data_1b5m_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 1b5m _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.451 0 N-CA-C 114.363 1.246 . . . . 100.0 114.363 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t -56.86 141.68 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 O-C-N 124.948 1.405 . . . . 96.69 108.687 178.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 73.4 m -90.44 151.27 21.48 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 125.54 1.536 . . . . 100.0 114.099 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . 0.263 2.2 m-85 -126.09 151.91 46.56 Favored 'General case' 0 CA--C 1.465 -2.315 0 C-N-CA 115.32 -2.552 . . . . 62.84 113.924 175.329 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -118.19 171.08 8.36 Favored 'General case' 0 CA--C 1.492 -1.276 0 O-C-N 126.412 2.32 . . . . 43.75 108.79 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ARG . . . . . 0.531 ' NH2' ' CD2' ' A' ' 80' ' ' HIS . 0.0 OUTLIER -128.21 137.53 52.07 Favored 'General case' 0 C--N 1.269 -2.91 0 CA-C-N 111.734 -2.485 . . . . 100.0 105.331 -179.636 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.8 mt -36.84 -48.02 0.72 Allowed 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 122.931 1.348 . . . . 40.48 111.645 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -54.56 -53.36 55.52 Favored 'General case' 0 N--CA 1.424 -1.741 0 O-C-N 120.855 -1.153 . . . . 100.0 112.899 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . 0.422 ' OE1' ' N ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -62.99 -39.7 95.55 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 116.699 -2.0 . . . . 87.13 108.075 -178.779 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . 0.269 43.4 t -54.0 -51.13 48.87 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 CA-C-O 123.412 1.577 . . . . 45.12 108.819 -177.46 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.66 -22.97 9.9 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 116.702 2.112 . . . . 40.41 116.702 -178.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . 0.403 ' CE ' ' CA ' ' A' ' 11' ' ' GLU . 12.3 mtmt -70.93 -21.13 62.39 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.081 -1.047 . . . . 81.37 112.376 -178.188 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -89.12 44.97 1.25 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 117.16 2.281 . . . . 67.55 117.16 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.98 2.02 25.26 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.746 2.418 . . . . 90.16 114.905 -178.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' THR . . . . . 0.459 ' O ' ' OG1' ' A' ' 21' ' ' THR . 0.9 OUTLIER -106.49 176.68 5.09 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 118.417 2.747 . . . . 63.31 118.417 -178.138 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.08 -23.38 41.34 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 112.812 -1.995 . . . . 46.88 107.38 179.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -66.98 -40.02 87.33 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 111.887 -2.415 . . . . 100.0 107.218 177.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -153.46 113.94 4.01 Favored 'General case' 0 N--CA 1.422 -1.867 0 CA-C-N 113.548 -1.66 . . . . 100.0 111.046 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 17' ' ' THR . 11.1 m -111.28 123.69 50.71 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 127.608 3.067 . . . . 36.6 116.921 -179.053 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 40.7 m0 -125.73 159.44 32.3 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 104.379 -2.452 . . . . 35.41 104.379 178.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.1 ttp -160.05 157.51 28.78 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 128.738 2.815 . . . . 32.28 108.234 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.6 t -123.21 122.1 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.001 0 N-CA-C 106.661 -1.607 . . . . 35.1 106.661 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 14.0 mt -128.49 124.24 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 N-CA-C 104.956 -2.238 . . . . 39.03 104.956 179.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HIS . . . . . 0.475 ' N ' ' OG1' ' A' ' 55' ' ' THR . 40.3 m-70 45.94 49.57 11.84 Favored 'General case' 0 CA--C 1.548 0.896 0 O-C-N 125.452 1.72 . . . . 56.5 114.109 179.832 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 63.02 29.42 74.31 Favored Glycine 0 CA--C 1.505 -0.587 0 N-CA-C 119.447 2.539 . . . . 23.7 119.447 178.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -132.16 138.46 48.04 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 106.774 -1.565 . . . . 100.0 106.774 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . 0.423 ' N ' ' O ' ' A' ' 77' ' ' GLY . 98.6 t -94.53 153.58 3.44 Favored 'Isoleucine or valine' 0 C--O 1.256 1.429 0 N-CA-C 107.42 -1.326 . . . . 30.19 107.42 -179.481 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -146.83 153.81 40.61 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 126.993 2.683 . . . . 39.5 112.36 178.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASP . . . . . 0.514 ' OD1' ' OG1' ' A' ' 33' ' ' THR . 40.1 t0 -111.83 98.45 7.39 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-O 123.394 1.569 . . . . 68.68 107.036 177.031 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . 0.529 ' O ' ' C ' ' A' ' 33' ' ' THR . 2.9 mp -82.41 -6.4 9.93 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-N 110.94 -2.846 . . . . 88.28 111.834 -176.965 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' THR . . . . . 0.529 ' C ' ' O ' ' A' ' 32' ' ' ILE 0.35 60.9 m -29.56 -59.24 0.16 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 115.1 1.518 . . . . 50.93 115.1 -176.711 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 68.1 mtm180 -74.48 -12.45 60.49 Favored 'General case' 0 C--O 1.209 -1.057 0 N-CA-C 118.438 2.755 . . . . 100.0 118.438 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PHE . . . . . 0.45 ' O ' ' N ' ' A' ' 38' ' ' GLU . 38.8 t80 -82.58 -38.52 23.53 Favored 'General case' 0 C--O 1.204 -1.313 0 N-CA-C 117.445 2.387 . . . . 38.61 117.445 -178.283 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 74.9 mt -21.77 -51.53 0.02 OUTLIER 'General case' 0 CA--C 1.492 -1.254 0 C-N-CA 128.986 2.914 . . . . 47.74 118.24 -179.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 56.8 m -68.7 -27.53 66.04 Favored 'General case' 0 CA--C 1.511 -0.538 0 O-C-N 127.529 3.018 . . . . 73.4 112.654 -179.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . 0.642 ' N ' ' OE1' ' A' ' 38' ' ' GLU . 12.6 mp0 -87.22 -35.53 18.48 Favored 'General case' 0 CA--C 1.488 -1.427 0 O-C-N 125.892 1.995 . . . . 97.66 110.424 -178.826 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -51.99 106.06 0.61 Allowed Pre-proline 0 C--N 1.366 1.288 0 O-C-N 127.706 3.129 . . . . 30.15 113.8 -178.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -57.61 -40.3 81.31 Favored 'Trans proline' 0 CA--C 1.554 1.504 1 C-N-CA 126.179 4.586 . . . . 30.2 111.482 179.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . 0.452 ' CA ' ' C3D' ' A' ' 201' ' ' HEM . . . -81.72 14.31 31.53 Favored Glycine 0 CA--C 1.547 2.064 0 O-C-N 120.255 -1.528 . . . . 40.14 113.842 177.905 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 117.56 153.6 9.72 Favored Glycine 0 CA--C 1.546 1.97 0 CA-C-O 127.345 3.747 . . . . 54.03 121.174 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -94.35 -37.41 11.49 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 110.652 -2.774 . . . . 90.86 108.847 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -82.24 -21.05 36.48 Favored 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 116.067 1.877 . . . . 38.39 116.067 -174.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 4.0 p -72.04 -40.23 67.03 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.134 0 C-N-CA 119.643 -0.823 . . . . 37.72 110.904 -176.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . 0.507 ' O ' ' N ' ' A' ' 49' ' ' GLN . 36.3 mt -72.01 -50.45 28.51 Favored 'General case' 0 C--O 1.2 -1.548 0 C-N-CA 127.509 2.324 . . . . 31.21 110.099 179.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.3 mt -62.47 -26.05 68.31 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 127.472 3.511 . . . . 34.25 104.774 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.72 -16.62 63.19 Favored 'General case' 0 C--N 1.259 -3.367 0 C-N-CA 114.544 -2.862 . . . . 100.0 108.701 178.247 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' A' ' 46' ' ' LEU . 2.3 mt-30 -134.65 32.66 3.28 Favored 'General case' 0 C--O 1.254 1.315 0 N-CA-C 115.845 1.794 . . . . 85.89 115.845 -179.027 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.16 141.27 50.95 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.987 -0.551 . . . . 38.69 109.83 -179.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.89 -21.92 3.08 Favored Glycine 0 C--O 1.213 -1.166 0 C-N-CA 118.38 -1.867 . . . . 45.36 111.445 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.54 167.06 22.24 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 123.965 1.841 . . . . 42.32 114.376 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -97.37 93.79 6.7 Favored 'General case' 0 N--CA 1.415 -2.188 0 N-CA-C 101.492 -3.521 . . . . 68.37 101.492 176.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . 0.51 ' O ' ' C ' ' A' ' 55' ' ' THR 0.281 . . -78.83 12.34 2.19 Favored 'General case' 0 N--CA 1.411 -2.395 0 C-N-CA 113.906 -3.118 . . . . 25.52 113.453 -178.449 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . 0.51 ' C ' ' O ' ' A' ' 54' ' ' ALA 0.484 21.1 m -39.43 -68.33 0.17 Allowed 'General case' 0 C--N 1.298 -1.645 0 O-C-N 119.743 -1.848 . . . . 38.6 115.031 -179.382 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -49.0 -44.71 41.47 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 123.29 1.519 . . . . 100.0 109.773 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . 0.435 ' OG ' ' OE1' ' A' ' 49' ' ' GLN 1.207 0.1 OUTLIER -63.13 -46.21 88.31 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 120.02 3.341 . . . . 34.27 120.02 179.775 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -67.28 -29.75 69.43 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 120.517 -1.365 . . . . 38.59 111.366 -179.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . 0.64 ' OE2' ' NH2' ' A' ' 68' ' ' ARG . 17.2 mm-40 -80.16 -25.69 39.69 Favored 'General case' 0 C--N 1.297 -1.69 0 C-N-CA 115.434 -2.507 . . . . 85.96 109.918 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.37 -0.72 30.18 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 114.888 1.44 . . . . 100.0 114.888 -178.622 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . 0.499 ' O ' ' O ' ' A' ' 62' ' ' GLY . 8.0 t -114.74 -8.5 12.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 125.491 2.567 . . . . 45.99 109.572 -177.077 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . 0.499 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 59.87 113.18 0.01 OUTLIER Glycine 0 N--CA 1.436 -1.309 0 N-CA-C 108.373 -1.891 . . . . 43.15 108.373 -178.141 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' HIS . . . . . 0.502 ' CE1' ' C4C' ' A' ' 201' ' ' HEM . 46.0 m80 -126.34 140.35 52.58 Favored 'General case' 0 N--CA 1.428 -1.549 0 N-CA-C 102.198 -3.26 . . . . 28.92 102.198 176.71 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.0 p -67.2 179.88 0.51 Allowed Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 129.303 3.041 . . . . 43.37 116.189 -177.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PRO . . . . . 0.469 ' O ' ' OE2' ' A' ' 69' ' ' GLU . 4.4 Cg_exo -79.61 -27.13 4.29 Favored 'Trans proline' 0 N--CA 1.436 -1.864 0 N-CA-C 106.526 -2.144 . . . . 39.9 106.526 178.709 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . 0.429 ' N ' ' OD1' ' A' ' 66' ' ' ASP 0.306 0.5 OUTLIER -64.74 -39.16 93.17 Favored 'General case' 0 C--O 1.256 1.439 0 CA-C-N 112.897 -1.956 . . . . 83.16 113.326 -178.902 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.86 -25.82 62.99 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 122.719 1.247 . . . . 40.18 109.547 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . 0.64 ' NH2' ' OE2' ' A' ' 59' ' ' GLU . 10.5 mtt-85 -72.04 -39.07 69.37 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-N 113.18 -1.827 . . . . 37.09 111.258 -177.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . 0.469 ' OE2' ' O ' ' A' ' 65' ' ' PRO . 1.1 mt-10 -68.93 -32.96 72.95 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 110.113 -3.221 . . . . 100.0 108.499 179.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.46 -28.15 66.79 Favored 'General case' 0 CA--C 1.475 -1.94 0 C-N-CA 125.678 1.591 . . . . 53.13 109.66 -178.295 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.8 tp -60.52 -36.36 78.21 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 110.848 -2.887 . . . . 34.32 111.048 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -58.22 -21.24 47.06 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 114.532 1.308 . . . . 100.0 114.532 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 17.4 mp0 -90.34 -0.34 57.6 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 115.944 -2.303 . . . . 100.0 112.962 -177.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -121.72 14.81 10.96 Favored 'General case' 0 CA--C 1.496 -1.127 0 C-N-CA 115.948 -2.301 . . . . 66.39 112.373 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TYR . . . . . 0.532 ' OH ' ' OD1' ' A' ' 78' ' ' ASP . 86.6 t80 -72.65 133.61 44.72 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 124.746 2.213 . . . . 82.95 116.659 -177.899 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . 0.308 44.0 pt -122.24 -13.14 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.356 0 C-N-CA 114.103 -3.039 . . . . 44.58 112.678 -179.802 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 29' ' ' VAL . . . 160.79 -169.99 36.59 Favored Glycine 0 C--N 1.345 1.082 0 O-C-N 124.788 1.305 . . . . 40.04 112.783 179.655 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . 0.532 ' OD1' ' OH ' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -118.11 159.52 23.11 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 114.61 -0.795 . . . . 37.77 109.527 178.438 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 14.3 t -67.88 147.11 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 N-CA-C 104.687 -2.338 . . . . 33.28 104.687 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' HIS . . . . . 0.531 ' CD2' ' NH2' ' A' ' 8' ' ' ARG . 27.3 t-80 -63.43 129.05 93.33 Favored Pre-proline 0 C--N 1.354 0.787 0 O-C-N 126.221 2.201 . . . . 40.59 110.647 179.544 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -46.29 -45.03 19.34 Favored 'Trans proline' 0 CA--C 1.482 -2.101 0 CA-C-O 123.007 1.17 . . . . 37.98 111.368 -178.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASN . . . . . 0.469 ' ND2' ' CE1' ' A' ' 80' ' ' HIS . 69.3 m-80 -64.76 -11.64 38.71 Favored 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 117.852 -1.539 . . . . 79.9 113.718 -178.923 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASP . . . . . 0.486 ' N ' ' O ' ' A' ' 80' ' ' HIS . 2.2 m-20 -99.19 -24.56 14.82 Favored 'General case' 0 C--O 1.259 1.599 0 O-C-N 125.481 1.738 . . . . 76.16 109.26 -179.101 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.1 mt -49.39 134.48 18.83 Favored 'General case' 0 C--O 1.25 1.13 0 CA-C-N 113.794 -1.548 . . . . 59.28 107.154 176.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LYS . . . . . 0.494 ' N ' ' CD ' ' A' ' 86' ' ' PRO 0.734 2.2 pttt -104.48 95.44 8.49 Favored Pre-proline 0 C--O 1.242 0.684 0 N-CA-C 117.023 2.231 . . . . 100.0 117.023 178.845 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 85' ' ' LYS . 26.9 Cg_exo . . . . . 0 N--CA 1.435 -1.933 0 C-N-CA 123.853 3.036 . . . . 100.0 114.032 177.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HEM . . . . . 0.502 ' C4C' ' CE1' ' A' ' 63' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.451 0 N-CA-C 114.363 1.246 . . . . 100.0 114.363 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t -56.86 141.68 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 O-C-N 124.948 1.405 . . . . 96.69 108.687 178.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . 0.526 HG22 ' N ' ' A' ' 6' ' ' TYR . 73.4 m -90.44 151.27 21.48 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 125.54 1.536 . . . . 100.0 114.099 -177.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' TYR . . . . . 0.659 ' CE2' ' HD3' ' A' ' 81' ' ' PRO 0.263 2.2 m-85 -126.09 151.91 46.56 Favored 'General case' 0 CA--C 1.465 -2.315 0 C-N-CA 115.32 -2.552 . . . . 62.84 113.924 175.329 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . 0.673 ' O ' ' HB2' ' A' ' 80' ' ' HIS . 61.2 m-85 -118.19 171.08 8.36 Favored 'General case' 0 CA--C 1.492 -1.276 0 O-C-N 126.412 2.32 . . . . 43.75 108.79 175.906 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ARG . . . . . 0.445 ' NH2' ' CE1' ' A' ' 80' ' ' HIS . 0.0 OUTLIER -128.21 137.53 52.07 Favored 'General case' 0 C--N 1.269 -2.91 0 CA-C-N 111.734 -2.485 . . . . 100.0 105.331 -179.636 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.8 mt -36.84 -48.02 0.72 Allowed 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 122.931 1.348 . . . . 40.48 111.645 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . 0.582 ' OE2' ' HD3' ' A' ' 14' ' ' LYS . 12.8 tm-20 -54.56 -53.36 55.52 Favored 'General case' 0 N--CA 1.424 -1.741 0 O-C-N 120.855 -1.153 . . . . 100.0 112.899 178.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . 0.887 ' HA ' ' HE2' ' A' ' 14' ' ' LYS . 0.1 OUTLIER -62.99 -39.7 95.55 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 116.699 -2.0 . . . . 87.13 108.075 -178.779 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . 0.269 43.4 t -54.0 -51.13 48.87 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 CA-C-O 123.412 1.577 . . . . 45.12 108.819 -177.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.66 -22.97 9.9 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 116.702 2.112 . . . . 40.41 116.702 -178.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . 0.887 ' HE2' ' HA ' ' A' ' 11' ' ' GLU . 12.3 mtmt -70.93 -21.13 62.39 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.081 -1.047 . . . . 81.37 112.376 -178.188 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . 0.817 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 2.1 mpt_? -89.12 44.97 1.25 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 117.16 2.281 . . . . 67.55 117.16 -178.149 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . 0.55 ' HA ' ' CB ' ' A' ' 50' ' ' ALA . 19.1 p30 -79.98 2.02 25.26 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.746 2.418 . . . . 90.16 114.905 -178.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -106.49 176.68 5.09 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 118.417 2.747 . . . . 63.31 118.417 -178.138 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.08 -23.38 41.34 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 112.812 -1.995 . . . . 46.88 107.38 179.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -66.98 -40.02 87.33 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 111.887 -2.415 . . . . 100.0 107.218 177.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -153.46 113.94 4.01 Favored 'General case' 0 N--CA 1.422 -1.867 0 CA-C-N 113.548 -1.66 . . . . 100.0 111.046 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . 0.481 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 11.1 m -111.28 123.69 50.71 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 127.608 3.067 . . . . 36.6 116.921 -179.053 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TRP . . . . . 0.817 ' CE3' ' HD3' ' A' ' 15' ' ' ARG . 40.7 m0 -125.73 159.44 32.3 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 104.379 -2.452 . . . . 35.41 104.379 178.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' MET . . . . . 0.675 ' HE1' ' CD1' ' A' ' 32' ' ' ILE . 2.1 ttp -160.05 157.51 28.78 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 128.738 2.815 . . . . 32.28 108.234 -179.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . 0.482 HG22 HG22 ' A' ' 29' ' ' VAL . 8.6 t -123.21 122.1 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.001 0 N-CA-C 106.661 -1.607 . . . . 35.1 106.661 179.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . 0.589 ' HA ' ' OG1' ' A' ' 55' ' ' THR . 14.0 mt -128.49 124.24 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 N-CA-C 104.956 -2.238 . . . . 39.03 104.956 179.072 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HIS . . . . . 0.415 ' N ' ' OG1' ' A' ' 55' ' ' THR . 40.3 m-70 45.94 49.57 11.84 Favored 'General case' 0 CA--C 1.548 0.896 0 O-C-N 125.452 1.72 . . . . 56.5 114.109 179.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 63.02 29.42 74.31 Favored Glycine 0 CA--C 1.505 -0.587 0 N-CA-C 119.447 2.539 . . . . 23.7 119.447 178.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . 0.679 ' HG2' ' HE1' ' A' ' 75' ' ' TYR . 1.2 mpt_? -132.16 138.46 48.04 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 106.774 -1.565 . . . . 100.0 106.774 177.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . 0.482 HG22 HG22 ' A' ' 24' ' ' VAL . 98.6 t -94.53 153.58 3.44 Favored 'Isoleucine or valine' 0 C--O 1.256 1.429 0 N-CA-C 107.42 -1.326 . . . . 30.19 107.42 -179.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' TYR . . . . . 0.701 ' O ' ' HA ' ' A' ' 22' ' ' TRP . 8.2 m-85 -146.83 153.81 40.61 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 126.993 2.683 . . . . 39.5 112.36 178.276 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASP . . . . . 0.481 ' HA ' ' O ' ' A' ' 21' ' ' THR . 40.1 t0 -111.83 98.45 7.39 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-O 123.394 1.569 . . . . 68.68 107.036 177.031 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . 0.675 ' CD1' ' HE1' ' A' ' 23' ' ' MET . 2.9 mp -82.41 -6.4 9.93 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-N 110.94 -2.846 . . . . 88.28 111.834 -176.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' THR . . . . . 0.529 ' C ' ' O ' ' A' ' 32' ' ' ILE 0.35 60.9 m -29.56 -59.24 0.16 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 115.1 1.518 . . . . 50.93 115.1 -176.711 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 68.1 mtm180 -74.48 -12.45 60.49 Favored 'General case' 0 C--O 1.209 -1.057 0 N-CA-C 118.438 2.755 . . . . 100.0 118.438 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PHE . . . . . 0.431 ' O ' ' HB2' ' A' ' 38' ' ' GLU . 38.8 t80 -82.58 -38.52 23.53 Favored 'General case' 0 C--O 1.204 -1.313 0 N-CA-C 117.445 2.387 . . . . 38.61 117.445 -178.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . 0.55 HD23 HD12 ' A' ' 46' ' ' LEU . 74.9 mt -21.77 -51.53 0.02 OUTLIER 'General case' 0 CA--C 1.492 -1.254 0 C-N-CA 128.986 2.914 . . . . 47.74 118.24 -179.181 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 56.8 m -68.7 -27.53 66.04 Favored 'General case' 0 CA--C 1.511 -0.538 0 O-C-N 127.529 3.018 . . . . 73.4 112.654 -179.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . 0.642 ' N ' ' OE1' ' A' ' 38' ' ' GLU . 12.6 mp0 -87.22 -35.53 18.48 Favored 'General case' 0 CA--C 1.488 -1.427 0 O-C-N 125.892 1.995 . . . . 97.66 110.424 -178.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . 0.628 ' CD2' ' HD2' ' A' ' 40' ' ' PRO . 7.5 t-160 -51.99 106.06 0.61 Allowed Pre-proline 0 C--N 1.366 1.288 0 O-C-N 127.706 3.129 . . . . 30.15 113.8 -178.517 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . 0.628 ' HD2' ' CD2' ' A' ' 39' ' ' HIS . 8.2 Cg_exo -57.61 -40.3 81.31 Favored 'Trans proline' 0 CA--C 1.554 1.504 1 C-N-CA 126.179 4.586 . . . . 30.2 111.482 179.43 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . 0.71 ' HA3' ' C3D' ' A' ' 201' ' ' HEM . . . -81.72 14.31 31.53 Favored Glycine 0 CA--C 1.547 2.064 0 O-C-N 120.255 -1.528 . . . . 40.14 113.842 177.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 117.56 153.6 9.72 Favored Glycine 0 CA--C 1.546 1.97 0 CA-C-O 127.345 3.747 . . . . 54.03 121.174 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -94.35 -37.41 11.49 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 110.652 -2.774 . . . . 90.86 108.847 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -82.24 -21.05 36.48 Favored 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 116.067 1.877 . . . . 38.39 116.067 -174.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . 0.543 ' O ' ' HB2' ' A' ' 48' ' ' GLU . 4.0 p -72.04 -40.23 67.03 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.134 0 C-N-CA 119.643 -0.823 . . . . 37.72 110.904 -176.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . 0.55 HD12 HD23 ' A' ' 36' ' ' LEU . 36.3 mt -72.01 -50.45 28.51 Favored 'General case' 0 C--O 1.2 -1.548 0 C-N-CA 127.509 2.324 . . . . 31.21 110.099 179.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.3 mt -62.47 -26.05 68.31 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 127.472 3.511 . . . . 34.25 104.774 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . 0.543 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -64.72 -16.62 63.19 Favored 'General case' 0 C--N 1.259 -3.367 0 C-N-CA 114.544 -2.862 . . . . 100.0 108.701 178.247 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLN . . . . . 0.54 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 2.3 mt-30 -134.65 32.66 3.28 Favored 'General case' 0 C--O 1.254 1.315 0 N-CA-C 115.845 1.794 . . . . 85.89 115.845 -179.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . 0.55 ' CB ' ' HA ' ' A' ' 16' ' ' ASN . . . -58.16 141.27 50.95 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.987 -0.551 . . . . 38.69 109.83 -179.133 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.89 -21.92 3.08 Favored Glycine 0 C--O 1.213 -1.166 0 C-N-CA 118.38 -1.867 . . . . 45.36 111.445 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 49' ' ' GLN . . . -77.54 167.06 22.24 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 123.965 1.841 . . . . 42.32 114.376 -179.499 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . 0.521 ' OD1' ' HB ' ' A' ' 55' ' ' THR . 2.3 t0 -97.37 93.79 6.7 Favored 'General case' 0 N--CA 1.415 -2.188 0 N-CA-C 101.492 -3.521 . . . . 68.37 101.492 176.296 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . 0.51 ' O ' ' C ' ' A' ' 55' ' ' THR 0.281 . . -78.83 12.34 2.19 Favored 'General case' 0 N--CA 1.411 -2.395 0 C-N-CA 113.906 -3.118 . . . . 25.52 113.453 -178.449 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . 0.589 ' OG1' ' HA ' ' A' ' 25' ' ' ILE 0.484 21.1 m -39.43 -68.33 0.17 Allowed 'General case' 0 C--N 1.298 -1.645 0 O-C-N 119.743 -1.848 . . . . 38.6 115.031 -179.382 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -49.0 -44.71 41.47 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 123.29 1.519 . . . . 100.0 109.773 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . 1.207 0.1 OUTLIER -63.13 -46.21 88.31 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 120.02 3.341 . . . . 34.27 120.02 179.775 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -67.28 -29.75 69.43 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 120.517 -1.365 . . . . 38.59 111.366 -179.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . 0.633 ' OE2' ' NH2' ' A' ' 68' ' ' ARG . 17.2 mm-40 -80.16 -25.69 39.69 Favored 'General case' 0 C--N 1.297 -1.69 0 C-N-CA 115.434 -2.507 . . . . 85.96 109.918 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.37 -0.72 30.18 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 114.888 1.44 . . . . 100.0 114.888 -178.622 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . 0.499 ' O ' ' O ' ' A' ' 62' ' ' GLY . 8.0 t -114.74 -8.5 12.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 125.491 2.567 . . . . 45.99 109.572 -177.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . 0.499 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 59.87 113.18 0.01 OUTLIER Glycine 0 N--CA 1.436 -1.309 0 N-CA-C 108.373 -1.891 . . . . 43.15 108.373 -178.141 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' HIS . . . . . 0.502 ' CE1' ' C4C' ' A' ' 201' ' ' HEM . 46.0 m80 -126.34 140.35 52.58 Favored 'General case' 0 N--CA 1.428 -1.549 0 N-CA-C 102.198 -3.26 . . . . 28.92 102.198 176.71 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.0 p -67.2 179.88 0.51 Allowed Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 129.303 3.041 . . . . 43.37 116.189 -177.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PRO . . . . . 0.469 ' O ' ' OE2' ' A' ' 69' ' ' GLU . 4.4 Cg_exo -79.61 -27.13 4.29 Favored 'Trans proline' 0 N--CA 1.436 -1.864 0 N-CA-C 106.526 -2.144 . . . . 39.9 106.526 178.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . 0.545 ' O ' ' HG3' ' A' ' 70' ' ' MET 0.306 0.5 OUTLIER -64.74 -39.16 93.17 Favored 'General case' 0 C--O 1.256 1.439 0 CA-C-N 112.897 -1.956 . . . . 83.16 113.326 -178.902 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.86 -25.82 62.99 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 122.719 1.247 . . . . 40.18 109.547 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . 0.633 ' NH2' ' OE2' ' A' ' 59' ' ' GLU . 10.5 mtt-85 -72.04 -39.07 69.37 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-N 113.18 -1.827 . . . . 37.09 111.258 -177.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . 0.469 ' OE2' ' O ' ' A' ' 65' ' ' PRO . 1.1 mt-10 -68.93 -32.96 72.95 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 110.113 -3.221 . . . . 100.0 108.499 179.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -68.46 -28.15 66.79 Favored 'General case' 0 CA--C 1.475 -1.94 0 C-N-CA 125.678 1.591 . . . . 53.13 109.66 -178.295 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . 0.421 HD13 HMB2 ' A' ' 201' ' ' HEM . 3.8 tp -60.52 -36.36 78.21 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 110.848 -2.887 . . . . 34.32 111.048 178.725 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -58.22 -21.24 47.06 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 114.532 1.308 . . . . 100.0 114.532 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 17.4 mp0 -90.34 -0.34 57.6 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 115.944 -2.303 . . . . 100.0 112.962 -177.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -121.72 14.81 10.96 Favored 'General case' 0 CA--C 1.496 -1.127 0 C-N-CA 115.948 -2.301 . . . . 66.39 112.373 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TYR . . . . . 0.679 ' HE1' ' HG2' ' A' ' 28' ' ' ARG . 86.6 t80 -72.65 133.61 44.72 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 124.746 2.213 . . . . 82.95 116.659 -177.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . 0.308 44.0 pt -122.24 -13.14 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.356 0 C-N-CA 114.103 -3.039 . . . . 44.58 112.678 -179.802 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 160.79 -169.99 36.59 Favored Glycine 0 C--N 1.345 1.082 0 O-C-N 124.788 1.305 . . . . 40.04 112.783 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . 0.484 ' N ' ' OD1' ' A' ' 78' ' ' ASP . 0.0 OUTLIER -118.11 159.52 23.11 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 114.61 -0.795 . . . . 37.77 109.527 178.438 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 14.3 t -67.88 147.11 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 N-CA-C 104.687 -2.338 . . . . 33.28 104.687 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' HIS . . . . . 0.673 ' HB2' ' O ' ' A' ' 7' ' ' TYR . 4.6 t60 -63.43 129.05 93.33 Favored Pre-proline 0 C--N 1.354 0.787 0 O-C-N 126.221 2.201 . . . . 40.59 110.647 179.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PRO . . . . . 0.671 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 2.5 Cg_endo -46.29 -45.03 19.34 Favored 'Trans proline' 0 CA--C 1.482 -2.101 0 CA-C-O 123.007 1.17 . . . . 37.98 111.368 -178.142 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -64.76 -11.64 38.71 Favored 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 117.852 -1.539 . . . . 79.9 113.718 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -99.19 -24.56 14.82 Favored 'General case' 0 C--O 1.259 1.599 0 O-C-N 125.481 1.738 . . . . 76.16 109.26 -179.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . 0.671 ' HG ' ' HA ' ' A' ' 81' ' ' PRO . 8.1 mt -49.39 134.48 18.83 Favored 'General case' 0 C--O 1.25 1.13 0 CA-C-N 113.794 -1.548 . . . . 59.28 107.154 176.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LYS . . . . . 0.494 ' N ' ' CD ' ' A' ' 86' ' ' PRO 0.734 2.2 pttt -104.48 95.44 8.49 Favored Pre-proline 0 C--O 1.242 0.684 0 N-CA-C 117.023 2.231 . . . . 100.0 117.023 178.845 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PRO . . . . . 0.513 ' HD2' ' C ' ' A' ' 84' ' ' LEU . 26.9 Cg_exo . . . . . 0 N--CA 1.435 -1.933 0 C-N-CA 123.853 3.036 . . . . 100.0 114.032 177.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HEM . . . . . 0.71 ' C3D' ' HA3' ' A' ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.451 0 N-CA-C 114.363 1.246 . . . . 100.0 114.363 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t -56.86 141.68 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 O-C-N 124.948 1.405 . . . . 96.69 108.687 178.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . 0.526 HG22 ' N ' ' A' ' 6' ' ' TYR . 73.4 m -90.44 151.27 21.48 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 125.54 1.536 . . . . 100.0 114.099 -177.601 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.659 ' CE2' ' HD3' ' A' ' 81' ' ' PRO 0.263 2.2 m-85 -126.09 151.91 46.56 Favored 'General case' 0 CA--C 1.465 -2.315 0 C-N-CA 115.32 -2.552 . . . . 62.84 113.924 175.329 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.673 ' O ' ' HB2' ' A' ' 80' ' ' HIS . 61.2 m-85 -118.19 171.08 8.36 Favored 'General case' 0 CA--C 1.492 -1.276 0 O-C-N 126.412 2.32 . . . . 43.75 108.79 175.906 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.531 ' NH2' ' CD2' ' A' ' 80' ' ' HIS . 0.0 OUTLIER -128.21 137.53 52.07 Favored 'General case' 0 C--N 1.269 -2.91 0 CA-C-N 111.734 -2.485 . . . . 100.0 105.331 -179.636 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.8 mt -36.84 -48.02 0.72 Allowed 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 122.931 1.348 . . . . 40.48 111.645 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.582 ' OE2' ' HD3' ' A' ' 14' ' ' LYS . 12.8 tm-20 -54.56 -53.36 55.52 Favored 'General case' 0 N--CA 1.424 -1.741 0 O-C-N 120.855 -1.153 . . . . 100.0 112.899 178.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.887 ' HA ' ' HE2' ' A' ' 14' ' ' LYS . 0.1 OUTLIER -62.99 -39.7 95.55 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 116.699 -2.0 . . . . 87.13 108.075 -178.779 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . 0.269 43.4 t -54.0 -51.13 48.87 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 CA-C-O 123.412 1.577 . . . . 45.12 108.819 -177.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.66 -22.97 9.9 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 116.702 2.112 . . . . 40.41 116.702 -178.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.887 ' HE2' ' HA ' ' A' ' 11' ' ' GLU . 12.3 mtmt -70.93 -21.13 62.39 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.081 -1.047 . . . . 81.37 112.376 -178.188 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.817 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 2.1 mpt_? -89.12 44.97 1.25 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 117.16 2.281 . . . . 67.55 117.16 -178.149 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.561 HD22 ' C ' ' A' ' 16' ' ' ASN . 0.2 OUTLIER -79.98 2.02 25.26 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.746 2.418 . . . . 90.16 114.905 -178.55 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' THR . . . . . 0.511 ' N ' HD22 ' A' ' 16' ' ' ASN . 0.9 OUTLIER -106.49 176.68 5.09 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 118.417 2.747 . . . . 63.31 118.417 -178.138 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.08 -23.38 41.34 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 112.812 -1.995 . . . . 46.88 107.38 179.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -66.98 -40.02 87.33 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 111.887 -2.415 . . . . 100.0 107.218 177.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -153.46 113.94 4.01 Favored 'General case' 0 N--CA 1.422 -1.867 0 CA-C-N 113.548 -1.66 . . . . 100.0 111.046 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . 0.481 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 11.1 m -111.28 123.69 50.71 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 127.608 3.067 . . . . 36.6 116.921 -179.053 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.817 ' CE3' ' HD3' ' A' ' 15' ' ' ARG . 40.7 m0 -125.73 159.44 32.3 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 104.379 -2.452 . . . . 35.41 104.379 178.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' MET . . . . . 0.675 ' HE1' ' CD1' ' A' ' 32' ' ' ILE . 2.1 ttp -160.05 157.51 28.78 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 128.738 2.815 . . . . 32.28 108.234 -179.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.482 HG22 HG22 ' A' ' 29' ' ' VAL . 8.6 t -123.21 122.1 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.001 0 N-CA-C 106.661 -1.607 . . . . 35.1 106.661 179.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.589 ' HA ' ' OG1' ' A' ' 55' ' ' THR . 14.0 mt -128.49 124.24 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 N-CA-C 104.956 -2.238 . . . . 39.03 104.956 179.072 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.415 ' N ' ' OG1' ' A' ' 55' ' ' THR . 40.3 m-70 45.94 49.57 11.84 Favored 'General case' 0 CA--C 1.548 0.896 0 O-C-N 125.452 1.72 . . . . 56.5 114.109 179.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 63.02 29.42 74.31 Favored Glycine 0 CA--C 1.505 -0.587 0 N-CA-C 119.447 2.539 . . . . 23.7 119.447 178.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.679 ' HG2' ' HE1' ' A' ' 75' ' ' TYR . 1.2 mpt_? -132.16 138.46 48.04 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 106.774 -1.565 . . . . 100.0 106.774 177.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.482 HG22 HG22 ' A' ' 24' ' ' VAL . 98.6 t -94.53 153.58 3.44 Favored 'Isoleucine or valine' 0 C--O 1.256 1.429 0 N-CA-C 107.42 -1.326 . . . . 30.19 107.42 -179.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.701 ' O ' ' HA ' ' A' ' 22' ' ' TRP . 8.2 m-85 -146.83 153.81 40.61 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 126.993 2.683 . . . . 39.5 112.36 178.276 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.481 ' HA ' ' O ' ' A' ' 21' ' ' THR . 40.1 t0 -111.83 98.45 7.39 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-O 123.394 1.569 . . . . 68.68 107.036 177.031 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.675 ' CD1' ' HE1' ' A' ' 23' ' ' MET . 2.9 mp -82.41 -6.4 9.93 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-N 110.94 -2.846 . . . . 88.28 111.834 -176.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' THR . . . . . 0.529 ' C ' ' O ' ' A' ' 32' ' ' ILE 0.35 60.9 m -29.56 -59.24 0.16 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 115.1 1.518 . . . . 50.93 115.1 -176.711 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 68.1 mtm180 -74.48 -12.45 60.49 Favored 'General case' 0 C--O 1.209 -1.057 0 N-CA-C 118.438 2.755 . . . . 100.0 118.438 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.431 ' O ' ' HB2' ' A' ' 38' ' ' GLU . 38.8 t80 -82.58 -38.52 23.53 Favored 'General case' 0 C--O 1.204 -1.313 0 N-CA-C 117.445 2.387 . . . . 38.61 117.445 -178.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.55 HD23 HD12 ' A' ' 46' ' ' LEU . 74.9 mt -21.77 -51.53 0.02 OUTLIER 'General case' 0 CA--C 1.492 -1.254 0 C-N-CA 128.986 2.914 . . . . 47.74 118.24 -179.181 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 56.8 m -68.7 -27.53 66.04 Favored 'General case' 0 CA--C 1.511 -0.538 0 O-C-N 127.529 3.018 . . . . 73.4 112.654 -179.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.642 ' N ' ' OE1' ' A' ' 38' ' ' GLU . 12.6 mp0 -87.22 -35.53 18.48 Favored 'General case' 0 CA--C 1.488 -1.427 0 O-C-N 125.892 1.995 . . . . 97.66 110.424 -178.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.628 ' CD2' ' HD2' ' A' ' 40' ' ' PRO . 7.5 t-160 -51.99 106.06 0.61 Allowed Pre-proline 0 C--N 1.366 1.288 0 O-C-N 127.706 3.129 . . . . 30.15 113.8 -178.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.628 ' HD2' ' CD2' ' A' ' 39' ' ' HIS . 8.2 Cg_exo -57.61 -40.3 81.31 Favored 'Trans proline' 0 CA--C 1.554 1.504 1 C-N-CA 126.179 4.586 . . . . 30.2 111.482 179.43 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.71 ' HA3' ' C3D' ' A' ' 201' ' ' HEM . . . -81.72 14.31 31.53 Favored Glycine 0 CA--C 1.547 2.064 0 O-C-N 120.255 -1.528 . . . . 40.14 113.842 177.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 117.56 153.6 9.72 Favored Glycine 0 CA--C 1.546 1.97 0 CA-C-O 127.345 3.747 . . . . 54.03 121.174 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -94.35 -37.41 11.49 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 110.652 -2.774 . . . . 90.86 108.847 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -82.24 -21.05 36.48 Favored 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 116.067 1.877 . . . . 38.39 116.067 -174.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.543 ' O ' ' HB2' ' A' ' 48' ' ' GLU . 4.0 p -72.04 -40.23 67.03 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.134 0 C-N-CA 119.643 -0.823 . . . . 37.72 110.904 -176.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.55 HD12 HD23 ' A' ' 36' ' ' LEU . 36.3 mt -72.01 -50.45 28.51 Favored 'General case' 0 C--O 1.2 -1.548 0 C-N-CA 127.509 2.324 . . . . 31.21 110.099 179.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.3 mt -62.47 -26.05 68.31 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 127.472 3.511 . . . . 34.25 104.774 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.543 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -64.72 -16.62 63.19 Favored 'General case' 0 C--N 1.259 -3.367 0 C-N-CA 114.544 -2.862 . . . . 100.0 108.701 178.247 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.54 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 2.3 mt-30 -134.65 32.66 3.28 Favored 'General case' 0 C--O 1.254 1.315 0 N-CA-C 115.845 1.794 . . . . 85.89 115.845 -179.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.55 ' CB ' ' HA ' ' A' ' 16' ' ' ASN . . . -58.16 141.27 50.95 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.987 -0.551 . . . . 38.69 109.83 -179.133 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.89 -21.92 3.08 Favored Glycine 0 C--O 1.213 -1.166 0 C-N-CA 118.38 -1.867 . . . . 45.36 111.445 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 49' ' ' GLN . . . -77.54 167.06 22.24 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 123.965 1.841 . . . . 42.32 114.376 -179.499 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.521 ' OD1' ' HB ' ' A' ' 55' ' ' THR . 2.3 t0 -97.37 93.79 6.7 Favored 'General case' 0 N--CA 1.415 -2.188 0 N-CA-C 101.492 -3.521 . . . . 68.37 101.492 176.296 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.51 ' O ' ' C ' ' A' ' 55' ' ' THR 0.281 . . -78.83 12.34 2.19 Favored 'General case' 0 N--CA 1.411 -2.395 0 C-N-CA 113.906 -3.118 . . . . 25.52 113.453 -178.449 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . 0.589 ' OG1' ' HA ' ' A' ' 25' ' ' ILE 0.484 21.1 m -39.43 -68.33 0.17 Allowed 'General case' 0 C--N 1.298 -1.645 0 O-C-N 119.743 -1.848 . . . . 38.6 115.031 -179.382 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -49.0 -44.71 41.47 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 123.29 1.519 . . . . 100.0 109.773 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . 1.207 0.1 OUTLIER -63.13 -46.21 88.31 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 120.02 3.341 . . . . 34.27 120.02 179.775 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -67.28 -29.75 69.43 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 120.517 -1.365 . . . . 38.59 111.366 -179.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.633 ' OE2' ' NH2' ' A' ' 68' ' ' ARG . 17.2 mm-40 -80.16 -25.69 39.69 Favored 'General case' 0 C--N 1.297 -1.69 0 C-N-CA 115.434 -2.507 . . . . 85.96 109.918 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.37 -0.72 30.18 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 114.888 1.44 . . . . 100.0 114.888 -178.622 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.499 ' O ' ' O ' ' A' ' 62' ' ' GLY . 8.0 t -114.74 -8.5 12.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 125.491 2.567 . . . . 45.99 109.572 -177.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.499 ' O ' ' O ' ' A' ' 61' ' ' VAL . . . 59.87 113.18 0.01 OUTLIER Glycine 0 N--CA 1.436 -1.309 0 N-CA-C 108.373 -1.891 . . . . 43.15 108.373 -178.141 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.502 ' CE1' ' C4C' ' A' ' 201' ' ' HEM . 46.0 m80 -126.34 140.35 52.58 Favored 'General case' 0 N--CA 1.428 -1.549 0 N-CA-C 102.198 -3.26 . . . . 28.92 102.198 176.71 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.0 p -67.2 179.88 0.51 Allowed Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 129.303 3.041 . . . . 43.37 116.189 -177.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.469 ' O ' ' OE2' ' A' ' 69' ' ' GLU . 4.4 Cg_exo -79.61 -27.13 4.29 Favored 'Trans proline' 0 N--CA 1.436 -1.864 0 N-CA-C 106.526 -2.144 . . . . 39.9 106.526 178.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.545 ' O ' ' HG3' ' A' ' 70' ' ' MET 0.306 0.5 OUTLIER -64.74 -39.16 93.17 Favored 'General case' 0 C--O 1.256 1.439 0 CA-C-N 112.897 -1.956 . . . . 83.16 113.326 -178.902 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.86 -25.82 62.99 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 122.719 1.247 . . . . 40.18 109.547 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.633 ' NH2' ' OE2' ' A' ' 59' ' ' GLU . 10.5 mtt-85 -72.04 -39.07 69.37 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-N 113.18 -1.827 . . . . 37.09 111.258 -177.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.469 ' OE2' ' O ' ' A' ' 65' ' ' PRO . 1.1 mt-10 -68.93 -32.96 72.95 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 110.113 -3.221 . . . . 100.0 108.499 179.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -68.46 -28.15 66.79 Favored 'General case' 0 CA--C 1.475 -1.94 0 C-N-CA 125.678 1.591 . . . . 53.13 109.66 -178.295 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.421 HD13 HMB2 ' A' ' 201' ' ' HEM . 3.8 tp -60.52 -36.36 78.21 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 110.848 -2.887 . . . . 34.32 111.048 178.725 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -58.22 -21.24 47.06 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 114.532 1.308 . . . . 100.0 114.532 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 17.4 mp0 -90.34 -0.34 57.6 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 115.944 -2.303 . . . . 100.0 112.962 -177.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -121.72 14.81 10.96 Favored 'General case' 0 CA--C 1.496 -1.127 0 C-N-CA 115.948 -2.301 . . . . 66.39 112.373 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.679 ' HE1' ' HG2' ' A' ' 28' ' ' ARG . 86.6 t80 -72.65 133.61 44.72 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 124.746 2.213 . . . . 82.95 116.659 -177.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . 0.308 44.0 pt -122.24 -13.14 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.356 0 C-N-CA 114.103 -3.039 . . . . 44.58 112.678 -179.802 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 160.79 -169.99 36.59 Favored Glycine 0 C--N 1.345 1.082 0 O-C-N 124.788 1.305 . . . . 40.04 112.783 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.484 ' N ' ' OD1' ' A' ' 78' ' ' ASP . 0.0 OUTLIER -118.11 159.52 23.11 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 114.61 -0.795 . . . . 37.77 109.527 178.438 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 14.3 t -67.88 147.11 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 N-CA-C 104.687 -2.338 . . . . 33.28 104.687 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.737 ' CE1' HD22 ' A' ' 82' ' ' ASN . 27.3 t-80 -63.43 129.05 93.33 Favored Pre-proline 0 C--N 1.354 0.787 0 O-C-N 126.221 2.201 . . . . 40.59 110.647 179.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.671 ' HA ' ' HG ' ' A' ' 84' ' ' LEU . 2.5 Cg_endo -46.29 -45.03 19.34 Favored 'Trans proline' 0 CA--C 1.482 -2.101 0 CA-C-O 123.007 1.17 . . . . 37.98 111.368 -178.142 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.737 HD22 ' CE1' ' A' ' 80' ' ' HIS . 69.3 m-80 -64.76 -11.64 38.71 Favored 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 117.852 -1.539 . . . . 79.9 113.718 -178.923 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -99.19 -24.56 14.82 Favored 'General case' 0 C--O 1.259 1.599 0 O-C-N 125.481 1.738 . . . . 76.16 109.26 -179.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.671 ' HG ' ' HA ' ' A' ' 81' ' ' PRO . 8.1 mt -49.39 134.48 18.83 Favored 'General case' 0 C--O 1.25 1.13 0 CA-C-N 113.794 -1.548 . . . . 59.28 107.154 176.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.494 ' N ' ' CD ' ' A' ' 86' ' ' PRO 0.734 2.2 pttt -104.48 95.44 8.49 Favored Pre-proline 0 C--O 1.242 0.684 0 N-CA-C 117.023 2.231 . . . . 100.0 117.023 178.845 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.513 ' HD2' ' C ' ' A' ' 84' ' ' LEU . 26.9 Cg_exo . . . . . 0 N--CA 1.435 -1.933 0 C-N-CA 123.853 3.036 . . . . 100.0 114.032 177.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.71 ' C3D' ' HA3' ' A' ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_