data_6ra0_residue ############################ # Computer software used # ############################ 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 6ra0 _Structure_validation_residue.Date_analyzed 2019-08-09 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 ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.521 -0.138 0 N-CA-C 112.011 0.374 . . . . 92.54 112.011 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -119.7 171.33 8.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.754 0.788 . . . . 90.22 111.287 -167.78 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 m -128.37 167.15 24.07 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 N-CA-C 106.737 -1.579 . . . . 70.76 106.737 154.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 56.1 t -116.83 133.33 63.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 107.889 -1.152 . . . . 64.0 107.889 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 67.6 mt -104.04 142.19 34.88 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 107.765 -1.198 . . . . 54.18 107.765 172.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.7 mtp-105 -131.57 135.67 47.18 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.781 -0.768 . . . . 52.5 110.711 175.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -152.22 146.21 25.26 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.301 -0.629 . . . . 74.08 109.301 169.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 65.24 -108.23 2.26 Favored Glycine 0 N--CA 1.446 -0.7 0 N-CA-C 109.856 -1.297 . . . . 87.42 109.856 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -132.98 32.25 2.79 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.49 -1.044 . . . . 98.3 110.49 172.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.9 p -127.0 136.12 51.8 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.788 -0.243 . . . . 73.21 111.059 -169.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -113.43 150.55 32.6 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 123.363 0.665 . . . . 96.36 110.061 172.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . 0.421 ' OE2' ' NE ' ' A' ' 40' ' ' ARG . 23.4 tt0 -145.89 137.51 25.01 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.294 1.037 . . . . 73.88 109.424 -179.695 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 19.8 ttm -88.41 138.07 31.76 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 123.811 0.844 . . . . 95.08 109.403 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.7 t -134.58 128.3 19.0 Favored Pre-proline 0 C--O 1.238 0.496 0 N-CA-C 108.207 -1.034 . . . . 78.47 108.207 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -69.52 131.79 22.32 Favored 'Trans proline' 0 C--O 1.235 0.357 0 CA-C-N 119.788 0.96 . . . . 101.64 110.774 -176.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.0 tp -94.62 104.47 16.41 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.463 -0.79 . . . . 88.86 109.301 -176.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.0 mp -92.62 146.87 5.82 Favored 'Isoleucine or valine' 0 C--N 1.349 0.574 0 C-N-CA 124.845 1.258 . . . . 115.81 107.937 167.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.0 mmt-85 -95.28 114.37 26.14 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.705 -1.591 . . . . 109.55 106.705 163.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -172.21 147.86 2.07 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 107.064 -1.458 . . . . 98.01 107.064 -167.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . 0.402 ' N ' ' OE1' ' A' ' 31' ' ' GLU . 42.6 mp0 -57.31 -36.06 70.62 Favored 'General case' 0 C--O 1.238 0.476 0 O-C-N 123.713 0.633 . . . . 135.44 112.104 -166.337 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -97.93 11.96 35.7 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.874 0.694 . . . . 120.75 112.874 -177.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 8.8 tpt -49.66 -45.94 49.14 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 120.192 -0.603 . . . . 90.4 111.067 176.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 tp -69.3 -43.74 73.17 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 120.724 -0.39 . . . . 73.86 111.645 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -44.92 -50.96 10.19 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-O 121.336 0.589 . . . . 86.77 111.037 171.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 40.3 mtm -67.22 -43.43 82.05 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 113.046 0.758 . . . . 93.18 113.046 -175.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.2 mt -58.11 -41.45 83.62 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 118.149 -1.421 . . . . 67.37 110.058 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 75.2 mmm -61.05 -40.42 93.55 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.273 -0.421 . . . . 60.58 111.46 -178.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -75.52 -30.73 59.88 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.197 -1.001 . . . . 96.5 112.263 -178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ARG . . . . . 0.421 ' NE ' ' OE2' ' A' ' 23' ' ' GLU . 5.4 mmm180 -60.9 -48.43 81.86 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 119.907 -0.717 . . . . 76.93 109.71 168.058 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.06 -53.04 46.93 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 116.264 -0.425 . . . . 56.32 111.496 177.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -53.76 -42.05 67.8 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.015 0.436 . . . . 72.55 110.961 177.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -66.56 -41.66 88.27 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.416 -0.513 . . . . 80.62 111.121 -179.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.7 mt -55.21 -46.11 77.72 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.316 0.579 . . . . 61.18 110.909 175.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.7 t -70.82 -43.98 76.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 C-N-CA 119.057 -1.057 . . . . 68.64 110.846 -173.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -62.71 -20.26 64.72 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 118.519 -1.272 . . . . 95.11 111.229 174.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -55.93 -24.23 41.32 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.154 -1.022 . . . . 75.18 113.382 164.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -92.23 -26.01 18.38 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 117.636 0.718 . . . . 86.9 112.687 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . 0.462 ' O ' ' N ' ' A' ' 51' ' ' LEU . . . 140.47 85.69 0.1 Allowed Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 119.478 -1.344 . . . . 99.43 115.127 169.59 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.5 m120 38.37 21.71 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 116.001 1.852 . . . . 113.64 116.001 170.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' A' ' 49' ' ' GLY . 34.1 mt -54.66 133.54 46.83 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.453 -0.943 . . . . 78.54 108.453 172.816 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.88 154.63 21.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.34 -0.944 . . . . 78.09 110.026 173.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 t -138.88 3.72 2.25 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 113.339 0.866 . . . . 58.85 113.339 -155.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -68.74 -23.8 64.38 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.436 0.532 . . . . 78.7 112.436 -174.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -111.63 36.2 3.36 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 117.438 -1.705 . . . . 49.24 111.35 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.9 ttp -79.37 128.91 33.93 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.363 -0.381 . . . . 58.66 110.438 176.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -132.55 152.27 51.65 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.542 -0.91 . . . . 46.87 108.542 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 28.2 mt -103.91 136.24 43.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.178 -1.045 . . . . 53.37 108.178 172.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -124.65 133.02 53.37 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.015 -1.106 . . . . 58.78 108.015 174.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -93.58 157.48 16.17 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 109.429 -0.582 . . . . 73.38 109.429 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 -87.21 140.25 29.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.544 -0.753 . . . . 46.22 109.231 174.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . 0.522 ' OE1' ' N ' ' A' ' 63' ' ' TYR . 6.2 tp10 -67.6 140.62 56.91 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 118.787 -1.165 . . . . 91.82 111.53 -177.739 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TYR . . . . . 0.522 ' N ' ' OE1' ' A' ' 62' ' ' GLU . 14.4 t80 -40.01 119.78 1.07 Allowed 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 125.372 1.469 . . . . 124.23 110.842 163.774 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.7 m120 67.82 7.42 5.72 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.187 0.81 . . . . 114.23 113.187 173.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.0 t -151.7 80.04 6.32 Favored Pre-proline 0 C--O 1.238 0.469 0 CA-C-N 119.579 1.081 . . . . 79.07 110.375 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -74.85 -4.27 15.16 Favored 'Trans proline' 0 CA--C 1.512 -0.588 0 C-N-CA 120.514 0.809 . . . . 60.81 114.173 -171.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.5 p -78.29 -9.45 59.25 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 119.705 1.139 . . . . 58.03 112.337 174.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.7 mt -107.49 135.47 48.9 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 123.456 0.703 . . . . 53.07 110.354 -176.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 35.9 mt -112.38 146.43 38.34 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 123.809 0.843 . . . . 54.79 111.284 174.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -127.52 131.93 24.08 Favored Pre-proline 0 C--O 1.238 0.499 0 N-CA-C 107.876 -1.157 . . . . 74.52 107.876 174.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.33 141.76 43.72 Favored 'Trans proline' 0 N--CA 1.474 0.352 0 CA-C-N 119.209 0.753 . . . . 54.86 111.519 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.8 mm -86.9 126.45 40.84 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 109.346 -0.613 . . . . 53.73 109.346 173.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' THR . . . . . 0.435 ' N ' ' OE1' ' A' ' 77' ' ' GLN . 1.5 p -119.1 -37.06 3.26 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 124.14 0.976 . . . . 79.77 113.02 179.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.1 p -121.09 154.64 35.86 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 118.5 0.591 . . . . 86.83 109.673 173.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -56.86 -19.84 19.69 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.531 -0.759 . . . . 87.58 112.457 -179.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.5 p -74.66 -29.25 61.18 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.153 0.427 . . . . 95.94 112.153 -171.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLN . . . . . 0.435 ' OE1' ' N ' ' A' ' 73' ' ' THR . 36.9 mt-30 -67.46 -14.61 63.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 112.235 0.457 . . . . 75.18 112.235 179.46 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 3.9 mt -77.6 116.88 21.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 108.217 -1.031 . . . . 81.62 108.217 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 p -114.19 145.86 41.13 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.245 -0.65 . . . . 80.85 109.245 173.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.3 t -54.41 139.9 35.61 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.999 -0.546 . . . . 92.41 111.031 -178.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.1 -8.07 68.61 Favored Glycine 0 C--N 1.338 0.692 0 N-CA-C 116.126 1.211 . . . . 74.07 116.126 -175.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.2 p -74.61 150.27 39.71 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 119.416 1.608 . . . . 67.34 110.885 -173.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 9.0 mm -97.76 112.23 29.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 106.834 -1.543 . . . . 62.96 106.834 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.5 mt -100.48 128.95 46.39 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.501 -0.555 . . . . 50.99 109.501 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -93.1 137.81 32.12 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.366 0.603 . . . . 62.51 110.593 177.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 96.4 mt -100.85 120.37 50.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 104.923 -2.251 . . . . 52.57 104.923 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 42.7 mt -133.88 123.89 45.84 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 108.552 -0.907 . . . . 49.9 108.552 -169.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 56.3 mt -88.95 97.92 11.46 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 106.835 -1.543 . . . . 50.32 106.835 171.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 33.1 m -77.71 -8.94 12.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 N-CA-C 113.434 0.902 . . . . 61.18 113.434 -169.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -84.16 11.46 8.09 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 119.121 0.873 . . . . 60.28 111.796 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.4 ttp85 -124.17 134.57 53.27 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 117.336 -1.745 . . . . 104.37 110.492 -157.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 21.8 m -40.25 131.09 2.16 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 127.026 2.131 . . . . 86.03 112.34 -165.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -72.65 157.76 36.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 118.857 -1.137 . . . . 80.35 108.717 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -157.03 152.55 26.67 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.415 -0.957 . . . . 69.59 108.415 179.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.04 138.43 58.33 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.632 -0.713 . . . . 72.76 111.822 -170.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.1 m -65.48 151.17 10.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.632 0.729 . . . . 94.26 110.386 176.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 4.5 mt -117.49 98.98 52.34 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 108.123 -1.066 . . . . 85.82 108.123 175.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -87.44 144.52 6.77 Favored 'Trans proline' 0 CA--C 1.518 -0.315 0 CA-C-O 121.524 0.551 . . . . 85.36 112.518 -171.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -61.38 135.15 57.6 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.592 -0.731 . . . . 73.63 110.103 168.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.4 p -101.21 121.11 51.67 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 N-CA-C 107.375 -1.343 . . . . 94.39 107.375 165.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 p -136.43 152.4 29.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.065 -0.717 . . . . 83.65 109.065 -156.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -146.46 155.41 49.53 Favored Pre-proline 0 C--O 1.263 1.811 0 C-N-CA 123.948 0.899 . . . . 94.52 109.291 176.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -59.52 159.34 24.07 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 122.263 1.975 . . . . 66.76 111.698 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -157.66 133.86 9.53 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.744 -1.117 . . . . 88.25 108.31 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.0 m -93.33 140.77 29.18 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.732 -0.84 . . . . 68.06 108.732 171.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -118.96 134.91 54.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.721 0.296 . . . . 81.33 110.831 -174.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 96.9 mmm -102.12 -18.22 15.66 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 113.839 1.052 . . . . 82.39 113.839 -171.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 10.9 mmt180 -119.81 156.25 54.22 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.117 -1.068 . . . . 113.79 108.117 169.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.76 123.17 12.15 Favored 'Trans proline' 0 C--O 1.236 0.383 0 N-CA-C 110.295 -0.694 . . . . 87.38 110.295 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.3 p -131.24 150.47 52.13 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.561 0.696 . . . . 74.69 110.152 178.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -102.24 146.07 28.52 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.08 -0.964 . . . . 92.51 109.96 -173.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 26.6 t -64.09 118.11 8.05 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.691 -0.686 . . . . 63.79 110.465 173.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -63.06 -24.58 67.98 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 119.698 -0.801 . . . . 86.77 112.202 -170.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -82.1 -58.61 2.88 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 118.314 0.506 . . . . 75.97 111.314 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 3.1 p -91.87 -18.52 23.67 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 113.632 0.975 . . . . 72.48 113.632 -170.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.95 -11.79 68.06 Favored Glycine 0 C--O 1.242 0.62 0 N-CA-C 116.19 1.236 . . . . 98.15 116.19 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -84.3 160.83 20.64 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.768 1.284 . . . . 83.05 110.694 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 11.4 ttm -74.4 139.11 43.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.066 -0.97 . . . . 103.11 110.55 -172.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 17.1 mt -61.91 124.79 21.73 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 107.935 -1.135 . . . . 71.49 107.935 161.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.4 p -117.68 168.2 10.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 118.451 -1.3 . . . . 74.78 110.079 175.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 119.29 179.62 16.68 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-O 122.066 0.814 . . . . 82.18 112.338 -175.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -96.76 -59.66 1.76 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.733 -0.733 . . . . 108.35 112.446 -177.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 7.2 mtp -113.83 162.67 16.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.543 -0.91 . . . . 112.3 108.543 168.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.5 mtt85 51.16 50.47 18.97 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 122.181 0.991 . . . . 107.24 112.151 166.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -71.4 -19.65 62.23 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.616 -0.72 . . . . 65.54 112.517 -171.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -165.02 -163.44 18.23 Favored Glycine 0 N--CA 1.44 -1.052 0 N-CA-C 109.103 -1.599 . . . . 61.32 109.103 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 16.0 m -119.18 152.49 21.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.327 -0.99 . . . . 68.44 108.327 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -124.6 133.23 53.33 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.106 -0.701 . . . . 88.98 109.106 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 42.4 t -86.93 137.69 32.16 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.466 -0.334 . . . . 77.95 110.658 -178.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.4 tttp -75.34 -28.96 59.82 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 116.051 -0.522 . . . . 94.57 112.389 -172.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 27.0 m-20 -97.74 -40.94 8.32 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.185 0.809 . . . . 97.17 113.185 -172.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 2.0 p -105.78 1.14 26.73 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 121.056 -1.027 . . . . 78.32 113.047 175.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.2 t30 64.22 17.69 10.85 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 124.889 1.276 . . . . 109.57 113.451 168.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -76.62 167.52 54.52 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.179 -1.01 . . . . 78.19 112.745 -178.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 68.2 m-20 -124.44 121.18 34.17 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.557 1.143 . . . . 72.3 108.703 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -140.06 154.98 47.24 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 122.476 0.31 . . . . 61.03 111.05 -177.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 35.7 m80 -62.38 153.93 29.65 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 118.848 -1.141 . . . . 62.6 109.207 161.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -58.36 -45.68 87.73 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 119.192 -1.003 . . . . 80.32 110.81 176.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -58.0 -20.95 42.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 119.524 -0.87 . . . . 89.72 111.463 174.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 35.3 m -96.5 -22.91 16.82 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 113.985 1.106 . . . . 55.06 113.985 -175.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 25.4 p -62.56 -16.54 56.69 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 119.162 0.892 . . . . 60.31 112.775 -169.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -133.5 28.93 3.96 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 118.297 0.499 . . . . 68.92 111.255 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.88 154.32 7.41 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 118.925 -1.11 . . . . 53.61 109.882 170.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.84 138.54 55.58 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 118.7 -1.2 . . . . 51.28 109.423 172.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 68.24 15.31 9.33 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 113.689 0.996 . . . . 74.4 113.689 177.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -95.48 66.83 2.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 122.441 1.115 . . . . 72.62 108.106 171.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.21 152.0 26.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.025 -0.989 . . . . 79.36 111.216 -173.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 36.8 t -91.65 103.59 16.16 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 106.183 -1.784 . . . . 84.12 106.183 -170.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 111.396 -0.681 . . . . 83.44 111.396 178.331 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.521 -0.138 0 N-CA-C 112.011 0.374 . . . . 92.54 112.011 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HIS . . . . . 0.422 ' CD2' ' H ' ' A' ' 13' ' ' HIS . 0.4 OUTLIER -119.7 171.33 8.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.754 0.788 . . . . 90.22 111.287 -167.78 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 m -128.37 167.15 24.07 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 N-CA-C 106.737 -1.579 . . . . 70.76 106.737 154.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 56.1 t -116.83 133.33 63.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 107.889 -1.152 . . . . 64.0 107.889 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 67.6 mt -104.04 142.19 34.88 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 107.765 -1.198 . . . . 54.18 107.765 172.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . 0.431 ' HD3' ' OE2' ' A' ' 85' ' ' GLU . 27.7 mtp-105 -131.57 135.67 47.18 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.781 -0.768 . . . . 52.5 110.711 175.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' TYR . . . . . 0.415 ' CE2' HG22 ' A' ' 45' ' ' VAL . 80.2 t80 -152.22 146.21 25.26 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.301 -0.629 . . . . 74.08 109.301 169.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 65.24 -108.23 2.26 Favored Glycine 0 N--CA 1.446 -0.7 0 N-CA-C 109.856 -1.297 . . . . 87.42 109.856 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -132.98 32.25 2.79 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.49 -1.044 . . . . 98.3 110.49 172.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.9 p -127.0 136.12 51.8 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.788 -0.243 . . . . 73.21 111.059 -169.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -113.43 150.55 32.6 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 123.363 0.665 . . . . 96.36 110.061 172.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -145.89 137.51 25.01 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.294 1.037 . . . . 73.88 109.424 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 19.8 ttm -88.41 138.07 31.76 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 123.811 0.844 . . . . 95.08 109.403 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.7 t -134.58 128.3 19.0 Favored Pre-proline 0 C--O 1.238 0.496 0 N-CA-C 108.207 -1.034 . . . . 78.47 108.207 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -69.52 131.79 22.32 Favored 'Trans proline' 0 C--O 1.235 0.357 0 CA-C-N 119.788 0.96 . . . . 101.64 110.774 -176.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . 0.628 ' HA ' ' HE1' ' A' ' 33' ' ' MET . 44.0 tp -94.62 104.47 16.41 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.463 -0.79 . . . . 88.86 109.301 -176.112 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . 0.481 HD12 ' N ' ' A' ' 28' ' ' ILE . 4.0 mp -92.62 146.87 5.82 Favored 'Isoleucine or valine' 0 C--N 1.349 0.574 0 C-N-CA 124.845 1.258 . . . . 115.81 107.937 167.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.0 mmt-85 -95.28 114.37 26.14 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.705 -1.591 . . . . 109.55 106.705 163.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -172.21 147.86 2.07 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 107.064 -1.458 . . . . 98.01 107.064 -167.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . 0.437 ' H ' ' CD ' ' A' ' 31' ' ' GLU . 42.6 mp0 -57.31 -36.06 70.62 Favored 'General case' 0 C--O 1.238 0.476 0 O-C-N 123.713 0.633 . . . . 135.44 112.104 -166.337 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -97.93 11.96 35.7 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.874 0.694 . . . . 120.75 112.874 -177.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' MET . . . . . 0.628 ' HE1' ' HA ' ' A' ' 27' ' ' LEU . 8.8 tpt -49.66 -45.94 49.14 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 120.192 -0.603 . . . . 90.4 111.067 176.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 tp -69.3 -43.74 73.17 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 120.724 -0.39 . . . . 73.86 111.645 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -44.92 -50.96 10.19 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-O 121.336 0.589 . . . . 86.77 111.037 171.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 40.3 mtm -67.22 -43.43 82.05 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 113.046 0.758 . . . . 93.18 113.046 -175.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.2 mt -58.11 -41.45 83.62 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 118.149 -1.421 . . . . 67.37 110.058 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 75.2 mmm -61.05 -40.42 93.55 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.273 -0.421 . . . . 60.58 111.46 -178.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -75.52 -30.73 59.88 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.197 -1.001 . . . . 96.5 112.263 -178.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -60.9 -48.43 81.86 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 119.907 -0.717 . . . . 76.93 109.71 168.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.06 -53.04 46.93 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 116.264 -0.425 . . . . 56.32 111.496 177.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -53.76 -42.05 67.8 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.015 0.436 . . . . 72.55 110.961 177.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -66.56 -41.66 88.27 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.416 -0.513 . . . . 80.62 111.121 -179.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.7 mt -55.21 -46.11 77.72 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.316 0.579 . . . . 61.18 110.909 175.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . 0.415 HG22 ' CE2' ' A' ' 18' ' ' TYR . 2.7 t -70.82 -43.98 76.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 C-N-CA 119.057 -1.057 . . . . 68.64 110.846 -173.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -62.71 -20.26 64.72 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 118.519 -1.272 . . . . 95.11 111.229 174.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -55.93 -24.23 41.32 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.154 -1.022 . . . . 75.18 113.382 164.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -92.23 -26.01 18.38 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 117.636 0.718 . . . . 86.9 112.687 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . 0.462 ' O ' ' N ' ' A' ' 51' ' ' LEU . . . 140.47 85.69 0.1 Allowed Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 119.478 -1.344 . . . . 99.43 115.127 169.59 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 38.37 21.71 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 116.001 1.852 . . . . 113.64 116.001 170.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' A' ' 49' ' ' GLY . 34.1 mt -54.66 133.54 46.83 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.453 -0.943 . . . . 78.54 108.453 172.816 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.88 154.63 21.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.34 -0.944 . . . . 78.09 110.026 173.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 t -138.88 3.72 2.25 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 113.339 0.866 . . . . 58.85 113.339 -155.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -68.74 -23.8 64.38 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.436 0.532 . . . . 78.7 112.436 -174.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -111.63 36.2 3.36 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 117.438 -1.705 . . . . 49.24 111.35 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.9 ttp -79.37 128.91 33.93 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.363 -0.381 . . . . 58.66 110.438 176.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -132.55 152.27 51.65 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.542 -0.91 . . . . 46.87 108.542 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 85' ' ' GLU . 28.2 mt -103.91 136.24 43.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.178 -1.045 . . . . 53.37 108.178 172.445 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PHE . . . . . 0.434 ' CD1' HD12 ' A' ' 87' ' ' ILE . 37.1 m-85 -124.65 133.02 53.37 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.015 -1.106 . . . . 58.78 108.015 174.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -93.58 157.48 16.17 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 109.429 -0.582 . . . . 73.38 109.429 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HIS . . . . . 0.411 ' HE1' ' O ' ' A' ' 144' ' ' ALA . 57.1 m-70 -87.21 140.25 29.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.544 -0.753 . . . . 46.22 109.231 174.138 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . 0.504 ' OE1' ' N ' ' A' ' 63' ' ' TYR . 6.2 tp10 -67.6 140.62 56.91 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 118.787 -1.165 . . . . 91.82 111.53 -177.739 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TYR . . . . . 0.504 ' N ' ' OE1' ' A' ' 62' ' ' GLU . 14.4 t80 -40.01 119.78 1.07 Allowed 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 125.372 1.469 . . . . 124.23 110.842 163.774 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.7 m120 67.82 7.42 5.72 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.187 0.81 . . . . 114.23 113.187 173.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.0 t -151.7 80.04 6.32 Favored Pre-proline 0 C--O 1.238 0.469 0 CA-C-N 119.579 1.081 . . . . 79.07 110.375 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . 0.44 ' HG2' ' O ' ' A' ' 139' ' ' ARG . 3.6 Cg_endo -74.85 -4.27 15.16 Favored 'Trans proline' 0 CA--C 1.512 -0.588 0 C-N-CA 120.514 0.809 . . . . 60.81 114.173 -171.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.5 p -78.29 -9.45 59.25 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 119.705 1.139 . . . . 58.03 112.337 174.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.7 mt -107.49 135.47 48.9 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 123.456 0.703 . . . . 53.07 110.354 -176.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . 0.416 ' HB3' ' HB3' ' A' ' 59' ' ' PHE . 35.9 mt -112.38 146.43 38.34 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 123.809 0.843 . . . . 54.79 111.284 174.461 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' TYR . . . . . 0.497 ' CE2' ' HB2' ' A' ' 62' ' ' GLU . 62.0 m-85 -127.52 131.93 24.08 Favored Pre-proline 0 C--O 1.238 0.499 0 N-CA-C 107.876 -1.157 . . . . 74.52 107.876 174.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.33 141.76 43.72 Favored 'Trans proline' 0 N--CA 1.474 0.352 0 CA-C-N 119.209 0.753 . . . . 54.86 111.519 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.8 mm -86.9 126.45 40.84 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 109.346 -0.613 . . . . 53.73 109.346 173.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 p -119.1 -37.06 3.26 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 124.14 0.976 . . . . 79.77 113.02 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.1 p -121.09 154.64 35.86 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 118.5 0.591 . . . . 86.83 109.673 173.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . 0.446 ' HA ' HD12 ' A' ' 78' ' ' ILE . . . -56.86 -19.84 19.69 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.531 -0.759 . . . . 87.58 112.457 -179.201 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.5 p -74.66 -29.25 61.18 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.153 0.427 . . . . 95.94 112.153 -171.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -67.46 -14.61 63.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 112.235 0.457 . . . . 75.18 112.235 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . 0.446 HD12 ' HA ' ' A' ' 75' ' ' ALA . 3.9 mt -77.6 116.88 21.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 108.217 -1.031 . . . . 81.62 108.217 175.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 p -114.19 145.86 41.13 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.245 -0.65 . . . . 80.85 109.245 173.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.3 t -54.41 139.9 35.61 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.999 -0.546 . . . . 92.41 111.031 -178.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.1 -8.07 68.61 Favored Glycine 0 C--N 1.338 0.692 0 N-CA-C 116.126 1.211 . . . . 74.07 116.126 -175.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.2 p -74.61 150.27 39.71 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 119.416 1.608 . . . . 67.34 110.885 -173.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 9.0 mm -97.76 112.23 29.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 106.834 -1.543 . . . . 62.96 106.834 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.5 mt -100.48 128.95 46.39 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.501 -0.555 . . . . 50.99 109.501 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . 0.431 ' OE2' ' HD3' ' A' ' 17' ' ' ARG . 81.5 mm-40 -93.1 137.81 32.12 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.366 0.603 . . . . 62.51 110.593 177.739 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 96.4 mt -100.85 120.37 50.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 104.923 -2.251 . . . . 52.57 104.923 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ILE . . . . . 0.694 HG12 HH11 ' A' ' 145' ' ' ARG . 42.7 mt -133.88 123.89 45.84 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 108.552 -0.907 . . . . 49.9 108.552 -169.258 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 56.3 mt -88.95 97.92 11.46 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 106.835 -1.543 . . . . 50.32 106.835 171.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 33.1 m -77.71 -8.94 12.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 N-CA-C 113.434 0.902 . . . . 61.18 113.434 -169.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -84.16 11.46 8.09 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 119.121 0.873 . . . . 60.28 111.796 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.4 ttp85 -124.17 134.57 53.27 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 117.336 -1.745 . . . . 104.37 110.492 -157.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 21.8 m -40.25 131.09 2.16 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 127.026 2.131 . . . . 86.03 112.34 -165.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -72.65 157.76 36.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 118.857 -1.137 . . . . 80.35 108.717 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -157.03 152.55 26.67 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.415 -0.957 . . . . 69.59 108.415 179.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.04 138.43 58.33 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.632 -0.713 . . . . 72.76 111.822 -170.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.1 m -65.48 151.17 10.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.632 0.729 . . . . 94.26 110.386 176.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 4.5 mt -117.49 98.98 52.34 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 108.123 -1.066 . . . . 85.82 108.123 175.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -87.44 144.52 6.77 Favored 'Trans proline' 0 CA--C 1.518 -0.315 0 CA-C-O 121.524 0.551 . . . . 85.36 112.518 -171.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -61.38 135.15 57.6 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.592 -0.731 . . . . 73.63 110.103 168.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.4 p -101.21 121.11 51.67 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 N-CA-C 107.375 -1.343 . . . . 94.39 107.375 165.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . 0.618 HG22 ' HB ' ' A' ' 127' ' ' VAL . 1.4 p -136.43 152.4 29.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.065 -0.717 . . . . 83.65 109.065 -156.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -146.46 155.41 49.53 Favored Pre-proline 0 C--O 1.263 1.811 0 C-N-CA 123.948 0.899 . . . . 94.52 109.291 176.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -59.52 159.34 24.07 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 122.263 1.975 . . . . 66.76 111.698 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -157.66 133.86 9.53 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.744 -1.117 . . . . 88.25 108.31 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.0 m -93.33 140.77 29.18 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.732 -0.84 . . . . 68.06 108.732 171.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -118.96 134.91 54.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.721 0.296 . . . . 81.33 110.831 -174.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 96.9 mmm -102.12 -18.22 15.66 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 113.839 1.052 . . . . 82.39 113.839 -171.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ARG . . . . . 0.437 ' O ' HG23 ' A' ' 110' ' ' THR . 10.9 mmt180 -119.81 156.25 54.22 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.117 -1.068 . . . . 113.79 108.117 169.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.76 123.17 12.15 Favored 'Trans proline' 0 C--O 1.236 0.383 0 N-CA-C 110.295 -0.694 . . . . 87.38 110.295 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 108' ' ' ARG . 1.3 p -131.24 150.47 52.13 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.561 0.696 . . . . 74.69 110.152 178.257 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -102.24 146.07 28.52 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.08 -0.964 . . . . 92.51 109.96 -173.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 26.6 t -64.09 118.11 8.05 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.691 -0.686 . . . . 63.79 110.465 173.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -63.06 -24.58 67.98 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 119.698 -0.801 . . . . 86.77 112.202 -170.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -82.1 -58.61 2.88 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 118.314 0.506 . . . . 75.97 111.314 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 3.1 p -91.87 -18.52 23.67 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 113.632 0.975 . . . . 72.48 113.632 -170.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.95 -11.79 68.06 Favored Glycine 0 C--O 1.242 0.62 0 N-CA-C 116.19 1.236 . . . . 98.15 116.19 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -84.3 160.83 20.64 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.768 1.284 . . . . 83.05 110.694 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 11.4 ttm -74.4 139.11 43.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.066 -0.97 . . . . 103.11 110.55 -172.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 17.1 mt -61.91 124.79 21.73 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 107.935 -1.135 . . . . 71.49 107.935 161.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.4 p -117.68 168.2 10.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 118.451 -1.3 . . . . 74.78 110.079 175.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 119.29 179.62 16.68 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-O 122.066 0.814 . . . . 82.18 112.338 -175.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -96.76 -59.66 1.76 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.733 -0.733 . . . . 108.35 112.446 -177.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 7.2 mtp -113.83 162.67 16.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.543 -0.91 . . . . 112.3 108.543 168.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.5 mtt85 51.16 50.47 18.97 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 122.181 0.991 . . . . 107.24 112.151 166.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -71.4 -19.65 62.23 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.616 -0.72 . . . . 65.54 112.517 -171.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -165.02 -163.44 18.23 Favored Glycine 0 N--CA 1.44 -1.052 0 N-CA-C 109.103 -1.599 . . . . 61.32 109.103 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . 0.618 ' HB ' HG22 ' A' ' 101' ' ' VAL . 16.0 m -119.18 152.49 21.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.327 -0.99 . . . . 68.44 108.327 -178.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -124.6 133.23 53.33 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.106 -0.701 . . . . 88.98 109.106 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 42.4 t -86.93 137.69 32.16 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.466 -0.334 . . . . 77.95 110.658 -178.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.4 tttp -75.34 -28.96 59.82 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 116.051 -0.522 . . . . 94.57 112.389 -172.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 27.0 m-20 -97.74 -40.94 8.32 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.185 0.809 . . . . 97.17 113.185 -172.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' CYS . . . . . 0.425 ' HB3' ' SG ' ' A' ' 148' ' ' CYS . 2.0 p -105.78 1.14 26.73 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 121.056 -1.027 . . . . 78.32 113.047 175.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.2 t30 64.22 17.69 10.85 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 124.889 1.276 . . . . 109.57 113.451 168.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -76.62 167.52 54.52 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.179 -1.01 . . . . 78.19 112.745 -178.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 68.2 m-20 -124.44 121.18 34.17 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.557 1.143 . . . . 72.3 108.703 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -140.06 154.98 47.24 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 122.476 0.31 . . . . 61.03 111.05 -177.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 35.7 m80 -62.38 153.93 29.65 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 118.848 -1.141 . . . . 62.6 109.207 161.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -58.36 -45.68 87.73 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 119.192 -1.003 . . . . 80.32 110.81 176.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ARG . . . . . 0.44 ' O ' ' HG2' ' A' ' 66' ' ' PRO . 17.4 ptt180 -58.0 -20.95 42.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 119.524 -0.87 . . . . 89.72 111.463 174.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 35.3 m -96.5 -22.91 16.82 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 113.985 1.106 . . . . 55.06 113.985 -175.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 25.4 p -62.56 -16.54 56.69 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 119.162 0.892 . . . . 60.31 112.775 -169.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -133.5 28.93 3.96 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 118.297 0.499 . . . . 68.92 111.255 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.88 154.32 7.41 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 118.925 -1.11 . . . . 53.61 109.882 170.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ALA . . . . . 0.411 ' O ' ' HE1' ' A' ' 61' ' ' HIS . . . -57.84 138.54 55.58 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 118.7 -1.2 . . . . 51.28 109.423 172.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ARG . . . . . 0.694 HH11 HG12 ' A' ' 87' ' ' ILE . 7.7 mtp180 68.24 15.31 9.33 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 113.689 0.996 . . . . 74.4 113.689 177.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -95.48 66.83 2.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 122.441 1.115 . . . . 72.62 108.106 171.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.21 152.0 26.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.025 -0.989 . . . . 79.36 111.216 -173.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' CYS . . . . . 0.425 ' SG ' ' HB3' ' A' ' 132' ' ' CYS . 36.8 t -91.65 103.59 16.16 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 106.183 -1.784 . . . . 84.12 106.183 -170.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 111.396 -0.681 . . . . 83.44 111.396 178.331 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.521 -0.138 0 N-CA-C 112.011 0.374 . . . . 92.54 112.011 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.422 ' CD2' ' H ' ' A' ' 13' ' ' HIS . 0.4 OUTLIER -119.7 171.33 8.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.754 0.788 . . . . 90.22 111.287 -167.78 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 m -128.37 167.15 24.07 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 N-CA-C 106.737 -1.579 . . . . 70.76 106.737 154.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 56.1 t -116.83 133.33 63.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 107.889 -1.152 . . . . 64.0 107.889 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 67.6 mt -104.04 142.19 34.88 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 107.765 -1.198 . . . . 54.18 107.765 172.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.431 ' HD3' ' OE2' ' A' ' 85' ' ' GLU . 27.7 mtp-105 -131.57 135.67 47.18 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.781 -0.768 . . . . 52.5 110.711 175.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.415 ' CE2' HG22 ' A' ' 45' ' ' VAL . 80.2 t80 -152.22 146.21 25.26 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.301 -0.629 . . . . 74.08 109.301 169.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 65.24 -108.23 2.26 Favored Glycine 0 N--CA 1.446 -0.7 0 N-CA-C 109.856 -1.297 . . . . 87.42 109.856 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -132.98 32.25 2.79 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.49 -1.044 . . . . 98.3 110.49 172.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.9 p -127.0 136.12 51.8 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.788 -0.243 . . . . 73.21 111.059 -169.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -113.43 150.55 32.6 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 123.363 0.665 . . . . 96.36 110.061 172.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -145.89 137.51 25.01 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 124.294 1.037 . . . . 73.88 109.424 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 19.8 ttm -88.41 138.07 31.76 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 123.811 0.844 . . . . 95.08 109.403 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.7 t -134.58 128.3 19.0 Favored Pre-proline 0 C--O 1.238 0.496 0 N-CA-C 108.207 -1.034 . . . . 78.47 108.207 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -69.52 131.79 22.32 Favored 'Trans proline' 0 C--O 1.235 0.357 0 CA-C-N 119.788 0.96 . . . . 101.64 110.774 -176.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.628 ' HA ' ' HE1' ' A' ' 33' ' ' MET . 44.0 tp -94.62 104.47 16.41 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.463 -0.79 . . . . 88.86 109.301 -176.112 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.481 HD12 ' N ' ' A' ' 28' ' ' ILE . 4.0 mp -92.62 146.87 5.82 Favored 'Isoleucine or valine' 0 C--N 1.349 0.574 0 C-N-CA 124.845 1.258 . . . . 115.81 107.937 167.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.0 mmt-85 -95.28 114.37 26.14 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.705 -1.591 . . . . 109.55 106.705 163.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -172.21 147.86 2.07 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 107.064 -1.458 . . . . 98.01 107.064 -167.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.437 ' H ' ' CD ' ' A' ' 31' ' ' GLU . 42.6 mp0 -57.31 -36.06 70.62 Favored 'General case' 0 C--O 1.238 0.476 0 O-C-N 123.713 0.633 . . . . 135.44 112.104 -166.337 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -97.93 11.96 35.7 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.874 0.694 . . . . 120.75 112.874 -177.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' MET . . . . . 0.628 ' HE1' ' HA ' ' A' ' 27' ' ' LEU . 8.8 tpt -49.66 -45.94 49.14 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 120.192 -0.603 . . . . 90.4 111.067 176.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 tp -69.3 -43.74 73.17 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 120.724 -0.39 . . . . 73.86 111.645 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -44.92 -50.96 10.19 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-O 121.336 0.589 . . . . 86.77 111.037 171.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 40.3 mtm -67.22 -43.43 82.05 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 113.046 0.758 . . . . 93.18 113.046 -175.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.2 mt -58.11 -41.45 83.62 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 118.149 -1.421 . . . . 67.37 110.058 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 75.2 mmm -61.05 -40.42 93.55 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.273 -0.421 . . . . 60.58 111.46 -178.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -75.52 -30.73 59.88 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.197 -1.001 . . . . 96.5 112.263 -178.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -60.9 -48.43 81.86 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 119.907 -0.717 . . . . 76.93 109.71 168.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.06 -53.04 46.93 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 116.264 -0.425 . . . . 56.32 111.496 177.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -53.76 -42.05 67.8 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.015 0.436 . . . . 72.55 110.961 177.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -66.56 -41.66 88.27 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.416 -0.513 . . . . 80.62 111.121 -179.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.7 mt -55.21 -46.11 77.72 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.316 0.579 . . . . 61.18 110.909 175.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.415 HG22 ' CE2' ' A' ' 18' ' ' TYR . 2.7 t -70.82 -43.98 76.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 C-N-CA 119.057 -1.057 . . . . 68.64 110.846 -173.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -62.71 -20.26 64.72 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 118.519 -1.272 . . . . 95.11 111.229 174.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -55.93 -24.23 41.32 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.154 -1.022 . . . . 75.18 113.382 164.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -92.23 -26.01 18.38 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 117.636 0.718 . . . . 86.9 112.687 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.462 ' O ' ' N ' ' A' ' 51' ' ' LEU . . . 140.47 85.69 0.1 Allowed Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 119.478 -1.344 . . . . 99.43 115.127 169.59 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.5 m120 38.37 21.71 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 116.001 1.852 . . . . 113.64 116.001 170.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' A' ' 49' ' ' GLY . 34.1 mt -54.66 133.54 46.83 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.453 -0.943 . . . . 78.54 108.453 172.816 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.88 154.63 21.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.34 -0.944 . . . . 78.09 110.026 173.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 t -138.88 3.72 2.25 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 113.339 0.866 . . . . 58.85 113.339 -155.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -68.74 -23.8 64.38 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.436 0.532 . . . . 78.7 112.436 -174.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -111.63 36.2 3.36 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 117.438 -1.705 . . . . 49.24 111.35 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.9 ttp -79.37 128.91 33.93 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.363 -0.381 . . . . 58.66 110.438 176.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -132.55 152.27 51.65 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.542 -0.91 . . . . 46.87 108.542 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 85' ' ' GLU . 28.2 mt -103.91 136.24 43.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.178 -1.045 . . . . 53.37 108.178 172.445 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.434 ' CD1' HD12 ' A' ' 87' ' ' ILE . 37.1 m-85 -124.65 133.02 53.37 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.015 -1.106 . . . . 58.78 108.015 174.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -93.58 157.48 16.17 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 109.429 -0.582 . . . . 73.38 109.429 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.411 ' HE1' ' O ' ' A' ' 144' ' ' ALA . 57.1 m-70 -87.21 140.25 29.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.544 -0.753 . . . . 46.22 109.231 174.138 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.504 ' OE1' ' N ' ' A' ' 63' ' ' TYR . 6.2 tp10 -67.6 140.62 56.91 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 118.787 -1.165 . . . . 91.82 111.53 -177.739 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.504 ' N ' ' OE1' ' A' ' 62' ' ' GLU . 14.4 t80 -40.01 119.78 1.07 Allowed 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 125.372 1.469 . . . . 124.23 110.842 163.774 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.7 m120 67.82 7.42 5.72 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.187 0.81 . . . . 114.23 113.187 173.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.0 t -151.7 80.04 6.32 Favored Pre-proline 0 C--O 1.238 0.469 0 CA-C-N 119.579 1.081 . . . . 79.07 110.375 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.44 ' HG2' ' O ' ' A' ' 139' ' ' ARG . 3.6 Cg_endo -74.85 -4.27 15.16 Favored 'Trans proline' 0 CA--C 1.512 -0.588 0 C-N-CA 120.514 0.809 . . . . 60.81 114.173 -171.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.5 p -78.29 -9.45 59.25 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 119.705 1.139 . . . . 58.03 112.337 174.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.7 mt -107.49 135.47 48.9 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 123.456 0.703 . . . . 53.07 110.354 -176.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.416 ' HB3' ' HB3' ' A' ' 59' ' ' PHE . 35.9 mt -112.38 146.43 38.34 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 123.809 0.843 . . . . 54.79 111.284 174.461 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.497 ' CE2' ' HB2' ' A' ' 62' ' ' GLU . 62.0 m-85 -127.52 131.93 24.08 Favored Pre-proline 0 C--O 1.238 0.499 0 N-CA-C 107.876 -1.157 . . . . 74.52 107.876 174.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.33 141.76 43.72 Favored 'Trans proline' 0 N--CA 1.474 0.352 0 CA-C-N 119.209 0.753 . . . . 54.86 111.519 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.8 mm -86.9 126.45 40.84 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 109.346 -0.613 . . . . 53.73 109.346 173.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 p -119.1 -37.06 3.26 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 124.14 0.976 . . . . 79.77 113.02 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.1 p -121.09 154.64 35.86 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 118.5 0.591 . . . . 86.83 109.673 173.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.446 ' HA ' HD12 ' A' ' 78' ' ' ILE . . . -56.86 -19.84 19.69 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.531 -0.759 . . . . 87.58 112.457 -179.201 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.5 p -74.66 -29.25 61.18 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.153 0.427 . . . . 95.94 112.153 -171.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -67.46 -14.61 63.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 112.235 0.457 . . . . 75.18 112.235 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.446 HD12 ' HA ' ' A' ' 75' ' ' ALA . 3.9 mt -77.6 116.88 21.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 108.217 -1.031 . . . . 81.62 108.217 175.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 p -114.19 145.86 41.13 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.245 -0.65 . . . . 80.85 109.245 173.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.3 t -54.41 139.9 35.61 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.999 -0.546 . . . . 92.41 111.031 -178.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.1 -8.07 68.61 Favored Glycine 0 C--N 1.338 0.692 0 N-CA-C 116.126 1.211 . . . . 74.07 116.126 -175.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.2 p -74.61 150.27 39.71 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 119.416 1.608 . . . . 67.34 110.885 -173.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 9.0 mm -97.76 112.23 29.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 106.834 -1.543 . . . . 62.96 106.834 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.5 mt -100.48 128.95 46.39 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.501 -0.555 . . . . 50.99 109.501 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.431 ' OE2' ' HD3' ' A' ' 17' ' ' ARG . 81.5 mm-40 -93.1 137.81 32.12 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.366 0.603 . . . . 62.51 110.593 177.739 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 96.4 mt -100.85 120.37 50.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 104.923 -2.251 . . . . 52.57 104.923 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.694 HG12 HH11 ' A' ' 145' ' ' ARG . 42.7 mt -133.88 123.89 45.84 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 108.552 -0.907 . . . . 49.9 108.552 -169.258 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 56.3 mt -88.95 97.92 11.46 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 106.835 -1.543 . . . . 50.32 106.835 171.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 33.1 m -77.71 -8.94 12.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 N-CA-C 113.434 0.902 . . . . 61.18 113.434 -169.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -84.16 11.46 8.09 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 119.121 0.873 . . . . 60.28 111.796 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.4 ttp85 -124.17 134.57 53.27 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 117.336 -1.745 . . . . 104.37 110.492 -157.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 21.8 m -40.25 131.09 2.16 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 127.026 2.131 . . . . 86.03 112.34 -165.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -72.65 157.76 36.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 118.857 -1.137 . . . . 80.35 108.717 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -157.03 152.55 26.67 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.415 -0.957 . . . . 69.59 108.415 179.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.04 138.43 58.33 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.632 -0.713 . . . . 72.76 111.822 -170.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.1 m -65.48 151.17 10.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.632 0.729 . . . . 94.26 110.386 176.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 4.5 mt -117.49 98.98 52.34 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 108.123 -1.066 . . . . 85.82 108.123 175.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -87.44 144.52 6.77 Favored 'Trans proline' 0 CA--C 1.518 -0.315 0 CA-C-O 121.524 0.551 . . . . 85.36 112.518 -171.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -61.38 135.15 57.6 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.592 -0.731 . . . . 73.63 110.103 168.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.4 p -101.21 121.11 51.67 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 N-CA-C 107.375 -1.343 . . . . 94.39 107.375 165.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.618 HG22 ' HB ' ' A' ' 127' ' ' VAL . 1.4 p -136.43 152.4 29.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.065 -0.717 . . . . 83.65 109.065 -156.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -146.46 155.41 49.53 Favored Pre-proline 0 C--O 1.263 1.811 0 C-N-CA 123.948 0.899 . . . . 94.52 109.291 176.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -59.52 159.34 24.07 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 122.263 1.975 . . . . 66.76 111.698 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -157.66 133.86 9.53 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.744 -1.117 . . . . 88.25 108.31 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.0 m -93.33 140.77 29.18 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.732 -0.84 . . . . 68.06 108.732 171.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -118.96 134.91 54.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.721 0.296 . . . . 81.33 110.831 -174.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 96.9 mmm -102.12 -18.22 15.66 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 113.839 1.052 . . . . 82.39 113.839 -171.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.437 ' O ' HG23 ' A' ' 110' ' ' THR . 10.9 mmt180 -119.81 156.25 54.22 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.117 -1.068 . . . . 113.79 108.117 169.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.76 123.17 12.15 Favored 'Trans proline' 0 C--O 1.236 0.383 0 N-CA-C 110.295 -0.694 . . . . 87.38 110.295 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 108' ' ' ARG . 1.3 p -131.24 150.47 52.13 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.561 0.696 . . . . 74.69 110.152 178.257 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -102.24 146.07 28.52 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.08 -0.964 . . . . 92.51 109.96 -173.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 26.6 t -64.09 118.11 8.05 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.691 -0.686 . . . . 63.79 110.465 173.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -63.06 -24.58 67.98 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 119.698 -0.801 . . . . 86.77 112.202 -170.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -82.1 -58.61 2.88 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 118.314 0.506 . . . . 75.97 111.314 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 3.1 p -91.87 -18.52 23.67 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 113.632 0.975 . . . . 72.48 113.632 -170.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.95 -11.79 68.06 Favored Glycine 0 C--O 1.242 0.62 0 N-CA-C 116.19 1.236 . . . . 98.15 116.19 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -84.3 160.83 20.64 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.768 1.284 . . . . 83.05 110.694 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 11.4 ttm -74.4 139.11 43.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.066 -0.97 . . . . 103.11 110.55 -172.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 17.1 mt -61.91 124.79 21.73 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 107.935 -1.135 . . . . 71.49 107.935 161.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.4 p -117.68 168.2 10.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 118.451 -1.3 . . . . 74.78 110.079 175.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 119.29 179.62 16.68 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-O 122.066 0.814 . . . . 82.18 112.338 -175.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -96.76 -59.66 1.76 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.733 -0.733 . . . . 108.35 112.446 -177.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 7.2 mtp -113.83 162.67 16.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.543 -0.91 . . . . 112.3 108.543 168.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.5 mtt85 51.16 50.47 18.97 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 122.181 0.991 . . . . 107.24 112.151 166.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -71.4 -19.65 62.23 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.616 -0.72 . . . . 65.54 112.517 -171.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -165.02 -163.44 18.23 Favored Glycine 0 N--CA 1.44 -1.052 0 N-CA-C 109.103 -1.599 . . . . 61.32 109.103 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.618 ' HB ' HG22 ' A' ' 101' ' ' VAL . 16.0 m -119.18 152.49 21.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.327 -0.99 . . . . 68.44 108.327 -178.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -124.6 133.23 53.33 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.106 -0.701 . . . . 88.98 109.106 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 42.4 t -86.93 137.69 32.16 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.466 -0.334 . . . . 77.95 110.658 -178.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.4 tttp -75.34 -28.96 59.82 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 116.051 -0.522 . . . . 94.57 112.389 -172.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 27.0 m-20 -97.74 -40.94 8.32 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.185 0.809 . . . . 97.17 113.185 -172.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' CYS . . . . . 0.425 ' HB3' ' SG ' ' A' ' 148' ' ' CYS . 2.0 p -105.78 1.14 26.73 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 121.056 -1.027 . . . . 78.32 113.047 175.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.2 t30 64.22 17.69 10.85 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 124.889 1.276 . . . . 109.57 113.451 168.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -76.62 167.52 54.52 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.179 -1.01 . . . . 78.19 112.745 -178.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 68.2 m-20 -124.44 121.18 34.17 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.557 1.143 . . . . 72.3 108.703 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -140.06 154.98 47.24 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 122.476 0.31 . . . . 61.03 111.05 -177.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 35.7 m80 -62.38 153.93 29.65 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 118.848 -1.141 . . . . 62.6 109.207 161.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -58.36 -45.68 87.73 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 119.192 -1.003 . . . . 80.32 110.81 176.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.44 ' O ' ' HG2' ' A' ' 66' ' ' PRO . 17.4 ptt180 -58.0 -20.95 42.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 119.524 -0.87 . . . . 89.72 111.463 174.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 35.3 m -96.5 -22.91 16.82 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 113.985 1.106 . . . . 55.06 113.985 -175.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 25.4 p -62.56 -16.54 56.69 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 119.162 0.892 . . . . 60.31 112.775 -169.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -133.5 28.93 3.96 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 118.297 0.499 . . . . 68.92 111.255 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.88 154.32 7.41 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 118.925 -1.11 . . . . 53.61 109.882 170.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.411 ' O ' ' HE1' ' A' ' 61' ' ' HIS . . . -57.84 138.54 55.58 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 118.7 -1.2 . . . . 51.28 109.423 172.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.694 HH11 HG12 ' A' ' 87' ' ' ILE . 7.7 mtp180 68.24 15.31 9.33 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 113.689 0.996 . . . . 74.4 113.689 177.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -95.48 66.83 2.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 122.441 1.115 . . . . 72.62 108.106 171.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -82.21 152.0 26.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.025 -0.989 . . . . 79.36 111.216 -173.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.425 ' SG ' ' HB3' ' A' ' 132' ' ' CYS . 36.8 t -91.65 103.59 16.16 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 106.183 -1.784 . . . . 84.12 106.183 -170.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 111.396 -0.681 . . . . 83.44 111.396 178.331 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_