data_6akj_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 6akj _Structure_validation_residue.Date_analyzed 2019-02-08 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 ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.74 0.305 . . . . 130.61 110.89 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 74.6 mt-10 -127.11 70.22 1.29 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.735 -0.839 . . . . 120.56 108.735 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.8 t -142.03 124.74 15.94 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.86 -1.163 . . . . 105.88 107.86 175.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -148.58 132.21 16.83 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.253 -0.647 . . . . 71.46 109.253 -174.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 18.9 mt -130.95 126.65 60.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 108.69 -0.856 . . . . 67.9 108.69 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' A' ' 72' ' ' LEU . 97.3 mt -112.15 131.21 64.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.523 -0.917 . . . . 62.17 108.523 179.86 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mp -109.1 113.85 27.06 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.424 -0.954 . . . . 71.48 108.424 178.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.1 mt -88.91 110.98 21.55 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 107.888 -1.152 . . . . 68.14 107.888 173.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 85.2 mt -117.41 134.41 61.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 109.163 -0.68 . . . . 70.48 109.163 -171.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -133.69 109.68 9.33 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 107.074 -1.454 . . . . 81.0 107.074 171.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -66.22 -61.98 1.73 Allowed 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.894 0.378 . . . . 112.46 111.44 -171.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -102.99 -176.61 26.68 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-O 122.58 1.1 . . . . 87.4 112.785 -177.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 63.6 p -67.08 -28.47 68.21 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.449 -0.875 . . . . 87.94 111.6 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -75.62 125.39 88.6 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 109.614 -0.513 . . . . 110.24 109.614 177.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.96 -1.46 5.23 Favored 'Trans proline' 0 C--O 1.236 0.411 0 N-CA-C 114.417 0.891 . . . . 86.89 114.417 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.81 -20.39 62.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 119.324 0.965 . . . . 126.15 111.892 174.772 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 69.0 p -85.15 24.5 1.1 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.465 0.542 . . . . 76.33 112.465 177.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -84.24 140.72 31.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.179 0.514 . . . . 87.32 110.941 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.0 tt -156.61 150.31 10.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 106.93 -1.508 . . . . 84.54 106.93 175.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 -127.62 142.07 51.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.369 -0.378 . . . . 69.86 110.033 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 86.4 p -121.65 146.4 47.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.773 -0.648 . . . . 77.68 109.747 178.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -128.09 140.51 51.9 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.905 -0.589 . . . . 77.23 109.443 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 34.1 m-70 -139.43 160.23 40.32 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.517 0.675 . . . . 70.32 109.657 -173.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.5 p -90.21 -9.62 47.4 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.262 -0.881 . . . . 72.48 113.323 -176.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.0 p -157.44 166.31 33.36 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.606 -0.887 . . . . 66.42 108.606 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.8 tp -65.24 -33.54 76.24 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.282 -0.872 . . . . 70.15 111.483 176.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 59.6 ttm-85 -64.16 -40.32 95.88 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.462 -0.495 . . . . 117.7 111.277 178.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 40.0 t -64.99 -39.8 94.01 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.372 -0.531 . . . . 78.07 111.272 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.38 90.82 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.395 -0.522 . . . . 68.7 111.204 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 86.2 mt -70.48 -43.66 77.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 C-N-CA 120.41 -0.516 . . . . 73.88 110.531 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -63.86 -30.16 71.28 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.33 -0.548 . . . . 98.7 111.533 178.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -70.24 -49.99 44.35 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.538 -0.465 . . . . 81.39 111.147 177.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.2 tp -68.0 -20.12 25.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 120.575 -0.45 . . . . 78.28 111.474 -177.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 30.0 t -80.59 -38.44 17.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 120.376 -0.53 . . . . 94.26 110.406 171.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.97 -33.74 88.07 Favored Glycine 0 C--N 1.335 0.513 0 C-N-CA 120.459 -0.877 . . . . 93.67 113.45 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.1 p -71.73 -31.05 40.31 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 119.971 -0.692 . . . . 91.3 110.525 177.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -62.75 -33.03 74.3 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.853 -0.529 . . . . 117.09 111.734 177.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -103.18 57.78 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 122.341 1.067 . . . . 110.11 110.773 -177.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.5 p . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 115.057 -0.974 . . . . 108.46 110.52 175.336 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.816 0.341 . . . . 107.92 110.267 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 95.3 p -69.26 -16.96 63.7 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.538 -0.465 . . . . 108.61 111.746 172.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -76.73 -12.08 59.94 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.598 0.592 . . . . 164.16 112.598 176.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -70.96 -34.67 71.67 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.466 -0.494 . . . . 94.96 111.561 176.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -58.96 -44.2 91.45 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.335 -0.546 . . . . 109.54 111.007 172.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -69.1 -33.12 73.01 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.608 -0.437 . . . . 122.78 111.592 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -66.53 -45.02 80.81 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.436 -0.506 . . . . 78.48 110.953 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -70.78 -32.68 69.87 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.495 -0.482 . . . . 86.9 111.746 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -74.54 -24.31 58.93 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.601 -0.44 . . . . 105.16 112.147 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -76.9 -16.47 59.38 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.688 0.625 . . . . 159.97 112.688 177.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.7 mt -64.46 119.49 8.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 108.587 -0.894 . . . . 82.56 108.587 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -62.71 -38.38 90.2 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.161 -0.472 . . . . 78.39 111.82 -170.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -155.74 131.6 9.88 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.722 -0.844 . . . . 68.2 108.722 -177.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 41.7 t -145.25 111.66 5.72 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.469 -0.937 . . . . 72.14 108.469 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 59.1 t -115.53 106.03 51.13 Favored Pre-proline 0 C--O 1.239 0.53 0 N-CA-C 109.445 -0.576 . . . . 59.01 109.445 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -75.05 134.37 17.65 Favored 'Trans proline' 0 C--O 1.234 0.277 0 CA-C-N 118.87 0.632 . . . . 60.47 110.775 174.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . 0.456 ' N ' ' O ' ' A' ' 11' ' ' ILE . 95.7 mt -113.39 116.07 29.07 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.298 -1.001 . . . . 61.48 108.298 174.879 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 60.7 t -106.07 129.04 59.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.559 -0.904 . . . . 72.22 108.559 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -84.87 135.28 34.14 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.161 -0.472 . . . . 68.73 110.81 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -106.39 127.0 52.94 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.357 -0.979 . . . . 68.98 108.357 173.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . . . -69.5 -38.77 77.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.324 -0.55 . . . . 69.79 111.635 -172.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -72.73 -60.65 2.13 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.43 -0.508 . . . . 71.44 111.245 -176.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -66.19 -14.3 61.66 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.878 0.696 . . . . 67.79 112.878 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 54.37 44.58 28.71 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.715 0.769 . . . . 93.82 111.096 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.04 163.31 33.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.093 -0.706 . . . . 54.49 109.093 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -101.05 131.91 46.73 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.541 -0.754 . . . . 60.16 109.974 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 73.6 mt -95.76 120.37 63.4 Favored Pre-proline 0 C--O 1.241 0.62 0 N-CA-C 108.084 -1.08 . . . . 76.41 108.084 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.25 143.9 20.29 Favored 'Trans proline' 0 C--N 1.33 -0.405 0 CA-C-N 119.358 0.806 . . . . 61.86 111.742 178.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -129.7 155.82 45.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.467 -0.788 . . . . 63.99 109.543 178.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -75.2 164.91 25.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.778 0.799 . . . . 123.24 110.104 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -62.31 -33.34 74.48 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.465 -0.789 . . . . 103.4 111.919 -174.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -65.91 -22.0 66.48 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.641 0.608 . . . . 119.92 112.641 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 89.3 t90 -63.92 -34.77 78.72 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.379 -0.529 . . . . 77.33 111.626 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 59.8 tp -79.58 -32.28 41.99 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.787 -0.365 . . . . 71.35 111.765 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.6 tt -61.48 -47.34 86.12 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.894 0.378 . . . . 77.7 110.888 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -63.62 -39.74 95.12 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.737 -0.385 . . . . 89.62 111.436 -176.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 8.7 m170 -69.5 -33.68 73.2 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.057 -0.657 . . . . 82.93 111.596 176.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.15 -30.42 69.54 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.164 -0.614 . . . . 76.46 111.497 175.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -67.01 -40.32 87.26 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.376 -0.53 . . . . 88.83 111.308 177.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -64.57 -36.02 82.85 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.214 -0.595 . . . . 112.42 111.123 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -64.2 -25.81 68.24 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.886 -0.326 . . . . 100.41 111.694 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 89.6 mt -90.13 -0.62 57.69 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 113.289 0.848 . . . . 89.48 113.289 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 60.4 p . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 118.619 0.645 . . . . 108.27 111.026 179.391 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.673 0.273 . . . . 118.5 110.943 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 99.7 m-85 -93.68 142.54 27.24 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.315 -0.402 . . . . 102.41 110.314 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ASP . . . . . 0.422 ' OD1' ' OG ' ' A' ' 125' ' ' SER . 12.2 t0 -109.86 94.18 4.89 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 107.562 -1.273 . . . . 101.69 107.562 -178.735 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -77.64 6.63 6.91 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.193 0.812 . . . . 85.14 113.193 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' SER . . . . . 0.422 ' OG ' ' OD1' ' A' ' 123' ' ' ASP . 95.3 p -97.25 -9.14 28.24 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.918 0.711 . . . . 95.41 112.918 177.978 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -67.87 113.48 5.63 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.387 -0.597 . . . . 148.91 109.387 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 58.96 38.84 24.19 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.212 0.529 . . . . 92.88 111.506 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 16.4 p -83.35 6.81 18.57 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 113.234 0.827 . . . . 70.18 113.234 -175.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.8 t -156.84 134.88 11.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 118.776 0.717 . . . . 75.14 109.379 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -93.34 7.44 44.43 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.818 -0.628 . . . . 66.64 112.307 173.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -134.37 175.17 9.75 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.757 -0.831 . . . . 88.92 108.757 -178.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -104.7 -16.61 16.97 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.907 -0.588 . . . . 74.36 112.187 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -168.99 152.71 5.28 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.997 -1.112 . . . . 66.06 107.997 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.2 p -60.48 -14.94 22.27 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.571 0.582 . . . . 71.06 112.571 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' TYR . . . . . 0.459 ' O ' ' NH2' ' A' ' 144' ' ' ARG . 71.4 t80 -55.49 -27.17 46.79 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 117.921 0.328 . . . . 96.94 111.695 173.369 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -90.77 -6.44 54.36 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.298 0.851 . . . . 98.01 113.298 -178.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -65.48 152.07 93.09 Favored Pre-proline 0 C--O 1.234 0.266 0 CA-C-N 118.363 0.529 . . . . 75.34 110.568 -177.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -58.52 -35.23 98.93 Favored 'Trans proline' 0 C--O 1.237 0.469 0 N-CA-C 114.155 0.791 . . . . 76.09 114.155 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -66.22 -45.18 81.6 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.904 -0.718 . . . . 67.14 111.281 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -76.31 -20.48 57.24 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.986 -0.686 . . . . 71.15 112.343 -177.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 73.5 mtp85 -76.75 -22.7 53.41 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.176 0.444 . . . . 123.34 111.93 167.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 47.1 t -67.33 -36.51 81.59 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.86 -0.336 . . . . 87.28 111.422 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.34 51.41 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.877 0.846 . . . . 105.59 111.632 179.986 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ARG . . . . . 0.459 ' NH2' ' O ' ' A' ' 135' ' ' TYR . 34.2 mtt85 . . . . . 0 C--N 1.331 -0.212 0 CA-C-N 115.901 -0.59 . . . . 115.01 110.092 172.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 . . . . . 0 C--O 1.231 0.096 0 N-CA-C 111.992 0.367 . . . . 135.84 111.992 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 42.2 m -97.99 136.04 38.83 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.435 -0.58 . . . . 106.48 109.435 175.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' HIS . . . . . . . . . . . . . 23.2 t-80 -150.81 123.96 8.81 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.707 -0.849 . . . . 78.14 108.707 -178.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.7 mt -127.49 126.95 68.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.601 -0.888 . . . . 72.2 108.601 -177.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 60.1 mt -111.55 131.49 62.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 108.368 -0.975 . . . . 59.86 108.368 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 67.6 mt -107.27 113.26 26.55 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.406 -0.961 . . . . 65.15 108.406 177.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 79.4 mt -87.84 100.37 12.82 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 107.508 -1.293 . . . . 60.19 107.508 174.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 84.1 mt -106.72 135.42 45.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.358 -0.608 . . . . 77.42 109.358 -172.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -131.45 110.3 10.91 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 107.214 -1.402 . . . . 88.41 107.214 170.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -63.54 -55.97 19.71 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 123.36 0.412 . . . . 103.97 111.511 -171.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -116.43 -178.9 18.07 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-O 122.007 0.781 . . . . 77.2 112.47 -177.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 63.8 p -63.9 -25.43 68.14 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 114.396 -0.902 . . . . 79.07 112.561 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -80.42 122.94 83.13 Favored Pre-proline 0 C--O 1.237 0.428 0 N-CA-C 109.292 -0.633 . . . . 129.09 109.292 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -64.38 -2.96 5.6 Favored 'Trans proline' 0 C--O 1.236 0.417 0 N-CA-C 114.328 0.857 . . . . 75.25 114.328 -179.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp -66.95 -24.32 66.06 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 119.08 0.854 . . . . 128.52 111.292 177.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 73.3 p -84.41 17.19 2.71 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.153 0.797 . . . . 86.04 113.153 -177.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -76.51 143.91 40.11 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 118.465 0.575 . . . . 75.32 111.194 -176.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 9.9 tt -157.84 146.0 9.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 N-CA-C 107.121 -1.437 . . . . 74.97 107.121 173.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -123.02 146.42 47.66 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.225 0.535 . . . . 66.0 110.298 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 97.7 p -128.84 144.25 51.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.445 -0.798 . . . . 60.4 109.242 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -124.57 142.62 51.21 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.417 -0.586 . . . . 74.86 109.417 176.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 27.5 m-70 -140.91 157.52 45.25 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.434 0.635 . . . . 65.96 109.484 -175.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 30.5 p -89.45 -3.37 58.43 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.373 -0.83 . . . . 82.21 113.188 -176.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 59.7 p -160.95 166.45 28.32 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.777 -0.823 . . . . 69.77 108.777 179.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 56.7 tp -67.03 -39.06 86.91 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.139 -0.937 . . . . 72.6 111.132 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 44.3 ttm-85 -60.68 -40.65 92.92 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.503 -0.479 . . . . 120.98 111.212 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 45.7 t -64.01 -36.51 84.21 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.531 -0.468 . . . . 77.11 111.274 178.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.8 -40.98 83.83 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.42 -0.512 . . . . 71.19 111.229 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 70.7 mt -68.51 -44.33 83.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.592 -0.443 . . . . 82.92 110.535 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -63.77 -27.73 69.39 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.223 -0.591 . . . . 101.59 111.561 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -68.54 -52.4 32.36 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.441 -0.504 . . . . 68.85 111.16 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 10.5 tp -68.82 -31.17 49.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 C-N-CA 120.127 -0.629 . . . . 79.12 110.806 -175.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 46.8 t -68.8 -43.45 82.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 O-C-N 121.707 -0.621 . . . . 76.04 110.325 173.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.81 -27.86 70.8 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.242 -0.98 . . . . 84.37 113.024 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 44.6 t -68.07 -42.83 85.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 117.301 0.551 . . . . 77.96 110.375 175.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -63.64 -30.05 71.21 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.491 -0.484 . . . . 79.05 111.632 177.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -86.52 9.56 17.99 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.152 0.797 . . . . 120.01 113.152 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 29.3 p -77.49 -3.7 41.85 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.741 0.645 . . . . 125.2 112.741 174.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 118.314 0.506 . . . . 125.2 110.819 175.299 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.918 0.389 . . . . 127.07 110.393 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' VAL . . . . . . . . . . . . . 31.4 t 64.07 -70.56 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 124.572 1.149 . . . . 97.25 111.54 172.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 1.4 p -62.91 -38.42 90.89 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.873 -0.731 . . . . 120.27 111.102 -177.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -66.9 -28.53 68.39 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.589 -0.445 . . . . 159.3 111.341 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -69.14 -43.32 74.6 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.51 -0.476 . . . . 77.42 111.25 176.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -69.76 -25.86 64.02 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.809 -0.756 . . . . 85.25 111.402 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -60.43 -45.16 94.63 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.174 -0.611 . . . . 115.52 110.44 167.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -64.81 -40.23 94.87 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.88 -0.328 . . . . 78.3 111.447 177.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -68.42 -41.74 79.96 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.915 -0.714 . . . . 99.38 111.215 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.48 -29.96 71.0 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.319 -0.552 . . . . 90.65 111.597 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -71.61 -17.48 62.28 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.597 0.592 . . . . 153.75 112.597 -179.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 59.0 mt -61.6 123.59 14.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.662 -0.866 . . . . 78.56 108.662 176.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -64.13 -37.34 87.11 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 116.268 -0.424 . . . . 85.38 111.716 -171.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -155.27 135.06 12.76 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.998 -0.741 . . . . 65.44 108.998 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' CYS . . . . . . . . . . . . . 34.8 t -156.68 98.82 1.82 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.515 -1.291 . . . . 70.14 107.515 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 1.7 m -109.97 115.33 55.21 Favored Pre-proline 0 C--O 1.239 0.52 0 N-CA-C 108.242 -1.022 . . . . 80.29 108.242 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -80.71 143.6 15.0 Favored 'Trans proline' 0 C--N 1.331 -0.354 0 C-N-CA 120.323 0.682 . . . . 61.82 111.884 177.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 25.0 mt -121.77 116.62 24.82 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.135 -1.061 . . . . 62.27 108.135 175.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.9 m -105.18 134.4 46.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 108.623 -0.881 . . . . 88.83 108.623 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -82.88 137.58 34.21 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.122 -0.49 . . . . 64.04 110.652 -177.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -105.89 125.7 51.31 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.75 -0.833 . . . . 74.12 108.75 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ARG . . . . . . . . . . . . . 64.5 mtp180 -61.47 -50.08 74.18 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.468 0.48 . . . . 141.23 111.551 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -72.44 -53.96 10.7 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.172 -0.611 . . . . 78.55 111.445 -173.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -71.49 -14.04 62.0 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.777 0.658 . . . . 66.64 112.777 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 78.8 mtm180 52.69 48.69 21.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 122.061 0.934 . . . . 80.93 111.048 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.2 165.37 31.12 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.396 -0.964 . . . . 56.5 108.396 -179.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -103.06 127.3 50.37 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.59 -0.732 . . . . 55.79 110.049 -176.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 76.6 mt -90.66 119.02 69.09 Favored Pre-proline 0 C--O 1.242 0.677 0 N-CA-C 107.96 -1.126 . . . . 75.46 107.96 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.78 143.54 18.66 Favored 'Trans proline' 0 C--N 1.332 -0.337 0 CA-C-N 119.264 0.773 . . . . 61.9 111.428 176.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -129.69 163.56 25.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.449 -0.796 . . . . 66.34 109.552 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -76.45 164.02 26.38 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.284 -0.871 . . . . 113.86 110.268 176.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -59.43 -30.34 68.42 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.175 -0.92 . . . . 83.03 111.404 175.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -65.27 -27.1 68.4 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 111.864 0.32 . . . . 147.22 111.864 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -60.95 -40.72 94.36 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.752 -0.379 . . . . 89.56 111.354 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 18.7 tp -75.58 -23.07 56.46 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 112.397 0.517 . . . . 86.23 112.397 177.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.31 -46.02 82.03 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 117.988 0.358 . . . . 86.2 111.151 176.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -63.31 -45.03 93.22 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.88 -0.328 . . . . 122.66 111.23 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' HIS . . . . . . . . . . . . . 82.2 m-70 -67.34 -36.43 81.4 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.189 -0.604 . . . . 80.95 111.336 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.84 -30.95 69.6 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.02 -0.672 . . . . 71.19 111.442 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLN . . . . . . . . . . . . . 35.3 tp60 -63.71 -50.7 68.12 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.718 -0.393 . . . . 85.64 111.083 178.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -71.68 -20.13 61.98 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.326 -0.55 . . . . 113.5 112.383 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -69.11 -36.76 77.87 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.126 -0.63 . . . . 96.48 111.085 174.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 57.1 mt -80.44 -18.83 47.61 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.806 0.669 . . . . 97.25 112.806 -177.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 63.0 p -76.56 -44.94 32.61 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.301 0.501 . . . . 111.38 111.147 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.72 -17.55 64.91 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.578 0.584 . . . . 115.01 112.578 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.99 -11.19 60.83 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.789 0.663 . . . . 112.18 112.789 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 118.425 0.557 . . . . 117.33 110.935 179.177 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.744 0.307 . . . . 114.79 111.178 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -81.4 140.59 34.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.051 0.453 . . . . 94.26 110.408 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -111.17 105.93 14.78 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.205 -1.035 . . . . 100.18 108.205 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -83.92 -6.39 59.41 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 113.459 0.911 . . . . 85.94 113.459 -175.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 98.7 p -82.25 -4.43 57.12 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 118.69 0.677 . . . . 87.45 112.71 176.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -72.67 114.12 10.45 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.528 -0.545 . . . . 137.02 109.528 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' HIS . . . . . 0.535 ' N ' ' O1 ' ' B' ' 201' ' ' SO4 . 2.4 m-70 58.07 32.39 21.92 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.363 0.665 . . . . 94.93 111.931 179.904 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' CYS . . . . . . . . . . . . . 16.3 p -77.88 4.66 11.39 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 113.296 0.85 . . . . 84.44 113.296 -175.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' THR . . . . . . . . . . . . . 10.3 t -155.92 141.8 18.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 119.02 0.827 . . . . 70.78 109.564 177.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -100.26 -3.15 32.03 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.667 -0.697 . . . . 85.14 111.993 170.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -125.42 155.23 40.74 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.804 -0.813 . . . . 94.86 108.804 178.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' GLY . . . . . . . . . . . . . . . -79.92 -39.6 16.46 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.556 -0.83 . . . . 110.26 112.044 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -144.32 157.51 44.23 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.338 -0.986 . . . . 96.12 108.338 -177.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' SER . . . . . . . . . . . . . 93.2 p -62.26 -14.06 34.76 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.178 -0.609 . . . . 67.53 112.307 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -55.6 -26.15 42.31 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 117.829 0.286 . . . . 91.62 111.527 172.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -93.61 -0.14 56.31 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 113.506 0.928 . . . . 135.23 113.506 -177.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' TRP . . . . . . . . . . . . . 46.1 m0 -70.86 154.11 94.43 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 118.677 0.671 . . . . 74.59 110.446 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -59.47 -31.26 94.41 Favored 'Trans proline' 0 C--O 1.237 0.463 0 N-CA-C 114.138 0.784 . . . . 95.07 114.138 -177.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -70.02 -47.24 62.91 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.748 0.704 . . . . 78.09 111.21 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -72.87 -24.61 60.89 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.61 0.596 . . . . 76.31 112.61 -176.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -71.62 -31.13 66.55 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.799 -0.761 . . . . 174.97 111.494 174.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 83.3 p -70.65 -17.1 62.87 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 112.276 0.473 . . . . 92.5 112.276 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 81.3 mt -85.44 29.96 0.65 Allowed 'General case' 0 C--O 1.238 0.495 0 N-CA-C 112.66 0.615 . . . . 115.25 112.66 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 66.5 mtt180 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 117.933 0.333 . . . . 109.66 110.488 179.593 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' SO4 . . . . . 0.535 ' O1 ' ' N ' ' B' ' 127' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.74 0.305 . . . . 130.61 110.89 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 74.6 mt-10 -127.11 70.22 1.29 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.735 -0.839 . . . . 120.56 108.735 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.8 t -142.03 124.74 15.94 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.86 -1.163 . . . . 105.88 107.86 175.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -148.58 132.21 16.83 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.253 -0.647 . . . . 71.46 109.253 -174.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 18.9 mt -130.95 126.65 60.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 108.69 -0.856 . . . . 67.9 108.69 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' A' ' 72' ' ' LEU . 97.3 mt -112.15 131.21 64.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.523 -0.917 . . . . 62.17 108.523 179.86 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mp -109.1 113.85 27.06 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.424 -0.954 . . . . 71.48 108.424 178.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.1 mt -88.91 110.98 21.55 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 107.888 -1.152 . . . . 68.14 107.888 173.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 85.2 mt -117.41 134.41 61.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 109.163 -0.68 . . . . 70.48 109.163 -171.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -133.69 109.68 9.33 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 107.074 -1.454 . . . . 81.0 107.074 171.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -66.22 -61.98 1.73 Allowed 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.894 0.378 . . . . 112.46 111.44 -171.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -102.99 -176.61 26.68 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-O 122.58 1.1 . . . . 87.4 112.785 -177.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 63.6 p -67.08 -28.47 68.21 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.449 -0.875 . . . . 87.94 111.6 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -75.62 125.39 88.6 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 109.614 -0.513 . . . . 110.24 109.614 177.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.96 -1.46 5.23 Favored 'Trans proline' 0 C--O 1.236 0.411 0 N-CA-C 114.417 0.891 . . . . 86.89 114.417 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.81 -20.39 62.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 119.324 0.965 . . . . 126.15 111.892 174.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 69.0 p -85.15 24.5 1.1 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.465 0.542 . . . . 76.33 112.465 177.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -84.24 140.72 31.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.179 0.514 . . . . 87.32 110.941 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.0 tt -156.61 150.31 10.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 106.93 -1.508 . . . . 84.54 106.93 175.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 -127.62 142.07 51.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.369 -0.378 . . . . 69.86 110.033 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 86.4 p -121.65 146.4 47.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.773 -0.648 . . . . 77.68 109.747 178.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -128.09 140.51 51.9 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.905 -0.589 . . . . 77.23 109.443 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 34.1 m-70 -139.43 160.23 40.32 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.517 0.675 . . . . 70.32 109.657 -173.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.5 p -90.21 -9.62 47.4 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.262 -0.881 . . . . 72.48 113.323 -176.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.0 p -157.44 166.31 33.36 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.606 -0.887 . . . . 66.42 108.606 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.8 tp -65.24 -33.54 76.24 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.282 -0.872 . . . . 70.15 111.483 176.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 59.6 ttm-85 -64.16 -40.32 95.88 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.462 -0.495 . . . . 117.7 111.277 178.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 40.0 t -64.99 -39.8 94.01 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.372 -0.531 . . . . 78.07 111.272 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.38 90.82 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.395 -0.522 . . . . 68.7 111.204 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . 0.563 HD11 ' HB3' ' A' ' 92' ' ' HIS . 86.2 mt -70.48 -43.66 77.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 C-N-CA 120.41 -0.516 . . . . 73.88 110.531 178.605 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -63.86 -30.16 71.28 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.33 -0.548 . . . . 98.7 111.533 178.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -70.24 -49.99 44.35 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.538 -0.465 . . . . 81.39 111.147 177.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.2 tp -68.0 -20.12 25.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 120.575 -0.45 . . . . 78.28 111.474 -177.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 30.0 t -80.59 -38.44 17.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 120.376 -0.53 . . . . 94.26 110.406 171.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.97 -33.74 88.07 Favored Glycine 0 C--N 1.335 0.513 0 C-N-CA 120.459 -0.877 . . . . 93.67 113.45 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.1 p -71.73 -31.05 40.31 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 119.971 -0.692 . . . . 91.3 110.525 177.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -62.75 -33.03 74.3 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.853 -0.529 . . . . 117.09 111.734 177.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -103.18 57.78 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 122.341 1.067 . . . . 110.11 110.773 -177.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.5 p . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 115.057 -0.974 . . . . 108.46 110.52 175.336 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.816 0.341 . . . . 107.92 110.267 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 95.3 p -69.26 -16.96 63.7 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.538 -0.465 . . . . 108.61 111.746 172.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . 0.527 ' HD2' ' H ' ' A' ' 58' ' ' ARG . 1.4 mpt_? -76.73 -12.08 59.94 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.598 0.592 . . . . 164.16 112.598 176.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -70.96 -34.67 71.67 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.466 -0.494 . . . . 94.96 111.561 176.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -58.96 -44.2 91.45 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.335 -0.546 . . . . 109.54 111.007 172.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -69.1 -33.12 73.01 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.608 -0.437 . . . . 122.78 111.592 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -66.53 -45.02 80.81 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.436 -0.506 . . . . 78.48 110.953 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -70.78 -32.68 69.87 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.495 -0.482 . . . . 86.9 111.746 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -74.54 -24.31 58.93 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.601 -0.44 . . . . 105.16 112.147 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -76.9 -16.47 59.38 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.688 0.625 . . . . 159.97 112.688 177.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.7 mt -64.46 119.49 8.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 108.587 -0.894 . . . . 82.56 108.587 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -62.71 -38.38 90.2 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.161 -0.472 . . . . 78.39 111.82 -170.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -155.74 131.6 9.88 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.722 -0.844 . . . . 68.2 108.722 -177.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' CYS . . . . . 0.636 ' HB3' ' HG3' ' A' ' 86' ' ' LYS . 41.7 t -145.25 111.66 5.72 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.469 -0.937 . . . . 72.14 108.469 179.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 59.1 t -115.53 106.03 51.13 Favored Pre-proline 0 C--O 1.239 0.53 0 N-CA-C 109.445 -0.576 . . . . 59.01 109.445 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -75.05 134.37 17.65 Favored 'Trans proline' 0 C--O 1.234 0.277 0 CA-C-N 118.87 0.632 . . . . 60.47 110.775 174.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . 0.459 ' HB2' ' HB ' ' A' ' 11' ' ' ILE . 95.7 mt -113.39 116.07 29.07 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.298 -1.001 . . . . 61.48 108.298 174.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 60.7 t -106.07 129.04 59.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.559 -0.904 . . . . 72.22 108.559 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TYR . . . . . 0.425 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 89.6 t80 -84.87 135.28 34.14 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.161 -0.472 . . . . 68.73 110.81 -176.461 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -106.39 127.0 52.94 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.357 -0.979 . . . . 68.98 108.357 173.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . . . -69.5 -38.77 77.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.324 -0.55 . . . . 69.79 111.635 -172.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -72.73 -60.65 2.13 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.43 -0.508 . . . . 71.44 111.245 -176.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -66.19 -14.3 61.66 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.878 0.696 . . . . 67.79 112.878 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 54.37 44.58 28.71 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.715 0.769 . . . . 93.82 111.096 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.04 163.31 33.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.093 -0.706 . . . . 54.49 109.093 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 74' ' ' TYR . 75.7 m-85 -101.05 131.91 46.73 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.541 -0.754 . . . . 60.16 109.974 -178.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 73.6 mt -95.76 120.37 63.4 Favored Pre-proline 0 C--O 1.241 0.62 0 N-CA-C 108.084 -1.08 . . . . 76.41 108.084 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.25 143.9 20.29 Favored 'Trans proline' 0 C--N 1.33 -0.405 0 CA-C-N 119.358 0.806 . . . . 61.86 111.742 178.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -129.7 155.82 45.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.467 -0.788 . . . . 63.99 109.543 178.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -75.2 164.91 25.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.778 0.799 . . . . 123.24 110.104 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . 0.636 ' HG3' ' HB3' ' A' ' 69' ' ' CYS . 38.0 ttpt -62.31 -33.34 74.48 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.465 -0.789 . . . . 103.4 111.919 -174.454 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -65.91 -22.0 66.48 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.641 0.608 . . . . 119.92 112.641 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 89.3 t90 -63.92 -34.77 78.72 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.379 -0.529 . . . . 77.33 111.626 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 59.8 tp -79.58 -32.28 41.99 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.787 -0.365 . . . . 71.35 111.765 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.6 tt -61.48 -47.34 86.12 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.894 0.378 . . . . 77.7 110.888 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -63.62 -39.74 95.12 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.737 -0.385 . . . . 89.62 111.436 -176.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HIS . . . . . 0.563 ' HB3' HD11 ' A' ' 35' ' ' ILE . 8.7 m170 -69.5 -33.68 73.2 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.057 -0.657 . . . . 82.93 111.596 176.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.15 -30.42 69.54 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.164 -0.614 . . . . 76.46 111.497 175.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -67.01 -40.32 87.26 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.376 -0.53 . . . . 88.83 111.308 177.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -64.57 -36.02 82.85 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.214 -0.595 . . . . 112.42 111.123 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -64.2 -25.81 68.24 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.886 -0.326 . . . . 100.41 111.694 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 89.6 mt -90.13 -0.62 57.69 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 113.289 0.848 . . . . 89.48 113.289 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 60.4 p . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 118.619 0.645 . . . . 108.27 111.026 179.391 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.673 0.273 . . . . 118.5 110.943 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 99.7 m-85 -93.68 142.54 27.24 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.315 -0.402 . . . . 102.41 110.314 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -109.86 94.18 4.89 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 107.562 -1.273 . . . . 101.69 107.562 -178.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -77.64 6.63 6.91 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.193 0.812 . . . . 85.14 113.193 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 95.3 p -97.25 -9.14 28.24 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.918 0.711 . . . . 95.41 112.918 177.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -67.87 113.48 5.63 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.387 -0.597 . . . . 148.91 109.387 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 58.96 38.84 24.19 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.212 0.529 . . . . 92.88 111.506 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 16.4 p -83.35 6.81 18.57 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 113.234 0.827 . . . . 70.18 113.234 -175.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.8 t -156.84 134.88 11.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 118.776 0.717 . . . . 75.14 109.379 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -93.34 7.44 44.43 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.818 -0.628 . . . . 66.64 112.307 173.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -134.37 175.17 9.75 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.757 -0.831 . . . . 88.92 108.757 -178.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -104.7 -16.61 16.97 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.907 -0.588 . . . . 74.36 112.187 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -168.99 152.71 5.28 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.997 -1.112 . . . . 66.06 107.997 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.2 p -60.48 -14.94 22.27 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.571 0.582 . . . . 71.06 112.571 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' TYR . . . . . 0.419 ' O ' ' NH2' ' A' ' 144' ' ' ARG . 71.4 t80 -55.49 -27.17 46.79 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 117.921 0.328 . . . . 96.94 111.695 173.369 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -90.77 -6.44 54.36 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.298 0.851 . . . . 98.01 113.298 -178.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -65.48 152.07 93.09 Favored Pre-proline 0 C--O 1.234 0.266 0 CA-C-N 118.363 0.529 . . . . 75.34 110.568 -177.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -58.52 -35.23 98.93 Favored 'Trans proline' 0 C--O 1.237 0.469 0 N-CA-C 114.155 0.791 . . . . 76.09 114.155 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -66.22 -45.18 81.6 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.904 -0.718 . . . . 67.14 111.281 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -76.31 -20.48 57.24 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.986 -0.686 . . . . 71.15 112.343 -177.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ARG . . . . . 0.55 ' HG2' HH12 ' A' ' 144' ' ' ARG . 73.5 mtp85 -76.75 -22.7 53.41 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.176 0.444 . . . . 123.34 111.93 167.613 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 47.1 t -67.33 -36.51 81.59 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.86 -0.336 . . . . 87.28 111.422 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.34 51.41 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.877 0.846 . . . . 105.59 111.632 179.986 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ARG . . . . . 0.55 HH12 ' HG2' ' A' ' 141' ' ' ARG . 34.2 mtt85 . . . . . 0 C--N 1.331 -0.212 0 CA-C-N 115.901 -0.59 . . . . 115.01 110.092 172.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 . . . . . 0 C--O 1.231 0.096 0 N-CA-C 111.992 0.367 . . . . 135.84 111.992 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 42.2 m -97.99 136.04 38.83 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.435 -0.58 . . . . 106.48 109.435 175.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' HIS . . . . . . . . . . . . . 23.2 t-80 -150.81 123.96 8.81 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.707 -0.849 . . . . 78.14 108.707 -178.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.7 mt -127.49 126.95 68.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.601 -0.888 . . . . 72.2 108.601 -177.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 60.1 mt -111.55 131.49 62.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 108.368 -0.975 . . . . 59.86 108.368 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 67.6 mt -107.27 113.26 26.55 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.406 -0.961 . . . . 65.15 108.406 177.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LEU . . . . . 0.58 ' HB2' HG23 ' B' ' 70' ' ' VAL . 79.4 mt -87.84 100.37 12.82 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 107.508 -1.293 . . . . 60.19 107.508 174.646 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 84.1 mt -106.72 135.42 45.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.358 -0.608 . . . . 77.42 109.358 -172.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -131.45 110.3 10.91 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 107.214 -1.402 . . . . 88.41 107.214 170.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -63.54 -55.97 19.71 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 123.36 0.412 . . . . 103.97 111.511 -171.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -116.43 -178.9 18.07 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-O 122.007 0.781 . . . . 77.2 112.47 -177.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 63.8 p -63.9 -25.43 68.14 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 114.396 -0.902 . . . . 79.07 112.561 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -80.42 122.94 83.13 Favored Pre-proline 0 C--O 1.237 0.428 0 N-CA-C 109.292 -0.633 . . . . 129.09 109.292 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -64.38 -2.96 5.6 Favored 'Trans proline' 0 C--O 1.236 0.417 0 N-CA-C 114.328 0.857 . . . . 75.25 114.328 -179.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp -66.95 -24.32 66.06 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 119.08 0.854 . . . . 128.52 111.292 177.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 73.3 p -84.41 17.19 2.71 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.153 0.797 . . . . 86.04 113.153 -177.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -76.51 143.91 40.11 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 118.465 0.575 . . . . 75.32 111.194 -176.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 9.9 tt -157.84 146.0 9.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 N-CA-C 107.121 -1.437 . . . . 74.97 107.121 173.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -123.02 146.42 47.66 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.225 0.535 . . . . 66.0 110.298 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 97.7 p -128.84 144.25 51.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.445 -0.798 . . . . 60.4 109.242 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -124.57 142.62 51.21 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.417 -0.586 . . . . 74.86 109.417 176.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 27.5 m-70 -140.91 157.52 45.25 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.434 0.635 . . . . 65.96 109.484 -175.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 30.5 p -89.45 -3.37 58.43 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.373 -0.83 . . . . 82.21 113.188 -176.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 59.7 p -160.95 166.45 28.32 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.777 -0.823 . . . . 69.77 108.777 179.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 56.7 tp -67.03 -39.06 86.91 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.139 -0.937 . . . . 72.6 111.132 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 44.3 ttm-85 -60.68 -40.65 92.92 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.503 -0.479 . . . . 120.98 111.212 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 45.7 t -64.01 -36.51 84.21 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.531 -0.468 . . . . 77.11 111.274 178.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.8 -40.98 83.83 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.42 -0.512 . . . . 71.19 111.229 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 70.7 mt -68.51 -44.33 83.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.592 -0.443 . . . . 82.92 110.535 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -63.77 -27.73 69.39 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.223 -0.591 . . . . 101.59 111.561 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -68.54 -52.4 32.36 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.441 -0.504 . . . . 68.85 111.16 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 10.5 tp -68.82 -31.17 49.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 C-N-CA 120.127 -0.629 . . . . 79.12 110.806 -175.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 46.8 t -68.8 -43.45 82.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 O-C-N 121.707 -0.621 . . . . 76.04 110.325 173.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.81 -27.86 70.8 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.242 -0.98 . . . . 84.37 113.024 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 44.6 t -68.07 -42.83 85.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 117.301 0.551 . . . . 77.96 110.375 175.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -63.64 -30.05 71.21 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.491 -0.484 . . . . 79.05 111.632 177.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -86.52 9.56 17.99 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.152 0.797 . . . . 120.01 113.152 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 29.3 p -77.49 -3.7 41.85 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.741 0.645 . . . . 125.2 112.741 174.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 118.314 0.506 . . . . 125.2 110.819 175.299 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.918 0.389 . . . . 127.07 110.393 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' VAL . . . . . . . . . . . . . 31.4 t 64.07 -70.56 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 124.572 1.149 . . . . 97.25 111.54 172.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 1.4 p -62.91 -38.42 90.89 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.873 -0.731 . . . . 120.27 111.102 -177.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -66.9 -28.53 68.39 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.589 -0.445 . . . . 159.3 111.341 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -69.14 -43.32 74.6 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.51 -0.476 . . . . 77.42 111.25 176.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -69.76 -25.86 64.02 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.809 -0.756 . . . . 85.25 111.402 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -60.43 -45.16 94.63 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.174 -0.611 . . . . 115.52 110.44 167.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -64.81 -40.23 94.87 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.88 -0.328 . . . . 78.3 111.447 177.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -68.42 -41.74 79.96 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.915 -0.714 . . . . 99.38 111.215 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.48 -29.96 71.0 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.319 -0.552 . . . . 90.65 111.597 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -71.61 -17.48 62.28 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.597 0.592 . . . . 153.75 112.597 -179.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 59.0 mt -61.6 123.59 14.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.662 -0.866 . . . . 78.56 108.662 176.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -64.13 -37.34 87.11 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 116.268 -0.424 . . . . 85.38 111.716 -171.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -155.27 135.06 12.76 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.998 -0.741 . . . . 65.44 108.998 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' CYS . . . . . . . . . . . . . 34.8 t -156.68 98.82 1.82 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.515 -1.291 . . . . 70.14 107.515 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' VAL . . . . . 0.58 HG23 ' HB2' ' B' ' 13' ' ' LEU . 1.7 m -109.97 115.33 55.21 Favored Pre-proline 0 C--O 1.239 0.52 0 N-CA-C 108.242 -1.022 . . . . 80.29 108.242 -179.012 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -80.71 143.6 15.0 Favored 'Trans proline' 0 C--N 1.331 -0.354 0 C-N-CA 120.323 0.682 . . . . 61.82 111.884 177.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 25.0 mt -121.77 116.62 24.82 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.135 -1.061 . . . . 62.27 108.135 175.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.9 m -105.18 134.4 46.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 108.623 -0.881 . . . . 88.83 108.623 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -82.88 137.58 34.21 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.122 -0.49 . . . . 64.04 110.652 -177.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -105.89 125.7 51.31 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.75 -0.833 . . . . 74.12 108.75 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ARG . . . . . . . . . . . . . 64.5 mtp180 -61.47 -50.08 74.18 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.468 0.48 . . . . 141.23 111.551 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -72.44 -53.96 10.7 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.172 -0.611 . . . . 78.55 111.445 -173.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -71.49 -14.04 62.0 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.777 0.658 . . . . 66.64 112.777 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 78.8 mtm180 52.69 48.69 21.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 122.061 0.934 . . . . 80.93 111.048 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.2 165.37 31.12 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.396 -0.964 . . . . 56.5 108.396 -179.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -103.06 127.3 50.37 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.59 -0.732 . . . . 55.79 110.049 -176.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 76.6 mt -90.66 119.02 69.09 Favored Pre-proline 0 C--O 1.242 0.677 0 N-CA-C 107.96 -1.126 . . . . 75.46 107.96 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.78 143.54 18.66 Favored 'Trans proline' 0 C--N 1.332 -0.337 0 CA-C-N 119.264 0.773 . . . . 61.9 111.428 176.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -129.69 163.56 25.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.449 -0.796 . . . . 66.34 109.552 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -76.45 164.02 26.38 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.284 -0.871 . . . . 113.86 110.268 176.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -59.43 -30.34 68.42 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.175 -0.92 . . . . 83.03 111.404 175.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' GLN . . . . . 0.46 ' HA ' HD12 ' B' ' 90' ' ' LEU . 61.9 tt0 -65.27 -27.1 68.4 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 111.864 0.32 . . . . 147.22 111.864 179.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -60.95 -40.72 94.36 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.752 -0.379 . . . . 89.56 111.354 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 18.7 tp -75.58 -23.07 56.46 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 112.397 0.517 . . . . 86.23 112.397 177.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' B' ' 87' ' ' GLN . 19.7 mt -65.31 -46.02 82.03 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 117.988 0.358 . . . . 86.2 111.151 176.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -63.31 -45.03 93.22 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.88 -0.328 . . . . 122.66 111.23 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' HIS . . . . . . . . . . . . . 82.2 m-70 -67.34 -36.43 81.4 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.189 -0.604 . . . . 80.95 111.336 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.84 -30.95 69.6 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.02 -0.672 . . . . 71.19 111.442 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLN . . . . . . . . . . . . . 35.3 tp60 -63.71 -50.7 68.12 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.718 -0.393 . . . . 85.64 111.083 178.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -71.68 -20.13 61.98 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.326 -0.55 . . . . 113.5 112.383 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -69.11 -36.76 77.87 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.126 -0.63 . . . . 96.48 111.085 174.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 57.1 mt -80.44 -18.83 47.61 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.806 0.669 . . . . 97.25 112.806 -177.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 63.0 p -76.56 -44.94 32.61 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.301 0.501 . . . . 111.38 111.147 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.72 -17.55 64.91 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.578 0.584 . . . . 115.01 112.578 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.99 -11.19 60.83 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.789 0.663 . . . . 112.18 112.789 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 118.425 0.557 . . . . 117.33 110.935 179.177 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 121' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.744 0.307 . . . . 114.79 111.178 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 122' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -81.4 140.59 34.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.051 0.453 . . . . 94.26 110.408 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -111.17 105.93 14.78 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.205 -1.035 . . . . 100.18 108.205 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -83.92 -6.39 59.41 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 113.459 0.911 . . . . 85.94 113.459 -175.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 98.7 p -82.25 -4.43 57.12 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 118.69 0.677 . . . . 87.45 112.71 176.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -72.67 114.12 10.45 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.528 -0.545 . . . . 137.02 109.528 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 58.07 32.39 21.92 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.363 0.665 . . . . 94.93 111.931 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' CYS . . . . . . . . . . . . . 16.3 p -77.88 4.66 11.39 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 113.296 0.85 . . . . 84.44 113.296 -175.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' THR . . . . . . . . . . . . . 10.3 t -155.92 141.8 18.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 119.02 0.827 . . . . 70.78 109.564 177.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -100.26 -3.15 32.03 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.667 -0.697 . . . . 85.14 111.993 170.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -125.42 155.23 40.74 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.804 -0.813 . . . . 94.86 108.804 178.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' GLY . . . . . . . . . . . . . . . -79.92 -39.6 16.46 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.556 -0.83 . . . . 110.26 112.044 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -144.32 157.51 44.23 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.338 -0.986 . . . . 96.12 108.338 -177.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' SER . . . . . . . . . . . . . 93.2 p -62.26 -14.06 34.76 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.178 -0.609 . . . . 67.53 112.307 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -55.6 -26.15 42.31 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 117.829 0.286 . . . . 91.62 111.527 172.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -93.61 -0.14 56.31 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 113.506 0.928 . . . . 135.23 113.506 -177.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' TRP . . . . . . . . . . . . . 46.1 m0 -70.86 154.11 94.43 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 118.677 0.671 . . . . 74.59 110.446 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -59.47 -31.26 94.41 Favored 'Trans proline' 0 C--O 1.237 0.463 0 N-CA-C 114.138 0.784 . . . . 95.07 114.138 -177.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -70.02 -47.24 62.91 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.748 0.704 . . . . 78.09 111.21 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -72.87 -24.61 60.89 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.61 0.596 . . . . 76.31 112.61 -176.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -71.62 -31.13 66.55 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.799 -0.761 . . . . 174.97 111.494 174.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 83.3 p -70.65 -17.1 62.87 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 112.276 0.473 . . . . 92.5 112.276 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 81.3 mt -85.44 29.96 0.65 Allowed 'General case' 0 C--O 1.238 0.495 0 N-CA-C 112.66 0.615 . . . . 115.25 112.66 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 66.5 mtt180 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 117.933 0.333 . . . . 109.66 110.488 179.593 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.74 0.305 . . . . 130.61 110.89 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 74.6 mt-10 -127.11 70.22 1.29 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.735 -0.839 . . . . 120.56 108.735 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.8 t -142.03 124.74 15.94 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.86 -1.163 . . . . 105.88 107.86 175.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -148.58 132.21 16.83 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.253 -0.647 . . . . 71.46 109.253 -174.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 18.9 mt -130.95 126.65 60.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 108.69 -0.856 . . . . 67.9 108.69 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' A' ' 72' ' ' LEU . 97.3 mt -112.15 131.21 64.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.523 -0.917 . . . . 62.17 108.523 179.86 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mp -109.1 113.85 27.06 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.424 -0.954 . . . . 71.48 108.424 178.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.1 mt -88.91 110.98 21.55 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 107.888 -1.152 . . . . 68.14 107.888 173.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 85.2 mt -117.41 134.41 61.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 109.163 -0.68 . . . . 70.48 109.163 -171.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -133.69 109.68 9.33 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 107.074 -1.454 . . . . 81.0 107.074 171.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -66.22 -61.98 1.73 Allowed 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.894 0.378 . . . . 112.46 111.44 -171.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -102.99 -176.61 26.68 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-O 122.58 1.1 . . . . 87.4 112.785 -177.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 63.6 p -67.08 -28.47 68.21 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.449 -0.875 . . . . 87.94 111.6 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -75.62 125.39 88.6 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 109.614 -0.513 . . . . 110.24 109.614 177.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.96 -1.46 5.23 Favored 'Trans proline' 0 C--O 1.236 0.411 0 N-CA-C 114.417 0.891 . . . . 86.89 114.417 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.81 -20.39 62.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 119.324 0.965 . . . . 126.15 111.892 174.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 69.0 p -85.15 24.5 1.1 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.465 0.542 . . . . 76.33 112.465 177.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -84.24 140.72 31.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.179 0.514 . . . . 87.32 110.941 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.0 tt -156.61 150.31 10.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 106.93 -1.508 . . . . 84.54 106.93 175.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 -127.62 142.07 51.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.369 -0.378 . . . . 69.86 110.033 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 86.4 p -121.65 146.4 47.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.773 -0.648 . . . . 77.68 109.747 178.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -128.09 140.51 51.9 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.905 -0.589 . . . . 77.23 109.443 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 34.1 m-70 -139.43 160.23 40.32 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.517 0.675 . . . . 70.32 109.657 -173.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.5 p -90.21 -9.62 47.4 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.262 -0.881 . . . . 72.48 113.323 -176.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.0 p -157.44 166.31 33.36 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.606 -0.887 . . . . 66.42 108.606 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.8 tp -65.24 -33.54 76.24 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.282 -0.872 . . . . 70.15 111.483 176.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 59.6 ttm-85 -64.16 -40.32 95.88 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.462 -0.495 . . . . 117.7 111.277 178.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 40.0 t -64.99 -39.8 94.01 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.372 -0.531 . . . . 78.07 111.272 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.38 90.82 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.395 -0.522 . . . . 68.7 111.204 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.563 HD11 ' HB3' ' A' ' 92' ' ' HIS . 86.2 mt -70.48 -43.66 77.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 C-N-CA 120.41 -0.516 . . . . 73.88 110.531 178.605 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -63.86 -30.16 71.28 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.33 -0.548 . . . . 98.7 111.533 178.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -70.24 -49.99 44.35 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.538 -0.465 . . . . 81.39 111.147 177.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.2 tp -68.0 -20.12 25.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 120.575 -0.45 . . . . 78.28 111.474 -177.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 30.0 t -80.59 -38.44 17.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 120.376 -0.53 . . . . 94.26 110.406 171.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.97 -33.74 88.07 Favored Glycine 0 C--N 1.335 0.513 0 C-N-CA 120.459 -0.877 . . . . 93.67 113.45 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.1 p -71.73 -31.05 40.31 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 119.971 -0.692 . . . . 91.3 110.525 177.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -62.75 -33.03 74.3 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.853 -0.529 . . . . 117.09 111.734 177.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -103.18 57.78 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 122.341 1.067 . . . . 110.11 110.773 -177.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.5 p . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 115.057 -0.974 . . . . 108.46 110.52 175.336 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.816 0.341 . . . . 107.92 110.267 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 95.3 p -69.26 -16.96 63.7 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.538 -0.465 . . . . 108.61 111.746 172.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.527 ' HD2' ' H ' ' A' ' 58' ' ' ARG . 1.4 mpt_? -76.73 -12.08 59.94 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.598 0.592 . . . . 164.16 112.598 176.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -70.96 -34.67 71.67 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.466 -0.494 . . . . 94.96 111.561 176.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -58.96 -44.2 91.45 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.335 -0.546 . . . . 109.54 111.007 172.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -69.1 -33.12 73.01 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.608 -0.437 . . . . 122.78 111.592 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -66.53 -45.02 80.81 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.436 -0.506 . . . . 78.48 110.953 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -70.78 -32.68 69.87 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.495 -0.482 . . . . 86.9 111.746 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -74.54 -24.31 58.93 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.601 -0.44 . . . . 105.16 112.147 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -76.9 -16.47 59.38 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.688 0.625 . . . . 159.97 112.688 177.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.7 mt -64.46 119.49 8.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 108.587 -0.894 . . . . 82.56 108.587 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -62.71 -38.38 90.2 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.161 -0.472 . . . . 78.39 111.82 -170.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -155.74 131.6 9.88 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.722 -0.844 . . . . 68.2 108.722 -177.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.636 ' HB3' ' HG3' ' A' ' 86' ' ' LYS . 41.7 t -145.25 111.66 5.72 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.469 -0.937 . . . . 72.14 108.469 179.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 59.1 t -115.53 106.03 51.13 Favored Pre-proline 0 C--O 1.239 0.53 0 N-CA-C 109.445 -0.576 . . . . 59.01 109.445 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -75.05 134.37 17.65 Favored 'Trans proline' 0 C--O 1.234 0.277 0 CA-C-N 118.87 0.632 . . . . 60.47 110.775 174.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.459 ' HB2' ' HB ' ' A' ' 11' ' ' ILE . 95.7 mt -113.39 116.07 29.07 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.298 -1.001 . . . . 61.48 108.298 174.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 60.7 t -106.07 129.04 59.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.559 -0.904 . . . . 72.22 108.559 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.425 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 89.6 t80 -84.87 135.28 34.14 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.161 -0.472 . . . . 68.73 110.81 -176.461 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -106.39 127.0 52.94 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.357 -0.979 . . . . 68.98 108.357 173.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . . . -69.5 -38.77 77.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.324 -0.55 . . . . 69.79 111.635 -172.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -72.73 -60.65 2.13 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.43 -0.508 . . . . 71.44 111.245 -176.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -66.19 -14.3 61.66 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.878 0.696 . . . . 67.79 112.878 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 54.37 44.58 28.71 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.715 0.769 . . . . 93.82 111.096 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.04 163.31 33.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.093 -0.706 . . . . 54.49 109.093 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 74' ' ' TYR . 75.7 m-85 -101.05 131.91 46.73 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.541 -0.754 . . . . 60.16 109.974 -178.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 73.6 mt -95.76 120.37 63.4 Favored Pre-proline 0 C--O 1.241 0.62 0 N-CA-C 108.084 -1.08 . . . . 76.41 108.084 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.25 143.9 20.29 Favored 'Trans proline' 0 C--N 1.33 -0.405 0 CA-C-N 119.358 0.806 . . . . 61.86 111.742 178.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -129.7 155.82 45.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.467 -0.788 . . . . 63.99 109.543 178.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -75.2 164.91 25.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.778 0.799 . . . . 123.24 110.104 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.636 ' HG3' ' HB3' ' A' ' 69' ' ' CYS . 38.0 ttpt -62.31 -33.34 74.48 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.465 -0.789 . . . . 103.4 111.919 -174.454 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -65.91 -22.0 66.48 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.641 0.608 . . . . 119.92 112.641 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 89.3 t90 -63.92 -34.77 78.72 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.379 -0.529 . . . . 77.33 111.626 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 59.8 tp -79.58 -32.28 41.99 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.787 -0.365 . . . . 71.35 111.765 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.6 tt -61.48 -47.34 86.12 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.894 0.378 . . . . 77.7 110.888 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -63.62 -39.74 95.12 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.737 -0.385 . . . . 89.62 111.436 -176.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.563 ' HB3' HD11 ' A' ' 35' ' ' ILE . 8.7 m170 -69.5 -33.68 73.2 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.057 -0.657 . . . . 82.93 111.596 176.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.15 -30.42 69.54 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.164 -0.614 . . . . 76.46 111.497 175.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -67.01 -40.32 87.26 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.376 -0.53 . . . . 88.83 111.308 177.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -64.57 -36.02 82.85 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.214 -0.595 . . . . 112.42 111.123 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -64.2 -25.81 68.24 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.886 -0.326 . . . . 100.41 111.694 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 89.6 mt -90.13 -0.62 57.69 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 113.289 0.848 . . . . 89.48 113.289 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 60.4 p . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 118.619 0.645 . . . . 108.27 111.026 179.391 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.673 0.273 . . . . 118.5 110.943 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 99.7 m-85 -93.68 142.54 27.24 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.315 -0.402 . . . . 102.41 110.314 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -109.86 94.18 4.89 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 107.562 -1.273 . . . . 101.69 107.562 -178.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -77.64 6.63 6.91 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.193 0.812 . . . . 85.14 113.193 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 95.3 p -97.25 -9.14 28.24 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.918 0.711 . . . . 95.41 112.918 177.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -67.87 113.48 5.63 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.387 -0.597 . . . . 148.91 109.387 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 58.96 38.84 24.19 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.212 0.529 . . . . 92.88 111.506 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 16.4 p -83.35 6.81 18.57 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 113.234 0.827 . . . . 70.18 113.234 -175.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.8 t -156.84 134.88 11.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 118.776 0.717 . . . . 75.14 109.379 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -93.34 7.44 44.43 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.818 -0.628 . . . . 66.64 112.307 173.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -134.37 175.17 9.75 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.757 -0.831 . . . . 88.92 108.757 -178.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -104.7 -16.61 16.97 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.907 -0.588 . . . . 74.36 112.187 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -168.99 152.71 5.28 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.997 -1.112 . . . . 66.06 107.997 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.2 p -60.48 -14.94 22.27 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.571 0.582 . . . . 71.06 112.571 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.419 ' O ' ' NH2' ' A' ' 144' ' ' ARG . 71.4 t80 -55.49 -27.17 46.79 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 117.921 0.328 . . . . 96.94 111.695 173.369 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -90.77 -6.44 54.36 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.298 0.851 . . . . 98.01 113.298 -178.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -65.48 152.07 93.09 Favored Pre-proline 0 C--O 1.234 0.266 0 CA-C-N 118.363 0.529 . . . . 75.34 110.568 -177.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -58.52 -35.23 98.93 Favored 'Trans proline' 0 C--O 1.237 0.469 0 N-CA-C 114.155 0.791 . . . . 76.09 114.155 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -66.22 -45.18 81.6 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.904 -0.718 . . . . 67.14 111.281 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -76.31 -20.48 57.24 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.986 -0.686 . . . . 71.15 112.343 -177.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.55 ' HG2' HH12 ' A' ' 144' ' ' ARG . 73.5 mtp85 -76.75 -22.7 53.41 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.176 0.444 . . . . 123.34 111.93 167.613 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 47.1 t -67.33 -36.51 81.59 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.86 -0.336 . . . . 87.28 111.422 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.34 51.41 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.877 0.846 . . . . 105.59 111.632 179.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.55 HH12 ' HG2' ' A' ' 141' ' ' ARG . 34.2 mtt85 . . . . . 0 C--N 1.331 -0.212 0 CA-C-N 115.901 -0.59 . . . . 115.01 110.092 172.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 . . . . . 0 C--O 1.231 0.096 0 N-CA-C 111.992 0.367 . . . . 135.84 111.992 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 42.2 m -97.99 136.04 38.83 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.435 -0.58 . . . . 106.48 109.435 175.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' HIS . . . . . . . . . . . . . 23.2 t-80 -150.81 123.96 8.81 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.707 -0.849 . . . . 78.14 108.707 -178.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 36.7 mt -127.49 126.95 68.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.601 -0.888 . . . . 72.2 108.601 -177.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 60.1 mt -111.55 131.49 62.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 108.368 -0.975 . . . . 59.86 108.368 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 67.6 mt -107.27 113.26 26.55 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.406 -0.961 . . . . 65.15 108.406 177.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.58 ' HB2' HG23 ' B' ' 70' ' ' VAL . 79.4 mt -87.84 100.37 12.82 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 107.508 -1.293 . . . . 60.19 107.508 174.646 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 84.1 mt -106.72 135.42 45.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.358 -0.608 . . . . 77.42 109.358 -172.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -131.45 110.3 10.91 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 107.214 -1.402 . . . . 88.41 107.214 170.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -63.54 -55.97 19.71 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 123.36 0.412 . . . . 103.97 111.511 -171.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -116.43 -178.9 18.07 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-O 122.007 0.781 . . . . 77.2 112.47 -177.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 63.8 p -63.9 -25.43 68.14 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 114.396 -0.902 . . . . 79.07 112.561 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -80.42 122.94 83.13 Favored Pre-proline 0 C--O 1.237 0.428 0 N-CA-C 109.292 -0.633 . . . . 129.09 109.292 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -64.38 -2.96 5.6 Favored 'Trans proline' 0 C--O 1.236 0.417 0 N-CA-C 114.328 0.857 . . . . 75.25 114.328 -179.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp -66.95 -24.32 66.06 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 119.08 0.854 . . . . 128.52 111.292 177.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 73.3 p -84.41 17.19 2.71 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.153 0.797 . . . . 86.04 113.153 -177.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -76.51 143.91 40.11 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 118.465 0.575 . . . . 75.32 111.194 -176.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 9.9 tt -157.84 146.0 9.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 N-CA-C 107.121 -1.437 . . . . 74.97 107.121 173.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -123.02 146.42 47.66 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.225 0.535 . . . . 66.0 110.298 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 97.7 p -128.84 144.25 51.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.445 -0.798 . . . . 60.4 109.242 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -124.57 142.62 51.21 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.417 -0.586 . . . . 74.86 109.417 176.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 27.5 m-70 -140.91 157.52 45.25 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.434 0.635 . . . . 65.96 109.484 -175.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 30.5 p -89.45 -3.37 58.43 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.373 -0.83 . . . . 82.21 113.188 -176.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 59.7 p -160.95 166.45 28.32 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.777 -0.823 . . . . 69.77 108.777 179.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 56.7 tp -67.03 -39.06 86.91 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.139 -0.937 . . . . 72.6 111.132 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 44.3 ttm-85 -60.68 -40.65 92.92 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.503 -0.479 . . . . 120.98 111.212 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 45.7 t -64.01 -36.51 84.21 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.531 -0.468 . . . . 77.11 111.274 178.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.8 -40.98 83.83 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.42 -0.512 . . . . 71.19 111.229 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 70.7 mt -68.51 -44.33 83.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.592 -0.443 . . . . 82.92 110.535 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -63.77 -27.73 69.39 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.223 -0.591 . . . . 101.59 111.561 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -68.54 -52.4 32.36 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.441 -0.504 . . . . 68.85 111.16 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 10.5 tp -68.82 -31.17 49.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 C-N-CA 120.127 -0.629 . . . . 79.12 110.806 -175.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 46.8 t -68.8 -43.45 82.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 O-C-N 121.707 -0.621 . . . . 76.04 110.325 173.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.81 -27.86 70.8 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.242 -0.98 . . . . 84.37 113.024 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 44.6 t -68.07 -42.83 85.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 117.301 0.551 . . . . 77.96 110.375 175.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -63.64 -30.05 71.21 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.491 -0.484 . . . . 79.05 111.632 177.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -86.52 9.56 17.99 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.152 0.797 . . . . 120.01 113.152 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 29.3 p -77.49 -3.7 41.85 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.741 0.645 . . . . 125.2 112.741 174.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 118.314 0.506 . . . . 125.2 110.819 175.299 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.918 0.389 . . . . 127.07 110.393 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' VAL . . . . . . . . . . . . . 31.4 t 64.07 -70.56 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 124.572 1.149 . . . . 97.25 111.54 172.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 1.4 p -62.91 -38.42 90.89 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.873 -0.731 . . . . 120.27 111.102 -177.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -66.9 -28.53 68.39 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.589 -0.445 . . . . 159.3 111.341 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -69.14 -43.32 74.6 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.51 -0.476 . . . . 77.42 111.25 176.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -69.76 -25.86 64.02 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.809 -0.756 . . . . 85.25 111.402 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -60.43 -45.16 94.63 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.174 -0.611 . . . . 115.52 110.44 167.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -64.81 -40.23 94.87 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.88 -0.328 . . . . 78.3 111.447 177.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -68.42 -41.74 79.96 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.915 -0.714 . . . . 99.38 111.215 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.48 -29.96 71.0 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.319 -0.552 . . . . 90.65 111.597 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -71.61 -17.48 62.28 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.597 0.592 . . . . 153.75 112.597 -179.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 59.0 mt -61.6 123.59 14.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.662 -0.866 . . . . 78.56 108.662 176.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -64.13 -37.34 87.11 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 116.268 -0.424 . . . . 85.38 111.716 -171.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -155.27 135.06 12.76 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.998 -0.741 . . . . 65.44 108.998 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' CYS . . . . . . . . . . . . . 34.8 t -156.68 98.82 1.82 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.515 -1.291 . . . . 70.14 107.515 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.58 HG23 ' HB2' ' B' ' 13' ' ' LEU . 1.7 m -109.97 115.33 55.21 Favored Pre-proline 0 C--O 1.239 0.52 0 N-CA-C 108.242 -1.022 . . . . 80.29 108.242 -179.012 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -80.71 143.6 15.0 Favored 'Trans proline' 0 C--N 1.331 -0.354 0 C-N-CA 120.323 0.682 . . . . 61.82 111.884 177.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 25.0 mt -121.77 116.62 24.82 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.135 -1.061 . . . . 62.27 108.135 175.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.9 m -105.18 134.4 46.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 108.623 -0.881 . . . . 88.83 108.623 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -82.88 137.58 34.21 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.122 -0.49 . . . . 64.04 110.652 -177.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -105.89 125.7 51.31 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.75 -0.833 . . . . 74.12 108.75 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ARG . . . . . . . . . . . . . 64.5 mtp180 -61.47 -50.08 74.18 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.468 0.48 . . . . 141.23 111.551 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -72.44 -53.96 10.7 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.172 -0.611 . . . . 78.55 111.445 -173.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -71.49 -14.04 62.0 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.777 0.658 . . . . 66.64 112.777 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 78.8 mtm180 52.69 48.69 21.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 122.061 0.934 . . . . 80.93 111.048 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.2 165.37 31.12 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.396 -0.964 . . . . 56.5 108.396 -179.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -103.06 127.3 50.37 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.59 -0.732 . . . . 55.79 110.049 -176.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 76.6 mt -90.66 119.02 69.09 Favored Pre-proline 0 C--O 1.242 0.677 0 N-CA-C 107.96 -1.126 . . . . 75.46 107.96 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.78 143.54 18.66 Favored 'Trans proline' 0 C--N 1.332 -0.337 0 CA-C-N 119.264 0.773 . . . . 61.9 111.428 176.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -129.69 163.56 25.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.449 -0.796 . . . . 66.34 109.552 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -76.45 164.02 26.38 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.284 -0.871 . . . . 113.86 110.268 176.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -59.43 -30.34 68.42 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.175 -0.92 . . . . 83.03 111.404 175.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' GLN . . . . . 0.46 ' HA ' HD12 ' B' ' 90' ' ' LEU . 61.9 tt0 -65.27 -27.1 68.4 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 111.864 0.32 . . . . 147.22 111.864 179.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -60.95 -40.72 94.36 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.752 -0.379 . . . . 89.56 111.354 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 18.7 tp -75.58 -23.07 56.46 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 112.397 0.517 . . . . 86.23 112.397 177.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' B' ' 87' ' ' GLN . 19.7 mt -65.31 -46.02 82.03 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 117.988 0.358 . . . . 86.2 111.151 176.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -63.31 -45.03 93.22 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.88 -0.328 . . . . 122.66 111.23 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' HIS . . . . . . . . . . . . . 82.2 m-70 -67.34 -36.43 81.4 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.189 -0.604 . . . . 80.95 111.336 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.84 -30.95 69.6 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.02 -0.672 . . . . 71.19 111.442 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLN . . . . . . . . . . . . . 35.3 tp60 -63.71 -50.7 68.12 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.718 -0.393 . . . . 85.64 111.083 178.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -71.68 -20.13 61.98 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.326 -0.55 . . . . 113.5 112.383 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -69.11 -36.76 77.87 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.126 -0.63 . . . . 96.48 111.085 174.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 57.1 mt -80.44 -18.83 47.61 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.806 0.669 . . . . 97.25 112.806 -177.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 63.0 p -76.56 -44.94 32.61 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.301 0.501 . . . . 111.38 111.147 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.72 -17.55 64.91 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.578 0.584 . . . . 115.01 112.578 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.99 -11.19 60.83 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.789 0.663 . . . . 112.18 112.789 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 118.425 0.557 . . . . 117.33 110.935 179.177 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.744 0.307 . . . . 114.79 111.178 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -81.4 140.59 34.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.051 0.453 . . . . 94.26 110.408 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -111.17 105.93 14.78 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.205 -1.035 . . . . 100.18 108.205 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -83.92 -6.39 59.41 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 113.459 0.911 . . . . 85.94 113.459 -175.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 98.7 p -82.25 -4.43 57.12 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 118.69 0.677 . . . . 87.45 112.71 176.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -72.67 114.12 10.45 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.528 -0.545 . . . . 137.02 109.528 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 58.07 32.39 21.92 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.363 0.665 . . . . 94.93 111.931 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' CYS . . . . . . . . . . . . . 16.3 p -77.88 4.66 11.39 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 113.296 0.85 . . . . 84.44 113.296 -175.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' THR . . . . . . . . . . . . . 10.3 t -155.92 141.8 18.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 119.02 0.827 . . . . 70.78 109.564 177.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -100.26 -3.15 32.03 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.667 -0.697 . . . . 85.14 111.993 170.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -125.42 155.23 40.74 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.804 -0.813 . . . . 94.86 108.804 178.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' GLY . . . . . . . . . . . . . . . -79.92 -39.6 16.46 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.556 -0.83 . . . . 110.26 112.044 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -144.32 157.51 44.23 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.338 -0.986 . . . . 96.12 108.338 -177.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' SER . . . . . . . . . . . . . 93.2 p -62.26 -14.06 34.76 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.178 -0.609 . . . . 67.53 112.307 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -55.6 -26.15 42.31 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 117.829 0.286 . . . . 91.62 111.527 172.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -93.61 -0.14 56.31 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 113.506 0.928 . . . . 135.23 113.506 -177.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' TRP . . . . . . . . . . . . . 46.1 m0 -70.86 154.11 94.43 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 118.677 0.671 . . . . 74.59 110.446 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -59.47 -31.26 94.41 Favored 'Trans proline' 0 C--O 1.237 0.463 0 N-CA-C 114.138 0.784 . . . . 95.07 114.138 -177.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -70.02 -47.24 62.91 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.748 0.704 . . . . 78.09 111.21 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -72.87 -24.61 60.89 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.61 0.596 . . . . 76.31 112.61 -176.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -71.62 -31.13 66.55 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.799 -0.761 . . . . 174.97 111.494 174.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 83.3 p -70.65 -17.1 62.87 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 112.276 0.473 . . . . 92.5 112.276 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 81.3 mt -85.44 29.96 0.65 Allowed 'General case' 0 C--O 1.238 0.495 0 N-CA-C 112.66 0.615 . . . . 115.25 112.66 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 66.5 mtt180 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 117.933 0.333 . . . . 109.66 110.488 179.593 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_