98 60.17 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.804 -0.635 . . . . 88.28 112.314 -179.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ASN . . . . . 0.602 ' N ' ' O ' ' B' ' 61' ' ' ALA . 18.6 t-20 55.19 76.67 0.25 Allowed 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 105.647 -1.983 . . . . 111.23 105.647 -178.174 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.9 m -143.26 163.04 39.66 Favored Pre-proline 0 C--O 1.24 0.586 0 N-CA-C 107.514 -1.291 . . . . 94.76 107.514 179.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_exo -64.53 101.72 0.38 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.235 1.956 . . . . 93.6 109.154 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' CYS . . . . . . . . . . . . . 49.8 t -74.91 78.5 2.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.723 -0.671 . . . . 97.54 110.357 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ILE . . . . . 0.52 ' O ' HD22 ' B' ' 69' ' ' LEU . . . -75.43 155.43 6.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 112.306 0.484 . . . . 67.57 112.306 179.582 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LEU . . . . . 0.52 HD22 ' O ' ' B' ' 68' ' ' ILE . 0.6 OUTLIER -128.05 79.45 1.9 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.363 -0.38 . . . . 88.91 110.323 179.931 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' B' ' 72' ' ' ASP . . . -102.16 79.26 1.85 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 120.102 -0.639 . . . . 80.42 111.346 179.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . . . -31.79 -23.86 0.0 OUTLIER 'General case' 0 C--O 1.233 0.219 0 N-CA-C 115.253 1.575 . . . . 88.66 115.253 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ASP . . . . . 0.554 ' N ' ' O ' ' B' ' 70' ' ' LYS . 11.7 p-10 -99.68 26.82 5.84 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 112.19 0.441 . . . . 121.91 112.19 -179.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' PHE . . . . . 0.587 ' CD2' HG13 ' B' ' 38' ' ' VAL . 45.9 t80 -97.85 148.74 23.11 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.094 1.146 . . . . 108.94 114.094 -179.376 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ARG . . . . . 0.407 ' HG2' ' C ' ' B' ' 73' ' ' PHE . 3.9 mtt180 -140.54 118.9 12.13 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.769 -0.651 . . . . 123.71 109.494 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ARG . . . . . 0.689 HH11 ' HG3' ' B' ' 75' ' ' ARG . 4.2 ptm180 -41.66 145.89 0.27 Allowed 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 113.855 1.057 . . . . 85.01 113.855 -178.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 86.1 m -91.61 138.2 31.76 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 106.873 -1.528 . . . . 92.77 106.873 178.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -91.34 69.71 6.0 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.392 -0.923 . . . . 64.7 110.899 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LYS . . . . . 0.608 ' HZ3' ' P ' ' C' ' 10' ' ' ' DC' . 2.8 mmmm -27.21 -70.57 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.97 1.841 . . . . 70.43 115.97 -179.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ARG . . . . . 0.642 ' N ' ' OP1' ' C' ' 11' ' ' ' DC' . 3.0 tpp180 -41.08 -85.15 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.549 -0.908 . . . . 112.34 108.549 179.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -37.72 -46.58 0.91 Allowed 'General case' 0 C--O 1.234 0.257 0 N-CA-C 113.517 0.932 . . . . 82.12 113.517 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ARG . . . . . 0.733 ' HD3' ' N ' ' B' ' 82' ' ' ASN . 0.0 OUTLIER -54.34 -75.82 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.842 -0.617 . . . . 84.89 110.889 -179.992 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ASN . . . . . 0.733 ' N ' ' HD3' ' B' ' 81' ' ' ARG . 2.1 m-80 -42.9 -33.42 0.78 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.864 -0.607 . . . . 95.66 110.783 -179.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -62.96 -39.79 95.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.356 0.598 . . . . 118.19 110.049 179.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ALA . . . . . 0.445 ' N ' ' O ' ' B' ' 81' ' ' ARG . . . -66.13 -57.78 6.89 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.982 -2.229 . . . . 75.9 104.982 177.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ILE . . . . . . . . . . . . . 3.7 mm -35.96 -67.31 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 CA-C-N 115.702 -0.681 . . . . 83.96 109.439 178.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -47.36 -45.42 24.87 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.014 -0.539 . . . . 112.34 112.444 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -57.96 -50.38 73.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.299 -0.96 . . . . 104.68 109.18 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -57.11 -67.71 0.29 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.828 -0.434 . . . . 129.71 109.828 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -37.89 -34.99 0.13 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.255 -0.43 . . . . 83.29 111.118 178.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LYS . . . . . 0.491 ' O ' ' C ' ' B' ' 91' ' ' GLU . . . -57.85 -78.5 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.386 -0.598 . . . . 103.68 109.386 179.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' GLU . . . . . 0.524 ' O ' ' N ' ' B' ' 94' ' ' ARG . . . -28.53 -63.52 0.1 Allowed 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.436 0.46 . . . . 77.98 110.687 179.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' LEU . . . . . 0.458 ' C ' ' O ' ' B' ' 91' ' ' GLU . . . -33.37 -49.57 0.28 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.207 -0.451 . . . . 106.59 110.695 -179.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' THR . . . . . 0.428 ' N ' ' O ' ' B' ' 90' ' ' LYS . 15.6 p -62.17 -50.94 69.84 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 119.69 -0.804 . . . . 115.68 108.837 178.822 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' B' ' 91' ' ' GLU . . . -57.0 -17.46 9.9 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.541 -0.54 . . . . 110.28 109.541 179.048 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . . . -75.96 -50.98 13.4 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 104.261 -2.496 . . . . 95.68 104.261 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . . . -58.53 -16.05 13.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.022 -0.99 . . . . 108.7 109.585 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' THR . . . . . 0.516 ' OG1' ' HA ' ' B' ' 94' ' ' ARG . 27.4 m -73.82 -4.85 37.3 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 106.557 -1.645 . . . . 116.96 106.557 179.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . . . -127.47 -83.0 0.6 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.352 -0.84 . . . . 117.67 110.007 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.166 -1.397 . . . . 91.32 110.354 179.968 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' HOH . . . . . 0.432 ' O ' " H2'" ' C' ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' ' DT' . . . . . 0.439 " H1'" " H5'" ' C' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O5'-C5'-C4' 113.032 2.023 . . . . 118.7 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' ' DT' . . . . . 0.442 H2'' ' OP2' ' C' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 N19-C1'-C2' 117.44 2.025 . . . . 88.069999999999993 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ' DG' . . . . . 0.681 H2'' " H5'" ' C' ' 4' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.407 -2.061 0 P-O5'-C5' 117.642 -2.036 . . . . 56.939999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ' DC' . . . . . 0.681 " H5'" H2'' ' C' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.413 -1.717 0 O4'-C1'-N19 105.686 -2.642 . . . . 84.870000000000005 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ' DC' . . . . . 0.616 H2'' ' C8 ' ' C' ' 6' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.419 -1.29 0 N19-C1'-C2' 117.461 2.038 . . . . 78.920000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' ' DG' . . . . . 0.616 ' C8 ' H2'' ' C' ' 5' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.421 -1.171 0 C5'-C4'-C3' 111.039 -2.441 . . . . 90.370000000000005 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.569 ' OP2' H2'' ' C' ' 6' ' ' ' DG' . . . . . . . . 0 P--O3' 1.595 -0.992 0 N19-C1'-C2' 116.635 1.522 . . . . 106.52 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' ' DT' . . . . . 0.806 H2'' ' H8 ' ' C' ' 9' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.403 -2.333 1 C5'-C4'-C3' 108.606 -4.063 . . . . 104.05 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' ' DA' . . . . . 0.806 ' H8 ' H2'' ' C' ' 8' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.412 -1.478 0 P-O3'-C3' 117.505 -1.829 . . . . 59.950000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.789 H2'' " H5'" ' C' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.413 -1.657 0 O4'-C1'-N19 106.177 -2.029 . . . . 59.450000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ' DC' . . . . . 0.789 " H5'" H2'' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.412 -1.729 0 C4'-C3'-O3' 104.049 -2.842 . . . . 56.030000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ' DG' . . . . . 1.032 H2'' H5'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.42 -1.251 0 C5'-C4'-C3' 111.379 -2.214 . . . . 76.579999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 1.032 H5'' H2'' ' C' ' 12' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.409 -1.955 0 C5'-C4'-C3' 111.751 -1.966 . . . . 87.230000000000004 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.416 -1.516 0 C4'-C3'-O3' 106.874 -1.557 . . . . 89.459999999999994 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C5'-C4'-C3' 112.332 -1.578 . . . . 74.959999999999994 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' ' DT' . . . . . 0.473 H2'' " O5'" ' D' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.422 -1.098 0 C5'-C4'-C3' 112.4 -1.533 . . . . 116.72 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' ' DT' . . . . . 0.862 H2'' ' C8 ' ' D' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.401 -2.407 0 C5'-C4'-C3' 110.342 -2.905 . . . . 82.829999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' ' DG' . . . . . 0.862 ' C8 ' H2'' ' D' ' 17' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.397 -2.681 0 C5'-C4'-C3' 111.746 -1.97 . . . . 64.480000000000004 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' ' DC' . . . . . 0.82 " H5'" H2'' ' D' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.404 -2.247 0 O4'-C1'-N19 105.78 -2.526 . . . . 76.489999999999995 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' ' DC' . . . . . 0.597 H2'' ' C8 ' ' D' ' 21' ' ' ' DG' . . . . . . . . 0 P--O3' 1.591 -1.31 0 N19-C1'-C2' 118.325 2.578 . . . . 82.159999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' ' DG' . . . . . 0.597 ' C8 ' H2'' ' D' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.943 0 O3'-P-O5' 101.43 -1.353 . . . . 87.739999999999995 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ' DG' . . . . . 0.544 ' OP2' H2'' ' D' ' 21' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-C2' 107.385 1.168 . . . . 115.7 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' ' DT' . . . . . 0.715 H2'' ' C8 ' ' D' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.402 -2.403 0 C5'-C4'-C3' 109.442 -3.505 . . . . 93.170000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' ' DA' . . . . . 0.715 ' C8 ' H2'' ' D' ' 23' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.416 -1.116 0 P-O3'-C3' 117.766 -1.612 . . . . 63.159999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' ' DC' . . . . . 0.726 H2'' " H5'" ' D' ' 26' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.409 -1.925 0 O4'-C1'-N19 106.488 -1.641 . . . . 58.869999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' ' DC' . . . . . 0.726 " H5'" H2'' ' D' ' 25' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.41 -1.89 0 C4'-C3'-O3' 104.921 -2.445 . . . . 58.619999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' ' DG' . . . . . 0.954 H2'' H5'' ' D' ' 28' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.417 -1.427 0 C5'-C4'-C3' 110.429 -2.847 . . . . 79.260000000000005 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' ' DG' . . . . . 0.954 H5'' H2'' ' D' ' 27' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.411 -1.827 0 C5'-C4'-C3' 111.448 -2.168 . . . . 87.209999999999994 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.417 -1.432 0 C5'-C4'-C3' 110.498 -2.802 . . . . 82.150000000000006 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.001 0 C2'-C3'-O3' 106.09 -1.67 . . . . 75.599999999999994 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.544 ' N ' ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.545 0 CA-C-O 120.811 0.339 . . . . 118.43000000000001 111.789 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -125.87 132.54 52.16 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 117.224 2.305 . . . . 73.719999999999999 117.224 -177.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' A' ' 40' ' ' CYS . 27.4 p -62.23 140.89 58.45 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 108.394 -0.965 . . . . 81.060000000000002 108.394 179.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.586 HG13 ' CD2' ' A' ' 73' ' ' PHE . 4.0 t -36.99 -61.73 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.755 0 N-CA-C 112.676 0.621 . . . . 80.879999999999995 112.676 -178.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.495 ' O ' ' HB3' ' A' ' 42' ' ' GLN . 41.9 tp10 -49.74 -54.63 17.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 113.859 1.059 . . . . 96.340000000000003 113.859 -179.774 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.792 ' CB ' ' HB2' ' A' ' 47' ' ' CYS . 7.6 m -54.83 -37.94 66.76 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 119.299 -0.96 . . . . 73.290000000000006 110.454 179.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 38' ' ' VAL . 77.8 mtt180 -61.6 -38.41 87.46 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.302 -0.863 . . . . 61.920000000000002 108.854 177.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.636 ' HG3' ' NE2' ' A' ' 43' ' ' GLN . 56.1 tp60 -59.72 -52.97 63.21 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.825 -0.625 . . . . 56.479999999999997 110.706 179.818 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.636 ' NE2' ' HG3' ' A' ' 42' ' ' GLN . 4.9 mp0 -89.17 11.33 18.97 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.925 0.713 . . . . 78.590000000000003 112.925 -179.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.403 ' NZ ' ' N7 ' ' D' ' 27' ' ' ' DG' . 89.1 mttt 45.64 48.35 11.37 Favored 'General case' 0 CA--C 1.48 -1.743 0 N-CA-C 108.691 -0.855 . . . . 54.840000000000003 108.691 179.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.2 p -116.34 150.28 37.94 Favored 'General case' 0 CA--C 1.505 -0.774 0 C-N-CA 119.551 -0.86 . . . . 90.459999999999994 110.311 -177.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -49.5 120.78 4.42 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.058 -0.657 . . . . 91.0 109.242 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.792 ' HB2' ' CB ' ' A' ' 40' ' ' CYS . 16.5 t -111.0 133.46 53.37 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 102.699 -3.074 . . . . 72.969999999999999 102.699 178.532 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . . . -118.3 67.72 0.77 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.053 -0.659 . . . . 99.620000000000005 110.641 -179.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.605 ' O ' ' C ' ' A' ' 50' ' ' CYS . . . -77.28 -84.11 0.07 Allowed 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.168 0.803 . . . . 99.0 113.168 -179.104 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.605 ' C ' ' O ' ' A' ' 49' ' ' ALA . . . -25.29 -64.88 0.06 Allowed 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 106.525 -1.657 . . . . 119.5 106.525 179.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.6 ' O ' ' N ' ' A' ' 53' ' ' ALA . 54.7 mp0 -37.81 -96.16 0.0 OUTLIER 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.29 -0.868 . . . . 173.66999999999999 109.852 179.469 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.445 ' O ' ' O ' ' A' ' 53' ' ' ALA . . . -54.07 76.85 0.0 OUTLIER 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.538 0.685 . . . . 116.79000000000001 111.059 -179.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.6 ' N ' ' O ' ' A' ' 51' ' ' GLU . . . 0.2 -146.02 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 120.794 3.628 . . . . 128.90000000000001 120.794 179.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . . . -56.94 -20.39 36.33 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 122.191 1.927 . . . . 118.03 111.631 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . . . -65.37 124.87 88.28 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.567 -0.742 . . . . 130.41 109.443 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -40.92 153.22 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 124.489 3.459 . . . . 109.98 112.528 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 60' ' ' CYS . 0.1 OUTLIER -48.7 146.69 2.97 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.775 -0.37 . . . . 95.030000000000001 110.794 -179.275 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . 0.546 ' O ' ' HB3' ' A' ' 61' ' ' ALA . 19.9 m -51.8 -63.85 1.0 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.66 0.985 . . . . 103.31 113.66 -179.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . . . -49.17 -39.28 28.63 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 109.716 -0.476 . . . . 112.52 109.716 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.409 ' HB2' ' SG ' ' A' ' 57' ' ' CYS . 28.6 m -64.44 -3.99 3.52 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.864 0.84 . . . . 94.280000000000001 110.451 179.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.596 ' O ' ' N ' ' A' ' 64' ' ' ASN . . . -83.38 -72.66 0.44 Allowed 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 104.417 -2.438 . . . . 94.170000000000002 104.417 177.555 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.537 ' C ' ' O ' ' A' ' 61' ' ' ALA . . . -35.18 -45.7 0.31 Allowed 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.635 -1.246 . . . . 88.129999999999995 107.635 179.622 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . . . -75.61 -33.19 60.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.771 -0.65 . . . . 79.069999999999993 112.279 -179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.596 ' N ' ' O ' ' A' ' 61' ' ' ALA . 18.6 t-20 55.45 76.74 0.25 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 105.646 -1.983 . . . . 98.0 105.646 -177.977 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.4 m -143.5 163.12 38.56 Favored Pre-proline 0 N--CA 1.447 -0.587 0 N-CA-C 107.336 -1.357 . . . . 102.03 107.336 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -64.53 101.89 0.38 Allowed 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.168 1.912 . . . . 100.72 109.244 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.5 t -74.85 78.34 2.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.748 -0.66 . . . . 91.469999999999999 110.602 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.479 ' O ' HD22 ' A' ' 69' ' ' LEU . . . -75.37 155.54 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 112.357 0.503 . . . . 66.069999999999993 112.357 179.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.479 HD22 ' O ' ' A' ' 68' ' ' ILE . 0.4 OUTLIER -128.18 79.51 1.91 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.473 -0.33 . . . . 74.319999999999993 110.503 179.874 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.552 ' O ' ' N ' ' A' ' 72' ' ' ASP . . . -102.4 78.91 1.78 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 120.103 -0.639 . . . . 81.629999999999995 111.511 -180.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . . . -31.44 -23.69 0.0 OUTLIER 'General case' 0 C--O 1.239 0.509 0 N-CA-C 115.254 1.575 . . . . 81.939999999999998 115.254 -179.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.552 ' N ' ' O ' ' A' ' 70' ' ' LYS . 11.8 p-10 -99.88 26.46 6.31 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 112.164 0.431 . . . . 129.93000000000001 112.164 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.586 ' CD2' HG13 ' A' ' 38' ' ' VAL . 46.2 t80 -97.32 148.59 22.98 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.272 1.212 . . . . 104.37 114.272 -179.475 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.409 ' HG2' ' C ' ' A' ' 73' ' ' PHE . 4.0 mtt180 -140.29 118.69 12.16 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.901 -0.591 . . . . 132.93000000000001 109.485 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.683 HH11 ' HG3' ' A' ' 75' ' ' ARG . 4.3 ptm180 -41.05 145.56 0.21 Allowed 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 114.189 1.181 . . . . 67.0 114.189 -178.768 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.9 m -91.2 136.61 32.97 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 106.697 -1.594 . . . . 86.019999999999996 106.697 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -86.96 67.94 9.93 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 119.855 -0.738 . . . . 53.200000000000003 111.048 179.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.506 ' HZ3' ' P ' ' D' ' 25' ' ' ' DC' . 2.8 mmmm -26.83 -70.52 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 116.033 1.864 . . . . 78.579999999999998 116.033 179.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.657 ' N ' ' OP1' ' D' ' 26' ' ' ' DC' . 3.0 tpp180 -41.2 -85.14 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 108.719 -0.845 . . . . 111.58 108.719 179.336 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -37.75 -46.45 0.91 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.491 0.922 . . . . 85.0 113.491 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.739 ' HD3' ' N ' ' A' ' 82' ' ' ASN . 0.0 OUTLIER -54.17 -76.2 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.943 -0.572 . . . . 97.959999999999994 110.704 -179.924 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.739 ' N ' ' HD3' ' A' ' 81' ' ' ARG . 7.1 m120 -42.74 -33.61 0.77 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.724 -0.671 . . . . 106.98999999999999 110.9 -179.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -62.81 -39.56 94.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.426 0.631 . . . . 120.11 110.092 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 81' ' ' ARG . . . -66.15 -58.39 5.53 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 104.898 -2.26 . . . . 78.540000000000006 104.898 177.938 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.6 mm -35.48 -67.43 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 CA-C-N 115.551 -0.75 . . . . 79.239999999999995 109.386 178.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -47.18 -45.36 22.9 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.09 -0.505 . . . . 110.48999999999999 112.36 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.9 tttm -58.22 -50.2 74.4 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.295 -0.962 . . . . 104.05 109.295 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -57.25 -67.58 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.845 -0.428 . . . . 125.54000000000001 109.845 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -38.11 -35.11 0.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.354 -0.384 . . . . 95.340000000000003 111.143 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.504 ' O ' ' C ' ' A' ' 91' ' ' GLU . . . -57.73 -78.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.382 -0.599 . . . . 93.629999999999995 109.382 179.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.531 ' O ' ' N ' ' A' ' 94' ' ' ARG . . . -28.35 -63.75 0.1 Allowed 'General case' 0 C--N 1.332 -0.192 0 O-C-N 123.358 0.411 . . . . 81.239999999999995 110.679 179.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.467 ' C ' ' O ' ' A' ' 91' ' ' GLU . . . -33.23 -49.76 0.28 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.201 -0.454 . . . . 104.77 110.624 -179.848 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 90' ' ' LYS . 15.2 p -61.92 -51.13 69.4 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.764 -0.828 . . . . 114.87 108.764 178.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' A' ' 91' ' ' GLU . . . -56.88 -17.34 9.11 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.439 -0.578 . . . . 110.78 109.439 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . . . -76.21 -51.08 12.84 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 104.089 -2.56 . . . . 96.219999999999999 104.089 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . . . -58.21 -16.11 12.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.997 -1.001 . . . . 97.849999999999994 109.724 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . 0.523 ' OG1' ' HA ' ' A' ' 94' ' ' ARG . 27.4 m -73.89 -4.76 36.98 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 106.642 -1.614 . . . . 122.0 106.642 179.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . . . -127.54 -82.64 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.257 -0.883 . . . . 125.09999999999999 110.059 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.192 0 CA-C-O 116.886 -1.531 . . . . 84.390000000000001 110.233 -179.679 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.597 ' CD2' ' N ' ' B' ' 35' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 111.404 0.149 . . . . 106.06 111.404 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -126.72 132.87 51.03 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 116.963 2.208 . . . . 72.269999999999996 116.963 -178.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' B' ' 40' ' ' CYS . 28.7 p -62.46 140.58 58.59 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.312 -0.996 . . . . 72.129999999999995 108.312 179.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.587 HG13 ' CD2' ' B' ' 73' ' ' PHE . 3.9 t -36.61 -61.5 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.599 0 N-CA-C 112.795 0.665 . . . . 76.760000000000005 112.795 -178.713 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.493 ' O ' ' HB3' ' B' ' 42' ' ' GLN . 41.3 tp10 -50.16 -54.68 19.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.979 1.103 . . . . 110.37 113.979 -179.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' CYS . . . . . 0.809 ' CB ' ' HB2' ' B' ' 47' ' ' CYS . 8.3 m -54.61 -38.34 66.66 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 119.291 -0.963 . . . . 94.040000000000006 110.523 179.069 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' B' ' 38' ' ' VAL . 76.0 mtt180 -61.27 -38.21 85.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.467 -0.938 . . . . 63.789999999999999 108.467 177.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLN . . . . . 0.645 ' HG3' ' NE2' ' B' ' 43' ' ' GLN . 56.1 tp60 -60.08 -53.09 61.86 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 116.387 -0.369 . . . . 59.439999999999998 110.761 179.994 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLN . . . . . 0.645 ' NE2' ' HG3' ' B' ' 42' ' ' GLN . 5.0 mp0 -88.86 11.03 19.07 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.482 0.919 . . . . 84.920000000000002 113.482 -179.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.564 ' NZ ' ' N7 ' ' C' ' 12' ' ' ' DG' . 90.2 mttt 46.28 49.04 13.13 Favored 'General case' 0 CA--C 1.483 -1.62 0 N-CA-C 107.53 -1.285 . . . . 60.020000000000003 107.53 178.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 42.4 p -117.01 150.22 38.98 Favored 'General case' 0 CA--C 1.502 -0.892 0 C-N-CA 119.89 -0.724 . . . . 96.650000000000006 110.151 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . . . -49.37 120.34 4.01 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.144 -0.622 . . . . 103.20999999999999 109.372 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' CYS . . . . . 0.809 ' HB2' ' CB ' ' B' ' 40' ' ' CYS . 15.3 t -110.8 133.98 52.9 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 102.608 -3.108 . . . . 81.819999999999993 102.608 178.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . . . -118.63 67.42 0.77 Allowed 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.19 -0.604 . . . . 101.12 110.544 -179.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ALA . . . . . 0.614 ' O ' ' C ' ' B' ' 50' ' ' CYS . . . -77.12 -83.87 0.07 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.311 0.856 . . . . 93.650000000000006 113.311 -179.467 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' CYS . . . . . 0.614 ' C ' ' O ' ' B' ' 49' ' ' ALA . . . -25.57 -64.78 0.06 Allowed 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 106.469 -1.678 . . . . 114.27 106.469 179.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.598 ' O ' ' N ' ' B' ' 53' ' ' ALA . 54.7 mp0 -37.82 -96.29 0.0 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.295 -0.866 . . . . 179.5 109.698 179.523 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ARG . . . . . 0.431 ' O ' ' O ' ' B' ' 53' ' ' ALA . . . -53.87 76.62 0.0 OUTLIER 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.337 0.589 . . . . 96.790000000000006 111.173 -179.653 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ALA . . . . . 0.598 ' N ' ' O ' ' B' ' 51' ' ' GLU . . . 0.22 -146.11 0.0 OUTLIER Pre-proline 0 N--CA 1.466 0.369 0 N-CA-C 120.813 3.635 . . . . 130.03 120.813 179.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' PRO . . . . . . . . . . . . . . . -56.78 -20.47 35.53 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.082 1.855 . . . . 128.59999999999999 111.715 -179.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . . . -65.44 124.98 88.65 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 115.592 -0.731 . . . . 127.05 109.521 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -40.83 153.03 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 124.592 3.528 . . . . 106.23999999999999 112.557 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.5 146.43 2.95 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.812 0.339 . . . . 95.340000000000003 110.839 -179.397 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' THR . . . . . 0.555 ' O ' ' HB3' ' B' ' 61' ' ' ALA . 19.3 m -51.46 -64.13 0.91 Allowed 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.64 0.978 . . . . 109.13 113.64 -179.177 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . . . -49.03 -38.93 25.29 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 109.875 -0.417 . . . . 101.7 109.875 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 25.5 m -64.81 -4.35 4.29 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.843 0.83 . . . . 95.609999999999999 110.163 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ALA . . . . . 0.602 ' O ' ' N ' ' B' ' 64' ' ' ASN . . . -83.12 -72.84 0.43 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 104.446 -2.427 . . . . 105.59 104.446 177.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.537 ' C ' ' O ' ' B' ' 61' ' ' ALA . . . -35.12 -45.67 0.3 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.585 -1.265 . . . . 94.989999999999995 107.585 179.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . . . -75.77 -32.98 60.17 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.804 -0.635 . . . . 88.280000000000001 112.314 -179.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ASN . . . . . 0.602 ' N ' ' O ' ' B' ' 61' ' ' ALA . 18.6 t-20 55.19 76.67 0.25 Allowed 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 105.647 -1.983 . . . . 111.23 105.647 -178.174 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.9 m -143.26 163.04 39.66 Favored Pre-proline 0 C--O 1.24 0.586 0 N-CA-C 107.514 -1.291 . . . . 94.760000000000005 107.514 179.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_exo -64.53 101.72 0.38 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.235 1.956 . . . . 93.599999999999994 109.154 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' CYS . . . . . . . . . . . . . 49.8 t -74.91 78.5 2.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.723 -0.671 . . . . 97.540000000000006 110.357 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.52 ' O ' HD22 ' B' ' 69' ' ' LEU . . . -75.43 155.43 6.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 112.306 0.484 . . . . 67.569999999999993 112.306 179.582 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.52 HD22 ' O ' ' B' ' 68' ' ' ILE . 0.6 OUTLIER -128.05 79.45 1.9 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.363 -0.38 . . . . 88.909999999999997 110.323 179.931 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' B' ' 72' ' ' ASP . . . -102.16 79.26 1.85 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 120.102 -0.639 . . . . 80.420000000000002 111.346 179.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . . . -31.79 -23.86 0.0 OUTLIER 'General case' 0 C--O 1.233 0.219 0 N-CA-C 115.253 1.575 . . . . 88.659999999999997 115.253 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.554 ' N ' ' O ' ' B' ' 70' ' ' LYS . 11.7 p-10 -99.68 26.82 5.84 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 112.19 0.441 . . . . 121.91 112.19 -179.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.587 ' CD2' HG13 ' B' ' 38' ' ' VAL . 45.9 t80 -97.85 148.74 23.11 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 114.094 1.146 . . . . 108.94 114.094 -179.376 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ARG . . . . . 0.407 ' HG2' ' C ' ' B' ' 73' ' ' PHE . 3.9 mtt180 -140.54 118.9 12.13 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.769 -0.651 . . . . 123.70999999999999 109.494 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ARG . . . . . 0.689 ' HG3' HH11 ' B' ' 75' ' ' ARG . 4.2 ptm180 -41.66 145.89 0.27 Allowed 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 113.855 1.057 . . . . 85.010000000000005 113.855 -178.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 86.1 m -91.61 138.2 31.76 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 106.873 -1.528 . . . . 92.769999999999996 106.873 178.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -91.34 69.71 6.0 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.392 -0.923 . . . . 64.700000000000003 110.899 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LYS . . . . . 0.608 ' HZ3' ' P ' ' C' ' 10' ' ' ' DC' . 2.8 mmmm -27.21 -70.57 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.97 1.841 . . . . 70.430000000000007 115.97 -179.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ARG . . . . . 0.642 ' N ' ' OP1' ' C' ' 11' ' ' ' DC' . 3.0 tpp180 -41.08 -85.15 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.549 -0.908 . . . . 112.34 108.549 179.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -37.72 -46.58 0.91 Allowed 'General case' 0 C--O 1.234 0.257 0 N-CA-C 113.517 0.932 . . . . 82.120000000000005 113.517 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.733 ' HD3' ' N ' ' B' ' 82' ' ' ASN . 0.0 OUTLIER -54.34 -75.82 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.842 -0.617 . . . . 84.890000000000001 110.889 -179.992 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ASN . . . . . 0.733 ' N ' ' HD3' ' B' ' 81' ' ' ARG . 7.0 m120 -42.9 -33.42 0.78 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.864 -0.607 . . . . 95.659999999999997 110.783 -179.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -62.96 -39.79 95.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.356 0.598 . . . . 118.19 110.049 179.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.445 ' N ' ' O ' ' B' ' 81' ' ' ARG . . . -66.13 -57.78 6.89 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.982 -2.229 . . . . 75.900000000000006 104.982 177.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ILE . . . . . . . . . . . . . 3.7 mm -35.96 -67.31 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 CA-C-N 115.702 -0.681 . . . . 83.959999999999994 109.439 178.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -47.36 -45.42 24.87 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.014 -0.539 . . . . 112.34 112.444 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -57.96 -50.38 73.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.299 -0.96 . . . . 104.68000000000001 109.18 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -57.11 -67.71 0.29 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.828 -0.434 . . . . 129.71000000000001 109.828 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -37.89 -34.99 0.13 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.255 -0.43 . . . . 83.290000000000006 111.118 178.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.491 ' O ' ' C ' ' B' ' 91' ' ' GLU . . . -57.85 -78.5 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.386 -0.598 . . . . 103.68000000000001 109.386 179.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.524 ' O ' ' N ' ' B' ' 94' ' ' ARG . . . -28.53 -63.52 0.1 Allowed 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.436 0.46 . . . . 77.980000000000004 110.687 179.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.458 ' C ' ' O ' ' B' ' 91' ' ' GLU . . . -33.37 -49.57 0.28 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.207 -0.451 . . . . 106.59 110.695 -179.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' THR . . . . . 0.428 ' N ' ' O ' ' B' ' 90' ' ' LYS . 15.6 p -62.17 -50.94 69.84 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 119.69 -0.804 . . . . 115.68000000000001 108.837 178.822 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' B' ' 91' ' ' GLU . . . -57.0 -17.46 9.9 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.541 -0.54 . . . . 110.28 109.541 179.048 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . . . -75.96 -50.98 13.4 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 104.261 -2.496 . . . . 95.680000000000007 104.261 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . . . -58.53 -16.05 13.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.022 -0.99 . . . . 108.7 109.585 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' THR . . . . . 0.516 ' OG1' ' HA ' ' B' ' 94' ' ' ARG . 27.4 m -73.82 -4.85 37.3 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 106.557 -1.645 . . . . 116.95999999999999 106.557 179.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . . . -127.47 -83.0 0.6 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.352 -0.84 . . . . 117.67 110.007 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.166 -1.397 . . . . 91.319999999999993 110.354 179.968 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' HOH . . . . . 0.524 ' O ' ' NE2' ' B' ' 43' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_