data_6hsy_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 6hsy _Structure_validation_residue.Date_analyzed 2019-10-18 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 ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.161 0 N-CA-C 110.484 -0.191 . . . . 125.31 110.484 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -87.24 156.2 8.19 Favored 'Trans proline' 0 C--N 1.33 -0.4 0 C-N-CA 120.598 0.865 . . . . 97.8 112.673 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 75.6 p -91.79 158.59 39.81 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 114.461 -1.245 . . . . 87.61 110.07 175.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.27 -30.55 80.93 Favored 'Trans proline' 0 C--O 1.237 0.464 0 N-CA-C 113.19 0.419 . . . . 82.82 113.19 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.37 -42.93 92.21 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.01 0.433 . . . . 74.16 110.691 175.963 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -67.6 -41.45 84.03 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.692 -0.403 . . . . 92.04 111.129 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.9 t -58.36 -36.29 57.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 120.738 -0.385 . . . . 75.95 110.25 178.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 66.2 t -71.39 -56.68 9.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 O-C-N 121.851 -0.531 . . . . 76.05 110.18 176.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.5 tp60 -53.64 -46.67 70.62 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 122.045 -0.41 . . . . 93.56 110.975 -178.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.32 -40.75 97.88 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.165 -1.017 . . . . 79.07 112.598 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.2 m -69.49 -39.96 77.32 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.231 -0.57 . . . . 70.38 111.076 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.64 -46.94 93.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.169 0.509 . . . . 82.12 110.077 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -62.97 -47.41 83.31 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 121.885 -0.509 . . . . 83.1 111.04 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -60.32 -46.31 90.34 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.731 -0.387 . . . . 101.36 111.193 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 tp -71.11 -39.83 71.85 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.468 -0.493 . . . . 89.77 111.555 -174.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 93.3 mt -70.17 -46.98 63.52 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.35 -0.54 . . . . 104.11 111.14 -177.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.8 p -63.7 -33.08 74.84 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.109 -0.636 . . . . 94.0 111.276 178.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -69.73 -36.94 76.3 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.609 -0.436 . . . . 78.36 111.064 178.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.8 mt -73.15 -38.01 53.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 C-N-CA 120.738 -0.385 . . . . 89.53 110.48 178.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -63.77 -43.13 97.3 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 121.775 -0.578 . . . . 134.18 111.124 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.45 -35.48 77.64 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.706 -0.398 . . . . 83.6 111.472 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -111.4 23.18 14.29 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 112.446 0.535 . . . . 83.92 112.446 -176.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -57.44 -32.59 67.07 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.631 -0.428 . . . . 128.91 111.821 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.65 -45.65 61.37 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.392 -0.523 . . . . 83.2 110.912 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.54 -33.61 76.3 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.565 -0.454 . . . . 83.79 111.642 -178.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -74.26 -42.62 59.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.336 -0.546 . . . . 87.06 111.257 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.3 mtpt -58.05 -27.43 63.59 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.033 -0.667 . . . . 136.7 111.572 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.21 -37.81 21.36 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.802 -0.359 . . . . 94.26 111.598 -179.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -132.02 100.82 15.51 Favored Pre-proline 0 C--O 1.244 0.81 0 N-CA-C 108.815 -0.809 . . . . 94.24 108.815 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -65.75 -26.07 53.17 Favored 'Trans proline' 0 C--O 1.237 0.453 0 CA-C-N 118.696 0.57 . . . . 95.63 113.072 178.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -60.26 -27.99 67.69 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.436 -0.505 . . . . 114.9 111.299 177.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -71.34 -42.37 68.61 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.181 -0.608 . . . . 119.73 110.884 173.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.6 tp -58.54 -44.68 89.72 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.425 -0.51 . . . . 89.18 110.943 174.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 15.6 m-30 -61.26 -39.32 89.91 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.521 -0.471 . . . . 90.97 111.026 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.89 -47.01 82.33 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.468 -0.493 . . . . 74.45 110.881 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.6 m -61.64 -38.56 88.13 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.201 -0.6 . . . . 73.95 110.995 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 87.5 mt -60.26 -48.1 83.16 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.595 -0.442 . . . . 78.73 110.937 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -61.66 -35.56 78.29 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.325 -0.55 . . . . 65.73 111.097 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -72.05 -40.61 68.24 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.629 -0.428 . . . . 81.65 111.264 -178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 83.4 mt -83.0 -51.96 13.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 120.87 0.367 . . . . 89.14 110.929 -176.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.1 mt -81.39 -29.08 34.08 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.807 -0.558 . . . . 76.17 112.474 -173.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -46.27 -55.16 7.91 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-O 121.325 0.403 . . . . 75.32 113.5 -177.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -62.45 -21.87 73.32 Favored 'Trans proline' 0 C--O 1.238 0.486 0 N-CA-C 114.122 0.778 . . . . 78.49 114.122 -177.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.7 m -112.33 20.49 6.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 118.952 0.797 . . . . 81.54 111.557 -174.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 42.0 t -123.91 130.59 73.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.418 -0.956 . . . . 87.02 108.418 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -92.73 73.85 4.97 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 122.579 1.18 . . . . 83.93 108.812 175.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.24 -46.45 85.9 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 114.587 -1.188 . . . . 76.55 111.187 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -66.91 -38.2 85.78 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.074 -0.65 . . . . 108.39 111.178 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -66.57 -38.02 93.01 Favored Glycine 0 C--N 1.334 0.451 0 C-N-CA 120.029 -1.081 . . . . 70.6 112.316 176.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.19 -46.34 87.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 O-C-N 122.222 -0.575 . . . . 77.88 110.205 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.07 -50.38 69.28 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 121.968 -0.457 . . . . 59.73 111.004 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -64.52 -36.49 84.39 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.321 -0.552 . . . . 125.69 111.078 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.7 t -60.34 -40.26 90.06 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.448 -0.501 . . . . 93.85 111.018 177.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 74.2 t -74.94 -37.05 40.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 C-N-CA 120.812 -0.355 . . . . 66.44 110.551 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 97.4 mtp -74.95 -32.9 61.84 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 121.886 -0.509 . . . . 66.09 112.365 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.5 m 74.8 153.76 0.15 Allowed 'General case' 0 C--O 1.236 0.356 0 C-N-CA 122.979 0.511 . . . . 105.79 109.881 -171.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.16 -32.73 53.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 120.809 -0.356 . . . . 101.45 110.759 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -52.64 -40.16 62.5 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.964 -0.46 . . . . 118.57 111.425 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -100.33 -32.76 10.69 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.293 0.849 . . . . 102.23 113.293 -176.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.9 p -64.05 -33.81 76.59 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.062 -0.655 . . . . 89.69 111.599 -178.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -75.14 -8.56 56.91 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.779 0.659 . . . . 115.17 112.779 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -93.12 2.15 56.86 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.286 0.494 . . . . 75.65 112.215 169.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -116.43 147.77 41.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.257 0.551 . . . . 62.4 110.197 -175.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 99.1 p -78.87 158.59 75.06 Favored Pre-proline 0 N--CA 1.451 -0.411 0 CA-C-N 115.477 -0.783 . . . . 68.71 110.393 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.77 -37.29 98.26 Favored 'Trans proline' 0 C--O 1.238 0.482 0 C-N-CA 118.902 -0.265 . . . . 78.56 112.581 173.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -62.22 -33.84 75.33 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.518 -0.473 . . . . 65.69 111.296 175.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -72.84 -45.87 56.02 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.788 0.327 . . . . 74.15 111.036 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 77.3 mt -57.66 -37.63 60.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.014 0.435 . . . . 65.69 110.136 176.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.1 tptt -61.24 -49.21 78.04 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.972 -0.455 . . . . 111.33 110.853 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 26.7 mtm105 -60.27 -30.37 69.4 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.045 -0.662 . . . . 68.36 111.484 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -71.4 -37.69 71.53 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.044 -0.662 . . . . 62.12 110.909 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -55.74 -46.25 77.84 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.429 -0.508 . . . . 77.56 110.807 173.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -66.49 -49.33 66.95 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.684 -0.406 . . . . 56.33 111.282 -172.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 88.9 t -54.71 -37.09 38.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.161 -0.616 . . . . 63.61 109.872 175.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -51.39 45.09 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.069 -0.395 . . . . 68.44 110.9 178.612 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -60.42 -56.88 16.11 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.096 0.474 . . . . 113.76 111.095 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -59.98 -40.37 88.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.731 -0.388 . . . . 78.39 111.459 -173.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.0 p -70.14 -35.9 74.39 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.181 -0.608 . . . . 85.96 111.068 -179.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 29.5 mt -62.07 -41.77 98.51 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.194 -0.602 . . . . 62.88 111.157 176.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.6 mtm -72.92 -36.46 67.24 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.349 -0.54 . . . . 75.54 111.368 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -65.64 -42.18 91.75 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.576 -0.45 . . . . 80.11 111.462 -177.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -99.95 -12.86 19.42 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.886 1.069 . . . . 81.15 113.886 -174.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -135.19 10.21 3.52 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.997 0.74 . . . . 88.55 112.997 -177.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -74.46 -43.21 31.29 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.06 -1.067 . . . . 86.72 112.632 178.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -59.18 -22.41 60.94 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.195 -0.591 . . . . 135.94 112.466 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.86 -29.64 68.43 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.421 -0.511 . . . . 90.43 111.702 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.2 mt -73.38 -17.89 61.23 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.476 0.547 . . . . 107.29 112.476 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 61.6 mt -89.42 -43.9 10.55 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.485 0.55 . . . . 107.22 112.485 177.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -63.28 -35.31 79.92 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.722 -0.391 . . . . 127.81 111.667 -171.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -133.93 59.73 1.73 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 122.109 0.957 . . . . 162.87 110.015 -176.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -92.17 0.02 57.44 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 114.392 -1.276 . . . . 127.51 112.773 166.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 55.6 m-20 -77.06 -4.76 45.91 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.551 0.74 . . . . 137.1 112.808 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -83.07 170.95 14.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 122.116 0.96 . . . . 136.8 110.812 -172.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -105.04 148.97 26.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.013 -0.994 . . . . 113.1 110.536 -177.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 81.2 mt -135.33 142.98 38.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 108.205 -1.035 . . . . 94.16 108.205 177.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 74.2 mtp180 -133.29 114.74 14.11 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.206 -0.664 . . . . 130.71 109.206 -177.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 95.3 t -81.43 113.81 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 107.748 -1.204 . . . . 75.18 107.748 176.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.2 mp -75.09 161.35 77.69 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.923 0.392 . . . . 89.54 110.984 -175.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -59.44 158.33 27.64 Favored 'Trans proline' 0 C--O 1.233 0.273 0 CA-C-O 122.211 0.838 . . . . 64.3 112.507 -172.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -160.29 145.23 14.71 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.712 -1.131 . . . . 79.57 108.835 178.153 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 50.6 m -104.68 9.85 34.99 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.502 -0.772 . . . . 79.99 112.588 -178.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.04 137.27 57.6 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.228 0.537 . . . . 92.86 110.742 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -95.67 162.92 22.68 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.831 -0.622 . . . . 145.68 110.529 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -63.54 -33.28 68.55 Favored 'Trans proline' 0 C--O 1.237 0.428 0 CA-C-N 118.062 0.344 . . . . 107.59 112.982 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 48.1 p -77.29 -6.96 55.13 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.142 0.793 . . . . 108.84 113.142 -178.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -59.86 155.89 15.41 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.93 0.871 . . . . 111.46 110.501 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -96.29 -15.65 21.81 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.203 -0.908 . . . . 99.76 113.22 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -164.18 149.53 10.49 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.163 -1.051 . . . . 122.84 108.163 -176.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -165.55 158.41 15.66 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.244 -0.65 . . . . 87.29 109.244 -178.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 45.5 m -122.6 124.89 44.53 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.227 -0.897 . . . . 85.11 108.718 176.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.5 t -112.29 120.67 63.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 107.959 -1.126 . . . . 75.24 107.959 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -103.04 152.56 21.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.236 0.541 . . . . 81.57 110.269 -177.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -151.65 169.91 20.99 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.96 -0.755 . . . . 132.36 108.96 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -127.22 143.32 51.27 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.254 -0.885 . . . . 99.33 109.211 178.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 70.5 mt -118.38 109.0 25.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 107.44 -1.318 . . . . 108.98 107.44 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -86.34 113.37 22.26 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.07 -1.085 . . . . 166.41 108.07 175.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -136.18 143.88 44.66 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.954 -0.387 . . . . 141.76 109.954 -174.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 89.4 p 54.89 81.55 0.11 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.785 -0.643 . . . . 161.43 111.565 176.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 80.5 mttt 62.33 10.9 4.16 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 124.226 1.011 . . . . 160.45 113.129 177.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 109.39 29.09 4.08 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 115.041 0.777 . . . . 150.8 115.041 173.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 10.3 m -81.18 115.89 20.82 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.812 -0.81 . . . . 152.04 108.812 175.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.4 t -104.6 126.66 59.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.128 -0.693 . . . . 120.57 109.128 -170.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -130.3 127.6 22.54 Favored Pre-proline 0 C--O 1.24 0.563 0 N-CA-C 108.554 -0.906 . . . . 130.6 108.554 172.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.7 142.24 35.48 Favored 'Trans proline' 0 C--N 1.333 -0.287 0 CA-C-N 119.619 0.9 . . . . 93.06 111.875 177.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 58.1 t -130.79 129.91 64.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 107.615 -1.254 . . . . 74.27 107.615 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 29.9 t -124.23 146.53 48.67 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.182 0.515 . . . . 81.78 110.019 -176.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -123.35 121.88 36.92 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.642 -0.873 . . . . 78.57 108.642 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 28.0 m -88.3 111.73 22.04 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.122 -1.066 . . . . 73.89 108.122 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' MET . . . . . . . . . . . . . 15.6 mmt -100.36 148.44 24.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.562 0.696 . . . . 91.21 110.916 -175.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 3.7 t -135.91 130.61 34.04 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.07 -0.968 . . . . 89.42 108.406 177.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -84.2 111.65 19.56 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.868 -0.79 . . . . 103.08 108.868 -177.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 46.8 mt -110.73 -178.7 3.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.678 0.751 . . . . 104.94 109.601 179.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ALA . . . . . . . . . . . . . . . -55.99 -40.65 73.65 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.535 -0.757 . . . . 108.72 111.065 177.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . -82.66 13.97 38.95 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 115.142 0.817 . . . . 100.93 115.142 177.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 102.84 -163.34 16.17 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-O 122.492 1.051 . . . . 112.9 112.622 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -79.25 136.73 37.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.63 -0.785 . . . . 95.28 110.326 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -138.25 154.93 49.05 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.428 0.632 . . . . 89.21 109.542 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 88.9 t -72.52 132.67 33.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 115.304 -0.862 . . . . 80.22 109.243 175.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 65.3 ttt-85 -117.32 -18.72 9.83 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.338 0.866 . . . . 131.31 113.338 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -163.79 153.76 15.0 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.323 -0.992 . . . . 72.76 108.323 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 83.8 t -131.08 128.45 62.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 108.548 -0.908 . . . . 76.37 108.548 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 77.0 mt -115.35 128.0 72.72 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 107.818 -1.178 . . . . 76.23 107.818 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 60.1 mt -124.3 114.97 43.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 108.276 -1.009 . . . . 79.17 108.276 -174.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 49.4 t30 50.57 41.99 26.21 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.568 0.699 . . . . 117.1 110.994 175.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 89.54 -12.76 65.91 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-O 119.038 -0.868 . . . . 94.21 115.258 178.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 78.8 mt -91.65 111.05 23.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 118.572 1.186 . . . . 96.29 108.219 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ASN . . . . . . . . . . . . . 41.0 t-20 -70.43 100.75 1.82 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.241 -1.022 . . . . 60.96 108.241 175.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 34.4 mm -65.03 -36.44 77.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 120.488 -0.485 . . . . 66.7 110.472 -175.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . -59.29 -48.29 86.67 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.036 -1.078 . . . . 63.38 112.305 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -66.91 -32.3 73.46 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.152 -0.617 . . . . 82.12 111.491 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 10.4 tt -58.89 -52.94 63.58 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.308 -0.557 . . . . 77.18 110.574 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -66.81 -30.05 70.15 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.164 -0.614 . . . . 70.46 111.507 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -61.89 -40.44 95.43 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.304 -0.558 . . . . 122.89 110.817 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -74.02 -43.38 58.14 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.673 -0.411 . . . . 59.16 111.231 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -60.69 -37.98 83.46 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.272 -0.571 . . . . 80.01 111.009 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -65.89 -40.58 91.69 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.377 -0.529 . . . . 67.82 110.981 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -67.24 -43.94 80.68 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.488 -0.485 . . . . 65.38 111.255 178.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -61.32 -44.47 97.14 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.451 -0.5 . . . . 59.53 111.119 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 44.3 p -68.39 -34.68 76.47 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.229 -0.589 . . . . 75.09 111.6 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 58.8 mmm -65.5 -39.88 92.38 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.284 -0.566 . . . . 64.15 111.241 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 50.3 tp60 -64.77 -38.16 90.06 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.072 -0.651 . . . . 87.57 110.894 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -70.05 -35.07 74.0 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.422 -0.511 . . . . 119.59 111.267 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -87.16 12.89 10.55 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.682 0.623 . . . . 74.3 112.682 178.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' ARG . . . . . 0.662 ' NH2' ' O3 ' ' A' 1005 ' ' SO4 . 17.7 mmm180 53.97 45.44 27.65 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.908 0.861 . . . . 95.62 110.709 -178.136 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 60.68 29.93 19.36 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.41 -0.813 . . . . 66.66 111.968 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -84.16 106.93 16.18 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.277 -1.009 . . . . 56.93 108.277 174.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 66.8 mt -65.22 -42.88 93.02 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.393 -0.523 . . . . 73.12 111.264 -178.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -57.78 -48.09 80.67 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.64 -0.424 . . . . 70.17 110.982 -179.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -60.55 -39.14 86.86 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.347 -0.541 . . . . 124.84 111.097 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' THR . . . . . . . . . . . . . 59.6 m -68.0 -40.41 83.03 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.744 -0.382 . . . . 58.31 111.217 -179.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.87 -40.82 81.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 120.556 -0.457 . . . . 57.21 110.529 -179.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.62 -15.82 63.85 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 121.792 -0.568 . . . . 66.68 112.394 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' GLY . . . . . . . . . . . . . . . -111.26 -2.32 27.95 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 118.224 0.466 . . . . 59.34 113.111 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -64.05 -26.71 68.68 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.382 -0.527 . . . . 71.98 111.684 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.32 -34.89 76.2 Favored Glycine 0 C--N 1.334 0.432 0 C-N-CA 120.002 -1.095 . . . . 66.42 112.514 175.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 49.5 tp10 -72.68 -32.31 65.7 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.279 -0.542 . . . . 102.37 111.546 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 76.8 t -64.98 -46.05 92.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 C-N-CA 120.464 -0.495 . . . . 73.92 110.149 175.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' VAL . . . . . . . . . . . . . 67.0 t -62.63 -42.25 95.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 O-C-N 122.066 -0.396 . . . . 64.5 110.376 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.24 77.11 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.428 -0.509 . . . . 61.06 111.35 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -93.67 0.89 56.68 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.003 0.742 . . . . 127.56 113.003 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ALA . . . . . . . . . . . . . . . -59.09 -31.14 68.63 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 118.409 0.55 . . . . 73.46 111.879 -175.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -68.4 -54.2 18.77 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.627 -0.429 . . . . 114.5 110.981 -176.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -63.52 -34.88 78.77 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.254 -0.578 . . . . 124.41 111.249 176.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 78.5 m -56.15 -36.22 68.05 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.569 -0.452 . . . . 80.7 110.868 173.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -76.29 -39.85 53.18 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 122.241 -0.287 . . . . 88.57 111.486 178.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' LYS . . . . . 0.472 ' HZ1' H271 ' A' 1002 ' ' H3T . 35.1 mmtp -61.33 -50.05 74.5 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.72 -0.392 . . . . 134.07 110.96 178.784 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.21 -43.69 83.01 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.387 -0.525 . . . . 98.13 111.0 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -68.75 -12.32 61.32 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.595 0.591 . . . . 111.07 112.595 177.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -92.85 -27.8 16.91 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.525 0.565 . . . . 114.37 112.525 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.835 0.35 . . . . 113.55 110.793 -179.299 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1001 ' ' GOT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1002 ' ' H3T . . . . . 0.472 H271 ' HZ1' ' A' ' 208' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1003 ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1004 ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1005 ' ' SO4 . . . . . 0.662 ' O3 ' ' NH2' ' A' ' 186' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1006 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1007 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.161 0 N-CA-C 110.484 -0.191 . . . . 107.54 110.484 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -87.24 156.2 8.19 Favored 'Trans proline' 0 C--N 1.33 -0.4 0 C-N-CA 120.598 0.865 . . . . 95.81 112.673 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 75.6 p -91.79 158.59 39.81 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 114.461 -1.245 . . . . 72.97 110.07 175.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.27 -30.55 80.93 Favored 'Trans proline' 0 C--O 1.237 0.464 0 N-CA-C 113.19 0.419 . . . . 68.98 113.19 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.37 -42.93 92.21 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.01 0.433 . . . . 64.25 110.691 175.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -67.6 -41.45 84.03 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.692 -0.403 . . . . 76.67 111.129 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.9 t -58.36 -36.29 57.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 120.738 -0.385 . . . . 67.81 110.25 178.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 66.2 t -71.39 -56.68 9.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 O-C-N 121.851 -0.531 . . . . 63.34 110.18 176.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.5 tp60 -53.64 -46.67 70.62 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 122.045 -0.41 . . . . 77.93 110.975 -178.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.32 -40.75 97.88 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.165 -1.017 . . . . 68.31 112.598 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.2 m -69.49 -39.96 77.32 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.231 -0.57 . . . . 63.38 111.076 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.64 -46.94 93.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.169 0.509 . . . . 68.4 110.077 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -62.97 -47.41 83.31 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 121.885 -0.509 . . . . 81.63 111.04 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -60.32 -46.31 90.34 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.731 -0.387 . . . . 93.23 111.193 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 tp -71.11 -39.83 71.85 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.468 -0.493 . . . . 74.78 111.555 -174.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 93.3 mt -70.17 -46.98 63.52 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.35 -0.54 . . . . 86.73 111.14 -177.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.8 p -63.7 -33.08 74.84 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.109 -0.636 . . . . 78.3 111.276 178.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -69.73 -36.94 76.3 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.609 -0.436 . . . . 65.26 111.064 178.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.8 mt -73.15 -38.01 53.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 C-N-CA 120.738 -0.385 . . . . 74.57 110.48 178.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -63.77 -43.13 97.3 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 121.775 -0.578 . . . . 111.78 111.124 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.45 -35.48 77.64 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.706 -0.398 . . . . 74.63 111.472 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -111.4 23.18 14.29 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 112.446 0.535 . . . . 83.92 112.446 -176.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -57.44 -32.59 67.07 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.631 -0.428 . . . . 107.39 111.821 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.65 -45.65 61.37 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.392 -0.523 . . . . 70.36 110.912 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.54 -33.61 76.3 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.565 -0.454 . . . . 69.79 111.642 -178.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -74.26 -42.62 59.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.336 -0.546 . . . . 72.52 111.257 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.3 mtpt -58.05 -27.43 63.59 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.033 -0.667 . . . . 113.88 111.572 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.21 -37.81 21.36 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.802 -0.359 . . . . 89.11 111.598 -179.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -132.02 100.82 15.51 Favored Pre-proline 0 C--O 1.244 0.81 0 N-CA-C 108.815 -0.809 . . . . 88.48 108.815 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -65.75 -26.07 53.17 Favored 'Trans proline' 0 C--O 1.237 0.453 0 CA-C-N 118.696 0.57 . . . . 79.66 113.072 178.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -60.26 -27.99 67.69 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.436 -0.505 . . . . 95.71 111.299 177.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -71.34 -42.37 68.61 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.181 -0.608 . . . . 99.74 110.884 173.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.6 tp -58.54 -44.68 89.72 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.425 -0.51 . . . . 74.28 110.943 174.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 15.6 m-30 -61.26 -39.32 89.91 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.521 -0.471 . . . . 75.78 111.026 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.89 -47.01 82.33 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.468 -0.493 . . . . 62.01 110.881 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.6 m -61.64 -38.56 88.13 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.201 -0.6 . . . . 61.59 110.995 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 87.5 mt -60.26 -48.1 83.16 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.595 -0.442 . . . . 65.57 110.937 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -61.66 -35.56 78.29 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.325 -0.55 . . . . 65.73 111.097 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -72.05 -40.61 68.24 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.629 -0.428 . . . . 68.01 111.264 -178.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 83.4 mt -83.0 -51.96 13.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 120.87 0.367 . . . . 74.25 110.929 -176.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.1 mt -81.39 -29.08 34.08 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.807 -0.558 . . . . 63.44 112.474 -173.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -46.27 -55.16 7.91 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-O 121.325 0.403 . . . . 62.73 113.5 -177.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -62.45 -21.87 73.32 Favored 'Trans proline' 0 C--O 1.238 0.486 0 N-CA-C 114.122 0.778 . . . . 65.82 114.122 -177.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.7 m -112.33 20.49 6.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 118.952 0.797 . . . . 81.54 111.557 -174.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 42.0 t -123.91 130.59 73.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.418 -0.956 . . . . 72.48 108.418 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -92.73 73.85 4.97 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 122.579 1.18 . . . . 73.55 108.812 175.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.24 -46.45 85.9 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 114.587 -1.188 . . . . 63.76 111.187 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -66.91 -38.2 85.78 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.074 -0.65 . . . . 108.39 111.178 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -66.57 -38.02 93.01 Favored Glycine 0 C--N 1.334 0.451 0 C-N-CA 120.029 -1.081 . . . . 63.43 112.316 176.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.19 -46.34 87.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 O-C-N 122.222 -0.575 . . . . 64.86 110.205 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.07 -50.38 69.28 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 121.968 -0.457 . . . . 52.86 111.004 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -64.52 -36.49 84.39 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.321 -0.552 . . . . 104.7 111.078 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.7 t -60.34 -40.26 90.06 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.448 -0.501 . . . . 78.18 111.018 177.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 74.2 t -74.94 -37.05 40.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 C-N-CA 120.812 -0.355 . . . . 55.33 110.551 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 97.4 mtp -74.95 -32.9 61.84 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 121.886 -0.509 . . . . 58.51 112.365 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.5 m 74.8 153.76 0.15 Allowed 'General case' 0 C--O 1.236 0.356 0 C-N-CA 122.979 0.511 . . . . 88.13 109.881 -171.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.16 -32.73 53.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 120.809 -0.356 . . . . 84.51 110.759 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -52.64 -40.16 62.5 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.964 -0.46 . . . . 98.77 111.425 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -100.33 -32.76 10.69 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.293 0.849 . . . . 85.15 113.293 -176.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.9 p -64.05 -33.81 76.59 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.062 -0.655 . . . . 74.71 111.599 -178.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -75.14 -8.56 56.91 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.779 0.659 . . . . 96.47 112.779 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -93.12 2.15 56.86 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.286 0.494 . . . . 63.01 112.215 169.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -116.43 147.77 41.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.257 0.551 . . . . 51.97 110.197 -175.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 99.1 p -78.87 158.59 75.06 Favored Pre-proline 0 N--CA 1.451 -0.411 0 CA-C-N 115.477 -0.783 . . . . 57.22 110.393 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.77 -37.29 98.26 Favored 'Trans proline' 0 C--O 1.238 0.482 0 C-N-CA 118.902 -0.265 . . . . 65.43 112.581 173.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -62.22 -33.84 75.33 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.518 -0.473 . . . . 64.2 111.296 175.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -72.84 -45.87 56.02 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.788 0.327 . . . . 61.76 111.036 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 77.3 mt -57.66 -37.63 60.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.014 0.435 . . . . 56.52 110.136 176.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.1 tptt -61.24 -49.21 78.04 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.972 -0.455 . . . . 92.74 110.853 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 26.7 mtm105 -60.27 -30.37 69.4 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.045 -0.662 . . . . 56.94 111.484 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -71.4 -37.69 71.53 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.044 -0.662 . . . . 51.73 110.909 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -55.74 -46.25 77.84 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.429 -0.508 . . . . 77.56 110.807 173.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -66.49 -49.33 66.95 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.684 -0.406 . . . . 56.33 111.282 -172.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 88.9 t -54.71 -37.09 38.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.161 -0.616 . . . . 52.97 109.872 175.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -51.39 45.09 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.069 -0.395 . . . . 57.0 110.9 178.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -60.42 -56.88 16.11 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.096 0.474 . . . . 94.76 111.095 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -59.98 -40.37 88.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.731 -0.388 . . . . 78.39 111.459 -173.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.0 p -70.14 -35.9 74.39 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.181 -0.608 . . . . 71.6 111.068 -179.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 29.5 mt -62.07 -41.77 98.51 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.194 -0.602 . . . . 56.38 111.157 176.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.6 mtm -72.92 -36.46 67.24 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.349 -0.54 . . . . 68.07 111.368 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -65.64 -42.18 91.75 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.576 -0.45 . . . . 74.98 111.462 -177.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -99.95 -12.86 19.42 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.886 1.069 . . . . 67.59 113.886 -174.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -135.19 10.21 3.52 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.997 0.74 . . . . 78.87 112.997 -177.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -74.46 -43.21 31.29 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.06 -1.067 . . . . 72.36 112.632 178.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -59.18 -22.41 60.94 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.195 -0.591 . . . . 113.24 112.466 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.86 -29.64 68.43 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.421 -0.511 . . . . 75.58 111.702 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.2 mt -73.38 -17.89 61.23 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.476 0.547 . . . . 89.37 112.476 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 61.6 mt -89.42 -43.9 10.55 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.485 0.55 . . . . 92.42 112.485 177.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -63.28 -35.31 79.92 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.722 -0.391 . . . . 118.43 111.667 -171.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -133.93 59.73 1.73 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 122.109 0.957 . . . . 135.74 110.015 -176.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -92.17 0.02 57.44 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 114.392 -1.276 . . . . 106.22 112.773 166.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 55.6 m-20 -77.06 -4.76 45.91 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.551 0.74 . . . . 114.98 112.808 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -83.07 170.95 14.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 122.116 0.96 . . . . 120.05 110.812 -172.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -105.04 148.97 26.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.013 -0.994 . . . . 107.14 110.536 -177.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 81.2 mt -135.33 142.98 38.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 108.205 -1.035 . . . . 94.16 108.205 177.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 74.2 mtp180 -133.29 114.74 14.11 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.206 -0.664 . . . . 108.89 109.206 -177.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 95.3 t -81.43 113.81 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 107.748 -1.204 . . . . 62.62 107.748 176.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.2 mp -75.09 161.35 77.69 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.923 0.392 . . . . 74.58 110.984 -175.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -59.44 158.33 27.64 Favored 'Trans proline' 0 C--O 1.233 0.273 0 CA-C-O 122.211 0.838 . . . . 64.3 112.507 -172.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -160.29 145.23 14.71 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.712 -1.131 . . . . 79.57 108.835 178.153 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 50.6 m -104.68 9.85 34.99 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.502 -0.772 . . . . 66.62 112.588 -178.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.04 137.27 57.6 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.228 0.537 . . . . 77.34 110.742 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -95.67 162.92 22.68 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.831 -0.622 . . . . 121.36 110.529 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -63.54 -33.28 68.55 Favored 'Trans proline' 0 C--O 1.237 0.428 0 CA-C-N 118.062 0.344 . . . . 89.62 112.982 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 48.1 p -77.29 -6.96 55.13 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.142 0.793 . . . . 90.67 113.142 -178.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -59.86 155.89 15.41 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.93 0.871 . . . . 92.85 110.501 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -96.29 -15.65 21.81 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.203 -0.908 . . . . 96.69 113.22 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -164.18 149.53 10.49 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.163 -1.051 . . . . 102.33 108.163 -176.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -165.55 158.41 15.66 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.244 -0.65 . . . . 72.71 109.244 -178.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 45.5 m -122.6 124.89 44.53 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.227 -0.897 . . . . 85.11 108.718 176.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.5 t -112.29 120.67 63.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 107.959 -1.126 . . . . 62.66 107.959 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -103.04 152.56 21.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.236 0.541 . . . . 67.94 110.269 -177.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -151.65 169.91 20.99 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.96 -0.755 . . . . 132.36 108.96 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -127.22 143.32 51.27 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.254 -0.885 . . . . 96.27 109.211 178.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 70.5 mt -118.38 109.0 25.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 107.44 -1.318 . . . . 90.78 107.44 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -86.34 113.37 22.26 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.07 -1.085 . . . . 138.82 108.07 175.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -136.18 143.88 44.66 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.954 -0.387 . . . . 131.87 109.954 -174.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 89.4 p 54.89 81.55 0.11 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.785 -0.643 . . . . 134.49 111.565 176.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 80.5 mttt 62.33 10.9 4.16 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 124.226 1.011 . . . . 133.67 113.129 177.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 109.39 29.09 4.08 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 115.041 0.777 . . . . 125.63 115.041 173.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 10.3 m -81.18 115.89 20.82 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.812 -0.81 . . . . 126.67 108.812 175.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.4 t -104.6 126.66 59.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.128 -0.693 . . . . 100.44 109.128 -170.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -130.3 127.6 22.54 Favored Pre-proline 0 C--O 1.24 0.563 0 N-CA-C 108.554 -0.906 . . . . 108.8 108.554 172.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.7 142.24 35.48 Favored 'Trans proline' 0 C--N 1.333 -0.287 0 CA-C-N 119.619 0.9 . . . . 77.51 111.875 177.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 58.1 t -130.79 129.91 64.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 107.615 -1.254 . . . . 61.85 107.615 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 29.9 t -124.23 146.53 48.67 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.182 0.515 . . . . 68.11 110.019 -176.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -123.35 121.88 36.92 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.642 -0.873 . . . . 65.44 108.642 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 28.0 m -88.3 111.73 22.04 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.122 -1.066 . . . . 61.54 108.122 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' MET . . . . . . . . . . . . . 15.6 mmt -100.36 148.44 24.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.562 0.696 . . . . 75.98 110.916 -175.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 3.7 t -135.91 130.61 34.04 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.07 -0.968 . . . . 74.48 108.406 177.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -84.2 111.65 19.56 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.868 -0.79 . . . . 86.75 108.868 -177.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 46.8 mt -110.73 -178.7 3.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.678 0.751 . . . . 87.41 109.601 179.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ALA . . . . . . . . . . . . . . . -55.99 -40.65 73.65 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.535 -0.757 . . . . 108.72 111.065 177.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . -82.66 13.97 38.95 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 115.142 0.817 . . . . 86.82 115.142 177.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 102.84 -163.34 16.17 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-O 122.492 1.051 . . . . 94.05 112.622 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -79.25 136.73 37.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.63 -0.785 . . . . 81.33 110.326 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -138.25 154.93 49.05 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.428 0.632 . . . . 74.31 109.542 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 88.9 t -72.52 132.67 33.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 115.304 -0.862 . . . . 66.82 109.243 175.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 65.3 ttt-85 -117.32 -18.72 9.83 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.338 0.866 . . . . 109.39 113.338 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -163.79 153.76 15.0 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.323 -0.992 . . . . 60.6 108.323 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 83.8 t -131.08 128.45 62.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 108.548 -0.908 . . . . 63.6 108.548 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 77.0 mt -115.35 128.0 72.72 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 107.818 -1.178 . . . . 71.32 107.818 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 60.1 mt -124.3 114.97 43.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 108.276 -1.009 . . . . 70.91 108.276 -174.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 49.4 t30 50.57 41.99 26.21 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.568 0.699 . . . . 97.55 110.994 175.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 89.54 -12.76 65.91 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-O 119.038 -0.868 . . . . 78.47 115.258 178.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 78.8 mt -91.65 111.05 23.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 118.572 1.186 . . . . 80.21 108.219 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ASN . . . . . . . . . . . . . 41.0 t-20 -70.43 100.75 1.82 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.241 -1.022 . . . . 60.96 108.241 175.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 34.4 mm -65.03 -36.44 77.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 120.488 -0.485 . . . . 55.55 110.472 -175.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . -59.29 -48.29 86.67 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.036 -1.078 . . . . 59.32 112.305 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -66.91 -32.3 73.46 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.152 -0.617 . . . . 78.82 111.491 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 10.4 tt -58.89 -52.94 63.58 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.308 -0.557 . . . . 64.28 110.574 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -66.81 -30.05 70.15 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.164 -0.614 . . . . 58.68 111.507 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -61.89 -40.44 95.43 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.304 -0.558 . . . . 102.37 110.817 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -74.02 -43.38 58.14 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.673 -0.411 . . . . 58.97 111.231 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -60.69 -37.98 83.46 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.272 -0.571 . . . . 80.01 111.009 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -65.89 -40.58 91.69 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.377 -0.529 . . . . 56.48 110.981 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -67.24 -43.94 80.68 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.488 -0.485 . . . . 57.37 111.255 178.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -61.32 -44.47 97.14 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.451 -0.5 . . . . 55.8 111.119 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 44.3 p -68.39 -34.68 76.47 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.229 -0.589 . . . . 62.54 111.6 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 58.8 mmm -65.5 -39.88 92.38 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.284 -0.566 . . . . 55.05 111.241 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 50.3 tp60 -64.77 -38.16 90.06 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.072 -0.651 . . . . 72.94 110.894 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -70.05 -35.07 74.0 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.422 -0.511 . . . . 99.62 111.267 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -87.16 12.89 10.55 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.682 0.623 . . . . 61.88 112.682 178.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' ARG . . . . . 0.662 ' NH2' ' O3 ' ' A' 1005 ' ' SO4 . 17.7 mmm180 53.97 45.44 27.65 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.908 0.861 . . . . 79.65 110.709 -178.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 60.68 29.93 19.36 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.41 -0.813 . . . . 55.65 111.968 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -84.16 106.93 16.18 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.277 -1.009 . . . . 54.38 108.277 174.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 66.8 mt -65.22 -42.88 93.02 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.393 -0.523 . . . . 60.9 111.264 -178.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 190' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -57.78 -48.09 80.67 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.64 -0.424 . . . . 61.39 110.982 -179.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -60.55 -39.14 86.86 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.347 -0.541 . . . . 104.0 111.097 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 192' ' ' THR . . . . . . . . . . . . . 59.6 m -68.0 -40.41 83.03 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.744 -0.382 . . . . 56.21 111.217 -179.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 193' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.87 -40.82 81.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 120.556 -0.457 . . . . 55.78 110.529 -179.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.62 -15.82 63.85 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 121.792 -0.568 . . . . 55.6 112.394 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 195' ' ' GLY . . . . . . . . . . . . . . . -111.26 -2.32 27.95 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 118.224 0.466 . . . . 49.59 113.111 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -64.05 -26.71 68.68 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.382 -0.527 . . . . 59.95 111.684 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.32 -34.89 76.2 Favored Glycine 0 C--N 1.334 0.432 0 C-N-CA 120.002 -1.095 . . . . 55.77 112.514 175.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 49.5 tp10 -72.68 -32.31 65.7 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.279 -0.542 . . . . 102.37 111.546 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 76.8 t -64.98 -46.05 92.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 C-N-CA 120.464 -0.495 . . . . 61.57 110.149 175.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' VAL . . . . . . . . . . . . . 67.0 t -62.63 -42.25 95.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 O-C-N 122.066 -0.396 . . . . 57.89 110.376 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.24 77.11 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.428 -0.509 . . . . 61.06 111.35 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -93.67 0.89 56.68 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.003 0.742 . . . . 106.26 113.003 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ALA . . . . . . . . . . . . . . . -59.09 -31.14 68.63 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 118.409 0.55 . . . . 62.92 111.879 -175.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -68.4 -54.2 18.77 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.627 -0.429 . . . . 95.38 110.981 -176.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -63.52 -34.88 78.77 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.254 -0.578 . . . . 124.41 111.249 176.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 78.5 m -56.15 -36.22 68.05 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.569 -0.452 . . . . 68.54 110.868 173.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -76.29 -39.85 53.18 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 122.241 -0.287 . . . . 73.77 111.486 178.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -61.33 -50.05 74.5 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.72 -0.392 . . . . 111.69 110.96 178.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.21 -43.69 83.01 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.387 -0.525 . . . . 81.74 111.0 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -68.75 -12.32 61.32 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.595 0.591 . . . . 111.07 112.595 177.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 211' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -92.85 -27.8 16.91 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.525 0.565 . . . . 109.28 112.525 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.835 0.35 . . . . 103.98 110.793 -179.299 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1001 ' ' GOT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1002 ' ' H3T . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1003 ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1004 ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1005 ' ' SO4 . . . . . 0.662 ' O3 ' ' NH2' ' A' ' 186' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1006 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1007 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.161 0 N-CA-C 110.484 -0.191 . . . . 107.54 110.484 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -87.24 156.2 8.19 Favored 'Trans proline' 0 C--N 1.33 -0.4 0 C-N-CA 120.598 0.865 . . . . 95.81 112.673 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 75.6 p -91.79 158.59 39.81 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 114.461 -1.245 . . . . 72.97 110.07 175.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.27 -30.55 80.93 Favored 'Trans proline' 0 C--O 1.237 0.464 0 N-CA-C 113.19 0.419 . . . . 68.98 113.19 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.37 -42.93 92.21 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.01 0.433 . . . . 64.25 110.691 175.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -67.6 -41.45 84.03 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.692 -0.403 . . . . 76.67 111.129 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.9 t -58.36 -36.29 57.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 120.738 -0.385 . . . . 67.81 110.25 178.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 66.2 t -71.39 -56.68 9.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 O-C-N 121.851 -0.531 . . . . 63.34 110.18 176.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.5 tp60 -53.64 -46.67 70.62 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 122.045 -0.41 . . . . 77.93 110.975 -178.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.32 -40.75 97.88 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.165 -1.017 . . . . 68.31 112.598 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.2 m -69.49 -39.96 77.32 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.231 -0.57 . . . . 63.38 111.076 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.64 -46.94 93.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.169 0.509 . . . . 68.4 110.077 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -62.97 -47.41 83.31 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 121.885 -0.509 . . . . 81.63 111.04 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -60.32 -46.31 90.34 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.731 -0.387 . . . . 93.23 111.193 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 tp -71.11 -39.83 71.85 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.468 -0.493 . . . . 74.78 111.555 -174.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 93.3 mt -70.17 -46.98 63.52 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.35 -0.54 . . . . 86.73 111.14 -177.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.8 p -63.7 -33.08 74.84 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.109 -0.636 . . . . 78.3 111.276 178.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -69.73 -36.94 76.3 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.609 -0.436 . . . . 65.26 111.064 178.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.8 mt -73.15 -38.01 53.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 C-N-CA 120.738 -0.385 . . . . 74.57 110.48 178.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -63.77 -43.13 97.3 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 121.775 -0.578 . . . . 111.78 111.124 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.45 -35.48 77.64 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.706 -0.398 . . . . 74.63 111.472 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -111.4 23.18 14.29 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 112.446 0.535 . . . . 83.92 112.446 -176.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -57.44 -32.59 67.07 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.631 -0.428 . . . . 107.39 111.821 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.65 -45.65 61.37 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.392 -0.523 . . . . 70.36 110.912 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.54 -33.61 76.3 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.565 -0.454 . . . . 69.79 111.642 -178.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -74.26 -42.62 59.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.336 -0.546 . . . . 72.52 111.257 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.3 mtpt -58.05 -27.43 63.59 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.033 -0.667 . . . . 113.88 111.572 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.21 -37.81 21.36 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.802 -0.359 . . . . 89.11 111.598 -179.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -132.02 100.82 15.51 Favored Pre-proline 0 C--O 1.244 0.81 0 N-CA-C 108.815 -0.809 . . . . 88.48 108.815 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -65.75 -26.07 53.17 Favored 'Trans proline' 0 C--O 1.237 0.453 0 CA-C-N 118.696 0.57 . . . . 79.66 113.072 178.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -60.26 -27.99 67.69 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.436 -0.505 . . . . 95.71 111.299 177.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -71.34 -42.37 68.61 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.181 -0.608 . . . . 99.74 110.884 173.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.6 tp -58.54 -44.68 89.72 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.425 -0.51 . . . . 74.28 110.943 174.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 15.6 m-30 -61.26 -39.32 89.91 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.521 -0.471 . . . . 75.78 111.026 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.89 -47.01 82.33 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.468 -0.493 . . . . 62.01 110.881 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.6 m -61.64 -38.56 88.13 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.201 -0.6 . . . . 61.59 110.995 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 87.5 mt -60.26 -48.1 83.16 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.595 -0.442 . . . . 65.57 110.937 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -61.66 -35.56 78.29 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.325 -0.55 . . . . 65.73 111.097 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -72.05 -40.61 68.24 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.629 -0.428 . . . . 68.01 111.264 -178.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 83.4 mt -83.0 -51.96 13.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 120.87 0.367 . . . . 74.25 110.929 -176.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.1 mt -81.39 -29.08 34.08 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.807 -0.558 . . . . 63.44 112.474 -173.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -46.27 -55.16 7.91 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-O 121.325 0.403 . . . . 62.73 113.5 -177.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -62.45 -21.87 73.32 Favored 'Trans proline' 0 C--O 1.238 0.486 0 N-CA-C 114.122 0.778 . . . . 65.82 114.122 -177.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.7 m -112.33 20.49 6.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 118.952 0.797 . . . . 81.54 111.557 -174.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 42.0 t -123.91 130.59 73.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.418 -0.956 . . . . 72.48 108.418 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -92.73 73.85 4.97 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 122.579 1.18 . . . . 73.55 108.812 175.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.24 -46.45 85.9 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 114.587 -1.188 . . . . 63.76 111.187 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -66.91 -38.2 85.78 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.074 -0.65 . . . . 108.39 111.178 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -66.57 -38.02 93.01 Favored Glycine 0 C--N 1.334 0.451 0 C-N-CA 120.029 -1.081 . . . . 63.43 112.316 176.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.19 -46.34 87.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 O-C-N 122.222 -0.575 . . . . 64.86 110.205 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.07 -50.38 69.28 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 121.968 -0.457 . . . . 52.86 111.004 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -64.52 -36.49 84.39 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.321 -0.552 . . . . 104.7 111.078 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.7 t -60.34 -40.26 90.06 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.448 -0.501 . . . . 78.18 111.018 177.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 74.2 t -74.94 -37.05 40.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 C-N-CA 120.812 -0.355 . . . . 55.33 110.551 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 97.4 mtp -74.95 -32.9 61.84 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 121.886 -0.509 . . . . 58.51 112.365 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 2.5 m 74.8 153.76 0.15 Allowed 'General case' 0 C--O 1.236 0.356 0 C-N-CA 122.979 0.511 . . . . 88.13 109.881 -171.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.16 -32.73 53.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 120.809 -0.356 . . . . 84.51 110.759 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -52.64 -40.16 62.5 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.964 -0.46 . . . . 98.77 111.425 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -100.33 -32.76 10.69 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.293 0.849 . . . . 85.15 113.293 -176.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.9 p -64.05 -33.81 76.59 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.062 -0.655 . . . . 74.71 111.599 -178.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -75.14 -8.56 56.91 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.779 0.659 . . . . 96.47 112.779 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -93.12 2.15 56.86 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.286 0.494 . . . . 63.01 112.215 169.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -116.43 147.77 41.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.257 0.551 . . . . 51.97 110.197 -175.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 99.1 p -78.87 158.59 75.06 Favored Pre-proline 0 N--CA 1.451 -0.411 0 CA-C-N 115.477 -0.783 . . . . 57.22 110.393 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.77 -37.29 98.26 Favored 'Trans proline' 0 C--O 1.238 0.482 0 C-N-CA 118.902 -0.265 . . . . 65.43 112.581 173.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -62.22 -33.84 75.33 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.518 -0.473 . . . . 64.2 111.296 175.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -72.84 -45.87 56.02 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.788 0.327 . . . . 61.76 111.036 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 77.3 mt -57.66 -37.63 60.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.014 0.435 . . . . 56.52 110.136 176.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.1 tptt -61.24 -49.21 78.04 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.972 -0.455 . . . . 92.74 110.853 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 26.7 mtm105 -60.27 -30.37 69.4 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.045 -0.662 . . . . 56.94 111.484 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -71.4 -37.69 71.53 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.044 -0.662 . . . . 51.73 110.909 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -55.74 -46.25 77.84 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.429 -0.508 . . . . 77.56 110.807 173.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -66.49 -49.33 66.95 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.684 -0.406 . . . . 56.33 111.282 -172.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 88.9 t -54.71 -37.09 38.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.161 -0.616 . . . . 52.97 109.872 175.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -51.39 45.09 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.069 -0.395 . . . . 57.0 110.9 178.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -60.42 -56.88 16.11 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.096 0.474 . . . . 94.76 111.095 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -59.98 -40.37 88.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.731 -0.388 . . . . 78.39 111.459 -173.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.0 p -70.14 -35.9 74.39 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.181 -0.608 . . . . 71.6 111.068 -179.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 29.5 mt -62.07 -41.77 98.51 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.194 -0.602 . . . . 56.38 111.157 176.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.6 mtm -72.92 -36.46 67.24 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.349 -0.54 . . . . 68.07 111.368 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -65.64 -42.18 91.75 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.576 -0.45 . . . . 74.98 111.462 -177.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -99.95 -12.86 19.42 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.886 1.069 . . . . 67.59 113.886 -174.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -135.19 10.21 3.52 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.997 0.74 . . . . 78.87 112.997 -177.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -74.46 -43.21 31.29 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.06 -1.067 . . . . 72.36 112.632 178.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -59.18 -22.41 60.94 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.195 -0.591 . . . . 113.24 112.466 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.86 -29.64 68.43 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.421 -0.511 . . . . 75.58 111.702 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.2 mt -73.38 -17.89 61.23 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.476 0.547 . . . . 89.37 112.476 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 61.6 mt -89.42 -43.9 10.55 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.485 0.55 . . . . 92.42 112.485 177.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -63.28 -35.31 79.92 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.722 -0.391 . . . . 118.43 111.667 -171.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -133.93 59.73 1.73 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 122.109 0.957 . . . . 135.74 110.015 -176.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -92.17 0.02 57.44 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 114.392 -1.276 . . . . 106.22 112.773 166.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 55.6 m-20 -77.06 -4.76 45.91 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.551 0.74 . . . . 114.98 112.808 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -83.07 170.95 14.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 122.116 0.96 . . . . 120.05 110.812 -172.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -105.04 148.97 26.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.013 -0.994 . . . . 107.14 110.536 -177.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 81.2 mt -135.33 142.98 38.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 108.205 -1.035 . . . . 94.16 108.205 177.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 74.2 mtp180 -133.29 114.74 14.11 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.206 -0.664 . . . . 108.89 109.206 -177.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 95.3 t -81.43 113.81 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 107.748 -1.204 . . . . 62.62 107.748 176.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.2 mp -75.09 161.35 77.69 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.923 0.392 . . . . 74.58 110.984 -175.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -59.44 158.33 27.64 Favored 'Trans proline' 0 C--O 1.233 0.273 0 CA-C-O 122.211 0.838 . . . . 64.3 112.507 -172.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -160.29 145.23 14.71 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.712 -1.131 . . . . 79.57 108.835 178.153 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 50.6 m -104.68 9.85 34.99 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.502 -0.772 . . . . 66.62 112.588 -178.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.04 137.27 57.6 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.228 0.537 . . . . 77.34 110.742 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -95.67 162.92 22.68 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.831 -0.622 . . . . 121.36 110.529 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -63.54 -33.28 68.55 Favored 'Trans proline' 0 C--O 1.237 0.428 0 CA-C-N 118.062 0.344 . . . . 89.62 112.982 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 48.1 p -77.29 -6.96 55.13 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.142 0.793 . . . . 90.67 113.142 -178.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -59.86 155.89 15.41 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.93 0.871 . . . . 92.85 110.501 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -96.29 -15.65 21.81 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.203 -0.908 . . . . 96.69 113.22 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -164.18 149.53 10.49 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.163 -1.051 . . . . 102.33 108.163 -176.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -165.55 158.41 15.66 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.244 -0.65 . . . . 72.71 109.244 -178.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 45.5 m -122.6 124.89 44.53 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.227 -0.897 . . . . 85.11 108.718 176.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 10.5 t -112.29 120.67 63.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 107.959 -1.126 . . . . 62.66 107.959 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -103.04 152.56 21.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.236 0.541 . . . . 67.94 110.269 -177.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -151.65 169.91 20.99 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.96 -0.755 . . . . 132.36 108.96 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -127.22 143.32 51.27 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.254 -0.885 . . . . 96.27 109.211 178.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 70.5 mt -118.38 109.0 25.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 107.44 -1.318 . . . . 90.78 107.44 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -86.34 113.37 22.26 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.07 -1.085 . . . . 138.82 108.07 175.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -136.18 143.88 44.66 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.954 -0.387 . . . . 131.87 109.954 -174.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 89.4 p 54.89 81.55 0.11 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.785 -0.643 . . . . 134.49 111.565 176.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 80.5 mttt 62.33 10.9 4.16 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 124.226 1.011 . . . . 133.67 113.129 177.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 109.39 29.09 4.08 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 115.041 0.777 . . . . 125.63 115.041 173.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 10.3 m -81.18 115.89 20.82 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.812 -0.81 . . . . 126.67 108.812 175.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.4 t -104.6 126.66 59.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.128 -0.693 . . . . 100.44 109.128 -170.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -130.3 127.6 22.54 Favored Pre-proline 0 C--O 1.24 0.563 0 N-CA-C 108.554 -0.906 . . . . 108.8 108.554 172.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.7 142.24 35.48 Favored 'Trans proline' 0 C--N 1.333 -0.287 0 CA-C-N 119.619 0.9 . . . . 77.51 111.875 177.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 58.1 t -130.79 129.91 64.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 107.615 -1.254 . . . . 61.85 107.615 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 29.9 t -124.23 146.53 48.67 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.182 0.515 . . . . 68.11 110.019 -176.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -123.35 121.88 36.92 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.642 -0.873 . . . . 65.44 108.642 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 28.0 m -88.3 111.73 22.04 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.122 -1.066 . . . . 61.54 108.122 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' MET . . . . . . . . . . . . . 15.6 mmt -100.36 148.44 24.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.562 0.696 . . . . 75.98 110.916 -175.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 3.7 t -135.91 130.61 34.04 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.07 -0.968 . . . . 74.48 108.406 177.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -84.2 111.65 19.56 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.868 -0.79 . . . . 86.75 108.868 -177.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 46.8 mt -110.73 -178.7 3.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.678 0.751 . . . . 87.41 109.601 179.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ALA . . . . . . . . . . . . . . . -55.99 -40.65 73.65 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.535 -0.757 . . . . 108.72 111.065 177.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . -82.66 13.97 38.95 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 115.142 0.817 . . . . 86.82 115.142 177.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 102.84 -163.34 16.17 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-O 122.492 1.051 . . . . 94.05 112.622 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -79.25 136.73 37.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.63 -0.785 . . . . 81.33 110.326 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -138.25 154.93 49.05 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.428 0.632 . . . . 74.31 109.542 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 88.9 t -72.52 132.67 33.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 115.304 -0.862 . . . . 66.82 109.243 175.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 65.3 ttt-85 -117.32 -18.72 9.83 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.338 0.866 . . . . 109.39 113.338 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -163.79 153.76 15.0 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.323 -0.992 . . . . 60.6 108.323 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 83.8 t -131.08 128.45 62.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 108.548 -0.908 . . . . 63.6 108.548 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 77.0 mt -115.35 128.0 72.72 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 107.818 -1.178 . . . . 71.32 107.818 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' ILE . . . . . . . . . . . . . 60.1 mt -124.3 114.97 43.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 108.276 -1.009 . . . . 70.91 108.276 -174.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 49.4 t30 50.57 41.99 26.21 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.568 0.699 . . . . 97.55 110.994 175.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 89.54 -12.76 65.91 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-O 119.038 -0.868 . . . . 78.47 115.258 178.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 78.8 mt -91.65 111.05 23.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 118.572 1.186 . . . . 80.21 108.219 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ASN . . . . . . . . . . . . . 41.0 t-20 -70.43 100.75 1.82 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.241 -1.022 . . . . 60.96 108.241 175.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ILE . . . . . . . . . . . . . 34.4 mm -65.03 -36.44 77.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 120.488 -0.485 . . . . 55.55 110.472 -175.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . -59.29 -48.29 86.67 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.036 -1.078 . . . . 59.32 112.305 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -66.91 -32.3 73.46 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.152 -0.617 . . . . 78.82 111.491 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 10.4 tt -58.89 -52.94 63.58 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.308 -0.557 . . . . 64.28 110.574 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -66.81 -30.05 70.15 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.164 -0.614 . . . . 58.68 111.507 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ARG . . . . . . . . . . . . . 14.5 ttp180 -61.89 -40.44 95.43 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.304 -0.558 . . . . 102.37 110.817 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -74.02 -43.38 58.14 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.673 -0.411 . . . . 58.97 111.231 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -60.69 -37.98 83.46 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.272 -0.571 . . . . 80.01 111.009 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -65.89 -40.58 91.69 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.377 -0.529 . . . . 56.48 110.981 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -67.24 -43.94 80.68 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.488 -0.485 . . . . 57.37 111.255 178.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -61.32 -44.47 97.14 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.451 -0.5 . . . . 55.8 111.119 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 44.3 p -68.39 -34.68 76.47 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.229 -0.589 . . . . 62.54 111.6 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 58.8 mmm -65.5 -39.88 92.38 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.284 -0.566 . . . . 55.05 111.241 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 50.3 tp60 -64.77 -38.16 90.06 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.072 -0.651 . . . . 72.94 110.894 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -70.05 -35.07 74.0 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.422 -0.511 . . . . 99.62 111.267 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -87.16 12.89 10.55 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.682 0.623 . . . . 61.88 112.682 178.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.662 ' NH2' ' O3 ' ' A' 1005 ' ' SO4 . 17.7 mmm180 53.97 45.44 27.65 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.908 0.861 . . . . 79.65 110.709 -178.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 60.68 29.93 19.36 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.41 -0.813 . . . . 55.65 111.968 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -84.16 106.93 16.18 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.277 -1.009 . . . . 54.38 108.277 174.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 66.8 mt -65.22 -42.88 93.02 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.393 -0.523 . . . . 60.9 111.264 -178.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -57.78 -48.09 80.67 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.64 -0.424 . . . . 61.39 110.982 -179.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -60.55 -39.14 86.86 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.347 -0.541 . . . . 104.0 111.097 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' THR . . . . . . . . . . . . . 59.6 m -68.0 -40.41 83.03 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.744 -0.382 . . . . 56.21 111.217 -179.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.87 -40.82 81.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 120.556 -0.457 . . . . 55.78 110.529 -179.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.62 -15.82 63.85 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 121.792 -0.568 . . . . 55.6 112.394 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' GLY . . . . . . . . . . . . . . . -111.26 -2.32 27.95 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 118.224 0.466 . . . . 49.59 113.111 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -64.05 -26.71 68.68 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.382 -0.527 . . . . 59.95 111.684 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -58.32 -34.89 76.2 Favored Glycine 0 C--N 1.334 0.432 0 C-N-CA 120.002 -1.095 . . . . 55.77 112.514 175.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 49.5 tp10 -72.68 -32.31 65.7 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.279 -0.542 . . . . 102.37 111.546 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 76.8 t -64.98 -46.05 92.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 C-N-CA 120.464 -0.495 . . . . 61.57 110.149 175.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' VAL . . . . . . . . . . . . . 67.0 t -62.63 -42.25 95.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 O-C-N 122.066 -0.396 . . . . 57.89 110.376 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.24 77.11 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.428 -0.509 . . . . 61.06 111.35 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -93.67 0.89 56.68 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.003 0.742 . . . . 106.26 113.003 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ALA . . . . . . . . . . . . . . . -59.09 -31.14 68.63 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 118.409 0.55 . . . . 62.92 111.879 -175.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' LYS . . . . . . . . . . . . . 32.6 tttt -68.4 -54.2 18.77 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.627 -0.429 . . . . 95.38 110.981 -176.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -63.52 -34.88 78.77 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.254 -0.578 . . . . 124.41 111.249 176.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 78.5 m -56.15 -36.22 68.05 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.569 -0.452 . . . . 68.54 110.868 173.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -76.29 -39.85 53.18 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 122.241 -0.287 . . . . 73.77 111.486 178.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -61.33 -50.05 74.5 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.72 -0.392 . . . . 111.69 110.96 178.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.21 -43.69 83.01 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.387 -0.525 . . . . 81.74 111.0 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -68.75 -12.32 61.32 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.595 0.591 . . . . 111.07 112.595 177.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -92.85 -27.8 16.91 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.525 0.565 . . . . 109.28 112.525 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.835 0.35 . . . . 103.98 110.793 -179.299 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1001 ' ' GOT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1002 ' ' H3T . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1003 ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1004 ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1005 ' ' SO4 . . . . . 0.662 ' O3 ' ' NH2' ' A' ' 186' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1006 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1007 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_