data_2fcq_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2fcq _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.8 tp . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 120.536 0.208 . . . . 85.0 110.802 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -131.59 139.01 49.07 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 120.777 -1.202 . . . . 85.0 107.846 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 19.1 pt -134.43 161.93 39.77 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 O-C-N 119.114 -2.241 . . . . 85.0 109.739 174.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -104.49 141.92 35.52 Favored 'General case' 0 N--CA 1.444 -0.742 0 O-C-N 120.163 -1.586 . . . . 85.0 110.813 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 37.6 t -118.78 118.21 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 O-C-N 120.147 -1.596 . . . . 85.0 108.616 173.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -84.17 126.01 32.72 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.892 -1.13 . . . . 85.0 110.15 178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.3 p -85.97 160.82 19.26 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 120.709 -1.244 . . . . 85.0 109.962 173.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.52 -39.15 22.33 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.575 1.15 . . . . 85.0 110.523 164.419 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.8 p -54.7 -31.54 58.16 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.053 -1.654 . . . . 85.0 110.259 177.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.3 -23.1 31.22 Favored Glycine 0 C--N 1.342 0.862 0 N-CA-C 108.503 -1.839 . . . . 85.0 108.503 -168.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -66.33 142.05 57.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.245 -1.738 . . . . 85.0 108.958 -169.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.2 m -109.32 129.57 55.52 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 120.934 -1.103 . . . . 85.0 108.958 -170.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.0 pt -119.54 122.02 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.28 0 O-C-N 120.784 -1.197 . . . . 85.0 108.62 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 64.2 p -71.4 147.13 48.24 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 120.749 -1.219 . . . . 85.0 108.902 172.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.0 mp -130.65 129.77 43.07 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 120.612 -1.305 . . . . 85.0 108.885 176.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -85.43 117.32 24.28 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 106.098 -1.816 . . . . 85.0 106.098 172.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.1 m -130.12 144.45 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.596 0 O-C-N 120.74 -1.225 . . . . 85.0 109.565 -175.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -76.81 152.73 82.94 Favored Pre-proline 0 CA--C 1.542 0.652 0 N-CA-C 104.645 -2.354 . . . . 85.0 104.645 167.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.38 -26.11 20.86 Favored 'Trans proline' 0 C--N 1.325 -0.691 0 C-N-CA 121.717 1.611 . . . . 85.0 113.475 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -93.15 15.06 16.15 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 119.443 -2.036 . . . . 85.0 110.933 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -68.36 138.26 55.25 Favored 'General case' 0 CA--C 1.518 -0.258 0 O-C-N 119.138 -2.226 . . . . 85.0 106.128 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.9 p -76.02 165.06 25.5 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.276 -1.515 . . . . 85.0 110.859 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 25.8 mm -61.54 -32.21 52.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 O-C-N 119.821 -1.799 . . . . 85.0 109.877 175.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . 0.588 ' OE1' ' N ' ' A' ' 53' ' ' GLY . 3.5 mp0 -58.09 -50.33 73.84 Favored 'General case' 0 CA--C 1.504 -0.799 0 O-C-N 119.127 -2.233 . . . . 85.0 109.059 172.463 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -53.28 -41.78 65.89 Favored 'General case' 0 N--CA 1.441 -0.899 0 O-C-N 120.598 -1.314 . . . . 85.0 108.387 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 67.2 t -64.15 -50.27 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 O-C-N 120.083 -1.635 . . . . 85.0 110.784 175.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -57.91 -40.29 80.03 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 118.826 -2.421 . . . . 85.0 110.823 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.11 -23.67 62.15 Favored 'General case' 0 C--N 1.32 -0.709 0 O-C-N 119.289 -2.132 . . . . 85.0 110.771 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -70.25 -38.05 75.07 Favored 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 119.752 -1.843 . . . . 85.0 108.19 173.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 91.8 mt -71.84 -45.95 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 125.076 1.35 . . . . 85.0 109.674 178.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -34.56 -52.17 0.5 Allowed 'General case' 0 C--O 1.222 -0.364 0 O-C-N 120.125 -1.61 . . . . 85.0 109.4 161.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -61.08 -67.96 0.35 Allowed 'General case' 0 C--O 1.213 -0.841 0 O-C-N 119.667 -1.895 . . . . 85.0 111.392 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -71.12 -26.39 63.0 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 118.27 -2.769 . . . . 85.0 112.386 -163.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -110.42 -52.67 2.76 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.723 -1.236 . . . . 85.0 112.947 -178.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.89 46.12 1.22 Allowed Glycine 0 CA--C 1.542 1.727 0 O-C-N 126.016 2.073 . . . . 85.0 111.552 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . 0.557 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 8.6 mt -117.54 109.53 41.76 Favored Pre-proline 0 C--O 1.246 0.897 0 N-CA-C 108.481 -0.933 . . . . 85.0 108.481 179.116 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_exo -47.73 123.94 9.04 Favored 'Trans proline' 0 N--CA 1.462 -0.343 0 C-N-CA 121.387 1.391 . . . . 85.0 114.081 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -38.38 -31.31 0.2 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.403 2.069 . . . . 85.0 114.456 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -65.08 -33.31 75.72 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 120.669 -1.269 . . . . 85.0 110.969 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -85.57 -10.46 55.87 Favored 'General case' 0 CA--C 1.511 -0.546 0 O-C-N 119.442 -2.036 . . . . 85.0 111.269 176.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . 0.557 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 58.3 mt-30 -82.54 137.29 34.63 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 119.783 -1.823 . . . . 85.0 110.171 179.607 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.0 ttm-85 -130.04 117.06 19.44 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.156 -1.794 . . . . 85.0 106.156 165.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.9 mt -98.48 145.55 26.66 Favored 'General case' 0 CA--C 1.511 -0.519 0 O-C-N 120.09 -1.631 . . . . 85.0 111.246 -178.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 5.2 mm -126.19 140.09 49.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 120.842 -1.161 . . . . 85.0 111.331 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -134.85 118.5 17.04 Favored 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 119.703 -1.873 . . . . 85.0 108.556 176.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 43.03 55.6 4.43 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 120.597 1.544 . . . . 85.0 108.767 -173.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.54 -27.42 1.06 Allowed Glycine 0 N--CA 1.468 0.811 0 O-C-N 120.186 -1.571 . . . . 85.0 114.807 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -72.48 117.01 13.62 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 120.284 2.042 . . . . 85.0 109.457 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -68.91 114.7 7.46 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 120.313 -1.492 . . . . 85.0 108.141 170.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 65.8 mt -73.8 147.25 43.58 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 120.434 -1.416 . . . . 85.0 112.432 -175.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -109.14 129.82 55.48 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.341 -1.475 . . . . 85.0 111.388 -172.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -35.73 138.75 0.15 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 120.45 1.477 . . . . 85.0 109.685 166.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . 0.588 ' N ' ' OE1' ' A' ' 24' ' ' GLU . . . 96.43 -41.84 2.33 Favored Glycine 0 C--O 1.225 -0.462 0 O-C-N 118.251 -2.781 . . . . 85.0 114.235 170.258 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -71.93 153.21 41.98 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 121.502 2.651 . . . . 85.0 108.293 167.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 71.7 p -101.51 162.21 13.07 Favored 'General case' 0 CA--C 1.517 -0.326 0 O-C-N 118.917 -2.365 . . . . 85.0 112.897 -175.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 92.3 mt -44.13 -47.5 9.02 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 119.82 -1.8 . . . . 85.0 109.789 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.4 p -66.6 -33.47 75.73 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.386 -1.446 . . . . 85.0 111.268 -175.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -57.49 -44.19 84.74 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 120.901 1.682 . . . . 85.0 108.508 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -87.69 10.8 16.97 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 118.72 -2.487 . . . . 85.0 112.324 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 56.63 39.58 29.72 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 119.998 -1.689 . . . . 85.0 112.311 179.473 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 56.2 mt -84.47 131.62 33.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 O-C-N 119.489 -2.007 . . . . 85.0 106.536 173.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -131.45 -176.4 4.02 Favored 'General case' 0 CA--C 1.485 -1.548 0 O-C-N 119.931 -1.731 . . . . 85.0 111.461 -169.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -47.97 134.66 13.41 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 120.782 -1.199 . . . . 85.0 109.372 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 62.5 26.67 15.86 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 120.729 -1.232 . . . . 85.0 113.263 173.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 58.4 m -82.85 147.1 28.53 Favored 'General case' 0 C--O 1.212 -0.871 0 O-C-N 120.023 -1.673 . . . . 85.0 108.397 175.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.8 m -104.35 126.72 51.69 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 118.672 -2.518 . . . . 85.0 111.546 -177.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 32.0 mt -104.09 137.88 41.4 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 119.61 -1.931 . . . . 85.0 107.998 171.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -98.67 122.4 41.84 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 119.649 -1.907 . . . . 85.0 108.093 175.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 32.9 tp -87.14 130.73 34.4 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.955 0.902 . . . . 85.0 112.038 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.4 m -139.45 155.56 25.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 119.991 -1.693 . . . . 85.0 108.562 172.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -91.96 161.85 14.63 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 119.852 -1.78 . . . . 85.0 111.845 -166.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 67.1 mtp85 -120.25 100.0 6.92 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.122 -1.436 . . . . 85.0 107.122 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 58.9 mt . . . . . 0 N--CA 1.467 0.405 0 C-N-CA 124.614 1.166 . . . . 85.0 112.241 173.063 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' LEU . . . . . . . . . . . . . 1.4 tp . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 108.748 -0.834 . . . . 85.0 108.748 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -157.99 118.44 3.39 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 120.093 -1.63 . . . . 85.0 110.779 -174.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 33.0 pt -122.08 153.02 26.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 O-C-N 120.502 -1.374 . . . . 85.0 108.654 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -95.38 163.13 13.37 Favored 'General case' 0 C--N 1.329 -0.288 0 O-C-N 120.512 -1.368 . . . . 85.0 109.928 177.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 55.1 t -146.19 105.59 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 O-C-N 119.687 -1.883 . . . . 85.0 110.691 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LYS . . . . . 1.127 ' CE ' ' CE1' ' B' ' 68' ' ' HIS . 13.4 ttmm -65.42 108.63 2.03 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 119.61 -1.931 . . . . 85.0 108.827 175.273 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 17.9 p -79.56 -173.31 3.69 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 119.388 -2.07 . . . . 85.0 111.574 -175.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 23.3 mt -71.26 -3.65 21.54 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 120.356 -1.465 . . . . 85.0 112.582 -177.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -107.02 -4.55 18.87 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.334 -1.479 . . . . 85.0 110.431 -178.894 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.28 -24.53 18.72 Favored Glycine 0 N--CA 1.47 0.93 0 O-C-N 119.512 -1.992 . . . . 85.0 110.667 -172.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 37.6 tttt -55.07 148.85 13.04 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.645 1.578 . . . . 85.0 110.03 169.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 48.3 m -123.56 108.45 12.63 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.456 -1.403 . . . . 85.0 111.419 -179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 30.1 pt -82.96 138.42 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 O-C-N 119.475 -2.016 . . . . 85.0 113.009 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 92.4 m -79.16 125.25 29.19 Favored 'General case' 0 CA--C 1.508 -0.645 0 O-C-N 120.686 -1.259 . . . . 85.0 108.699 172.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.7 mp -107.5 126.98 53.2 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 120.705 -1.247 . . . . 85.0 110.724 175.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -86.8 117.73 25.74 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 106.672 -1.603 . . . . 85.0 106.672 169.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 17.0 m -131.22 168.6 23.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 O-C-N 120.395 -1.441 . . . . 85.0 114.681 -176.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -108.09 144.56 29.64 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 106.58 -1.637 . . . . 85.0 106.58 176.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.75 -12.48 35.37 Favored 'Trans proline' 0 C--O 1.238 0.48 0 C-N-CA 122.288 1.992 . . . . 85.0 114.516 -178.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 52.3 m -113.11 26.48 10.43 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 120.183 -1.573 . . . . 85.0 109.899 171.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -76.12 139.1 41.16 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 119.851 -1.781 . . . . 85.0 106.889 172.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 70.1 p -79.81 163.12 24.66 Favored 'General case' 0 CA--C 1.508 -0.668 0 O-C-N 119.547 -1.971 . . . . 85.0 109.656 -178.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 13.6 mm -59.25 -41.26 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.824 0 N-CA-C 104.757 -2.312 . . . . 85.0 104.757 174.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.15 -39.43 69.48 Favored 'General case' 0 C--O 1.218 -0.558 0 O-C-N 120.267 -1.521 . . . . 85.0 110.067 176.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 -63.71 -38.8 92.47 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 119.155 -2.215 . . . . 85.0 110.443 176.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 42.7 t -66.14 -44.33 91.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 O-C-N 119.752 -1.842 . . . . 85.0 112.332 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -58.86 -39.51 81.56 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 120.818 -1.176 . . . . 85.0 110.811 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -75.48 -21.62 57.91 Favored 'General case' 0 C--O 1.239 0.509 0 O-C-N 120.265 -1.522 . . . . 85.0 111.87 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -71.53 -53.95 12.14 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 106.628 -1.619 . . . . 85.0 106.628 171.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 57.1 mt -50.75 -37.87 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 O-C-N 120.414 -1.429 . . . . 85.0 112.195 172.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.38 -37.76 87.98 Favored 'General case' 0 C--O 1.239 0.514 0 O-C-N 120.209 -1.557 . . . . 85.0 112.843 -179.432 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -71.29 -37.04 71.88 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 119.753 -1.842 . . . . 85.0 109.349 175.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -76.77 -63.57 1.32 Allowed 'General case' 0 CA--C 1.529 0.138 0 O-C-N 120.872 -1.142 . . . . 85.0 110.501 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -87.86 -30.27 20.28 Favored 'General case' 0 C--O 1.253 1.256 0 O-C-N 119.929 -1.732 . . . . 85.0 112.806 -174.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 96.5 6.15 58.67 Favored Glycine 0 N--CA 1.485 1.9 0 O-C-N 120.715 -1.241 . . . . 85.0 113.332 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 14.5 mt -86.39 115.06 60.72 Favored Pre-proline 0 N--CA 1.451 -0.402 0 O-C-N 120.108 -1.819 . . . . 85.0 106.549 -177.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -50.63 140.0 37.66 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 120.05 0.5 . . . . 85.0 111.168 177.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -44.16 -50.26 7.86 Favored 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 121.5 1.467 . . . . 85.0 114.573 174.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -70.78 -11.0 60.68 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 122.714 2.506 . . . . 85.0 112.945 -177.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -84.37 -3.28 58.2 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 121.597 1.999 . . . . 85.0 112.876 165.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -99.81 146.63 26.37 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 118.952 -2.343 . . . . 85.0 111.215 -177.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 13.0 ttm105 -129.21 134.75 48.14 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 107.226 -1.398 . . . . 85.0 107.226 160.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 40.5 mt -114.94 130.9 57.01 Favored 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 119.869 -1.769 . . . . 85.0 110.523 -174.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.6 mm -116.38 132.64 65.4 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 O-C-N 121.058 -1.026 . . . . 85.0 109.466 -175.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -130.8 115.94 17.29 Favored 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 119.939 -1.726 . . . . 85.0 108.271 169.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.92 51.22 16.94 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.267 -0.896 . . . . 85.0 111.775 173.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.15 -36.89 2.37 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 119.71 -1.869 . . . . 85.0 114.6 -178.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -75.81 129.65 37.37 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-N 121.882 2.841 . . . . 85.0 110.385 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -75.08 132.71 41.46 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 107.387 -1.338 . . . . 85.0 107.387 169.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 43.6 mt -84.36 143.59 29.38 Favored 'General case' 0 CA--C 1.498 -1.051 0 O-C-N 120.521 -1.362 . . . . 85.0 107.605 -175.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -112.23 133.56 54.29 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 119.641 -1.912 . . . . 85.0 109.472 -171.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -39.42 -50.49 2.1 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.802 1.241 . . . . 85.0 113.555 -169.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.64 -22.1 77.69 Favored Glycine 0 CA--C 1.534 1.224 0 O-C-N 119.472 -2.018 . . . . 85.0 117.65 -173.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -84.83 172.42 11.45 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 122.062 2.931 . . . . 85.0 109.655 -174.64 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 64.8 p -110.75 164.92 12.27 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 121.036 -1.04 . . . . 85.0 112.391 -174.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 mt -55.74 -44.39 77.52 Favored 'General case' 0 C--O 1.245 0.851 0 O-C-N 120.803 -1.186 . . . . 85.0 111.242 178.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 1.3 t -49.34 -50.55 39.26 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 120.86 -1.15 . . . . 85.0 111.549 169.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -54.41 -27.2 35.2 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 120.588 -1.32 . . . . 85.0 111.922 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -104.77 4.63 32.53 Favored 'General case' 0 C--O 1.239 0.508 0 O-C-N 119.598 -1.939 . . . . 85.0 111.51 177.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 61.67 56.18 2.54 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 120.107 -1.621 . . . . 85.0 108.149 174.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 22.4 mt -110.84 87.68 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 O-C-N 120.014 -1.679 . . . . 85.0 108.927 -177.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -82.05 -169.9 2.61 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 119.971 -1.706 . . . . 85.0 112.038 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.79 157.53 37.73 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 119.141 -2.224 . . . . 85.0 114.03 -168.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 63.37 4.84 1.82 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 125.451 1.5 . . . . 85.0 110.221 -174.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.9 m -63.29 164.97 8.08 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 119.885 -1.759 . . . . 85.0 109.273 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 10.4 m -141.79 125.17 16.56 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 119.847 -1.783 . . . . 85.0 112.553 -168.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 12.8 mt -112.04 121.43 44.96 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 120.898 -1.126 . . . . 85.0 109.924 -175.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' HIS . . . . . 1.127 ' CE1' ' CE ' ' B' ' 6' ' ' LYS . 39.4 m-70 -76.38 124.08 26.98 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 107.154 -1.425 . . . . 85.0 107.154 172.918 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 22.0 tp -88.83 129.52 35.57 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 119.868 -1.77 . . . . 85.0 111.236 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 89.7 t -113.53 144.75 20.52 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.339 0 O-C-N 120.128 -1.607 . . . . 85.0 109.747 175.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 14.3 tp -79.93 128.3 33.3 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 119.464 -2.023 . . . . 85.0 109.817 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -92.93 148.37 22.07 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 120.144 -1.598 . . . . 85.0 108.952 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 39.9 mt . . . . . 0 CA--C 1.55 0.977 0 O-C-N 119.356 -2.09 . . . . 85.0 114.409 -165.11 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 600' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 700' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 800' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.8 tp . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 120.536 0.208 . . . . 85.0 110.802 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -131.59 139.01 49.07 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 120.777 -1.202 . . . . 85.0 107.846 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 19.1 pt -134.43 161.93 39.77 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 O-C-N 119.114 -2.241 . . . . 85.0 109.739 174.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -104.49 141.92 35.52 Favored 'General case' 0 N--CA 1.444 -0.742 0 O-C-N 120.163 -1.586 . . . . 85.0 110.813 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 37.6 t -118.78 118.21 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 O-C-N 120.147 -1.596 . . . . 85.0 108.616 173.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -84.17 126.01 32.72 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.892 -1.13 . . . . 85.0 110.15 178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.3 p -85.97 160.82 19.26 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 120.709 -1.244 . . . . 85.0 109.962 173.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.52 -39.15 22.33 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.575 1.15 . . . . 85.0 110.523 164.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.8 p -54.7 -31.54 58.16 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.053 -1.654 . . . . 85.0 110.259 177.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.3 -23.1 31.22 Favored Glycine 0 C--N 1.342 0.862 0 N-CA-C 108.503 -1.839 . . . . 85.0 108.503 -168.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -66.33 142.05 57.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.245 -1.738 . . . . 85.0 108.958 -169.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.2 m -109.32 129.57 55.52 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 120.934 -1.103 . . . . 85.0 108.958 -170.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.0 pt -119.54 122.02 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.28 0 O-C-N 120.784 -1.197 . . . . 85.0 108.62 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . 0.429 ' O ' HD12 ' A' ' 15' ' ' LEU . 64.2 p -71.4 147.13 48.24 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 120.749 -1.219 . . . . 85.0 108.902 172.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . 0.429 HD12 ' O ' ' A' ' 14' ' ' THR . 5.0 mp -130.65 129.77 43.07 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 120.612 -1.305 . . . . 85.0 108.885 176.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -85.43 117.32 24.28 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 106.098 -1.816 . . . . 85.0 106.098 172.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.1 m -130.12 144.45 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.596 0 O-C-N 120.74 -1.225 . . . . 85.0 109.565 -175.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -76.81 152.73 82.94 Favored Pre-proline 0 CA--C 1.542 0.652 0 N-CA-C 104.645 -2.354 . . . . 85.0 104.645 167.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.38 -26.11 20.86 Favored 'Trans proline' 0 C--N 1.325 -0.691 0 C-N-CA 121.717 1.611 . . . . 85.0 113.475 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -93.15 15.06 16.15 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 119.443 -2.036 . . . . 85.0 110.933 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -68.36 138.26 55.25 Favored 'General case' 0 CA--C 1.518 -0.258 0 O-C-N 119.138 -2.226 . . . . 85.0 106.128 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.9 p -76.02 165.06 25.5 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.276 -1.515 . . . . 85.0 110.859 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 25.8 mm -61.54 -32.21 52.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 O-C-N 119.821 -1.799 . . . . 85.0 109.877 175.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . 0.588 ' OE1' ' N ' ' A' ' 53' ' ' GLY . 3.5 mp0 -58.09 -50.33 73.84 Favored 'General case' 0 CA--C 1.504 -0.799 0 O-C-N 119.127 -2.233 . . . . 85.0 109.059 172.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -53.28 -41.78 65.89 Favored 'General case' 0 N--CA 1.441 -0.899 0 O-C-N 120.598 -1.314 . . . . 85.0 108.387 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 67.2 t -64.15 -50.27 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 O-C-N 120.083 -1.635 . . . . 85.0 110.784 175.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -57.91 -40.29 80.03 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 118.826 -2.421 . . . . 85.0 110.823 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.11 -23.67 62.15 Favored 'General case' 0 C--N 1.32 -0.709 0 O-C-N 119.289 -2.132 . . . . 85.0 110.771 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -70.25 -38.05 75.07 Favored 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 119.752 -1.843 . . . . 85.0 108.19 173.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 91.8 mt -71.84 -45.95 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 125.076 1.35 . . . . 85.0 109.674 178.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 34.5 tp60 -34.56 -52.17 0.5 Allowed 'General case' 0 C--O 1.222 -0.364 0 O-C-N 120.125 -1.61 . . . . 85.0 109.4 161.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -61.08 -67.96 0.35 Allowed 'General case' 0 C--O 1.213 -0.841 0 O-C-N 119.667 -1.895 . . . . 85.0 111.392 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -71.12 -26.39 63.0 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 118.27 -2.769 . . . . 85.0 112.386 -163.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -110.42 -52.67 2.76 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.723 -1.236 . . . . 85.0 112.947 -178.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.89 46.12 1.22 Allowed Glycine 0 CA--C 1.542 1.727 0 O-C-N 126.016 2.073 . . . . 85.0 111.552 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 8.6 mt -117.54 109.53 41.76 Favored Pre-proline 0 C--O 1.246 0.897 0 N-CA-C 108.481 -0.933 . . . . 85.0 108.481 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_exo -47.73 123.94 9.04 Favored 'Trans proline' 0 N--CA 1.462 -0.343 0 C-N-CA 121.387 1.391 . . . . 85.0 114.081 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -38.38 -31.31 0.2 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.403 2.069 . . . . 85.0 114.456 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -65.08 -33.31 75.72 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 120.669 -1.269 . . . . 85.0 110.969 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -85.57 -10.46 55.87 Favored 'General case' 0 CA--C 1.511 -0.546 0 O-C-N 119.442 -2.036 . . . . 85.0 111.269 176.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -82.54 137.29 34.63 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 119.783 -1.823 . . . . 85.0 110.171 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.0 ttm-85 -130.04 117.06 19.44 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.156 -1.794 . . . . 85.0 106.156 165.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.9 mt -98.48 145.55 26.66 Favored 'General case' 0 CA--C 1.511 -0.519 0 O-C-N 120.09 -1.631 . . . . 85.0 111.246 -178.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 5.2 mm -126.19 140.09 49.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 120.842 -1.161 . . . . 85.0 111.331 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -134.85 118.5 17.04 Favored 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 119.703 -1.873 . . . . 85.0 108.556 176.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 43.03 55.6 4.43 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 120.597 1.544 . . . . 85.0 108.767 -173.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.54 -27.42 1.06 Allowed Glycine 0 N--CA 1.468 0.811 0 O-C-N 120.186 -1.571 . . . . 85.0 114.807 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -72.48 117.01 13.62 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 120.284 2.042 . . . . 85.0 109.457 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLN . . . . . 0.5 ' HB3' HG23 ' B' ' 9' ' ' THR . 53.4 tt0 -68.91 114.7 7.46 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 120.313 -1.492 . . . . 85.0 108.141 170.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 65.8 mt -73.8 147.25 43.58 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 120.434 -1.416 . . . . 85.0 112.432 -175.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -109.14 129.82 55.48 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.341 -1.475 . . . . 85.0 111.388 -172.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -35.73 138.75 0.15 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 120.45 1.477 . . . . 85.0 109.685 166.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . 0.588 ' N ' ' OE1' ' A' ' 24' ' ' GLU . . . 96.43 -41.84 2.33 Favored Glycine 0 C--O 1.225 -0.462 0 O-C-N 118.251 -2.781 . . . . 85.0 114.235 170.258 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -71.93 153.21 41.98 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 121.502 2.651 . . . . 85.0 108.293 167.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 71.7 p -101.51 162.21 13.07 Favored 'General case' 0 CA--C 1.517 -0.326 0 O-C-N 118.917 -2.365 . . . . 85.0 112.897 -175.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 92.3 mt -44.13 -47.5 9.02 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 119.82 -1.8 . . . . 85.0 109.789 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.4 p -66.6 -33.47 75.73 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.386 -1.446 . . . . 85.0 111.268 -175.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -57.49 -44.19 84.74 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 120.901 1.682 . . . . 85.0 108.508 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -87.69 10.8 16.97 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 118.72 -2.487 . . . . 85.0 112.324 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 56.63 39.58 29.72 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 119.998 -1.689 . . . . 85.0 112.311 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 56.2 mt -84.47 131.62 33.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 O-C-N 119.489 -2.007 . . . . 85.0 106.536 173.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -131.45 -176.4 4.02 Favored 'General case' 0 CA--C 1.485 -1.548 0 O-C-N 119.931 -1.731 . . . . 85.0 111.461 -169.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -47.97 134.66 13.41 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 120.782 -1.199 . . . . 85.0 109.372 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 62.5 26.67 15.86 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 120.729 -1.232 . . . . 85.0 113.263 173.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 58.4 m -82.85 147.1 28.53 Favored 'General case' 0 C--O 1.212 -0.871 0 O-C-N 120.023 -1.673 . . . . 85.0 108.397 175.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.8 m -104.35 126.72 51.69 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 118.672 -2.518 . . . . 85.0 111.546 -177.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 32.0 mt -104.09 137.88 41.4 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 119.61 -1.931 . . . . 85.0 107.998 171.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -98.67 122.4 41.84 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 119.649 -1.907 . . . . 85.0 108.093 175.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 32.9 tp -87.14 130.73 34.4 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.955 0.902 . . . . 85.0 112.038 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.4 m -139.45 155.56 25.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 119.991 -1.693 . . . . 85.0 108.562 172.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -91.96 161.85 14.63 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 119.852 -1.78 . . . . 85.0 111.845 -166.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 67.1 mtp85 -120.25 100.0 6.92 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.122 -1.436 . . . . 85.0 107.122 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 58.9 mt . . . . . 0 N--CA 1.467 0.405 0 C-N-CA 124.614 1.166 . . . . 85.0 112.241 173.063 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' LEU . . . . . . . . . . . . . 1.4 tp . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 108.748 -0.834 . . . . 85.0 108.748 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -157.99 118.44 3.39 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 120.093 -1.63 . . . . 85.0 110.779 -174.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 33.0 pt -122.08 153.02 26.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 O-C-N 120.502 -1.374 . . . . 85.0 108.654 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -95.38 163.13 13.37 Favored 'General case' 0 C--N 1.329 -0.288 0 O-C-N 120.512 -1.368 . . . . 85.0 109.928 177.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 55.1 t -146.19 105.59 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 O-C-N 119.687 -1.883 . . . . 85.0 110.691 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LYS . . . . . 1.07 ' HE3' ' NE2' ' B' ' 68' ' ' HIS . 13.4 ttmm -65.42 108.63 2.03 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 119.61 -1.931 . . . . 85.0 108.827 175.273 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 17.9 p -79.56 -173.31 3.69 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 119.388 -2.07 . . . . 85.0 111.574 -175.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 23.3 mt -71.26 -3.65 21.54 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 120.356 -1.465 . . . . 85.0 112.582 -177.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' THR . . . . . 0.5 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -107.02 -4.55 18.87 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.334 -1.479 . . . . 85.0 110.431 -178.894 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.28 -24.53 18.72 Favored Glycine 0 N--CA 1.47 0.93 0 O-C-N 119.512 -1.992 . . . . 85.0 110.667 -172.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 37.6 tttt -55.07 148.85 13.04 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.645 1.578 . . . . 85.0 110.03 169.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 48.3 m -123.56 108.45 12.63 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.456 -1.403 . . . . 85.0 111.419 -179.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 30.1 pt -82.96 138.42 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 O-C-N 119.475 -2.016 . . . . 85.0 113.009 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 92.4 m -79.16 125.25 29.19 Favored 'General case' 0 CA--C 1.508 -0.645 0 O-C-N 120.686 -1.259 . . . . 85.0 108.699 172.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.7 mp -107.5 126.98 53.2 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 120.705 -1.247 . . . . 85.0 110.724 175.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -86.8 117.73 25.74 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 106.672 -1.603 . . . . 85.0 106.672 169.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 17.0 m -131.22 168.6 23.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 O-C-N 120.395 -1.441 . . . . 85.0 114.681 -176.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -108.09 144.56 29.64 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 106.58 -1.637 . . . . 85.0 106.58 176.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.75 -12.48 35.37 Favored 'Trans proline' 0 C--O 1.238 0.48 0 C-N-CA 122.288 1.992 . . . . 85.0 114.516 -178.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 52.3 m -113.11 26.48 10.43 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 120.183 -1.573 . . . . 85.0 109.899 171.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -76.12 139.1 41.16 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 119.851 -1.781 . . . . 85.0 106.889 172.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 70.1 p -79.81 163.12 24.66 Favored 'General case' 0 CA--C 1.508 -0.668 0 O-C-N 119.547 -1.971 . . . . 85.0 109.656 -178.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 13.6 mm -59.25 -41.26 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.824 0 N-CA-C 104.757 -2.312 . . . . 85.0 104.757 174.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.15 -39.43 69.48 Favored 'General case' 0 C--O 1.218 -0.558 0 O-C-N 120.267 -1.521 . . . . 85.0 110.067 176.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 -63.71 -38.8 92.47 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 119.155 -2.215 . . . . 85.0 110.443 176.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 42.7 t -66.14 -44.33 91.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 O-C-N 119.752 -1.842 . . . . 85.0 112.332 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -58.86 -39.51 81.56 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 120.818 -1.176 . . . . 85.0 110.811 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -75.48 -21.62 57.91 Favored 'General case' 0 C--O 1.239 0.509 0 O-C-N 120.265 -1.522 . . . . 85.0 111.87 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -71.53 -53.95 12.14 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 106.628 -1.619 . . . . 85.0 106.628 171.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 57.1 mt -50.75 -37.87 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 O-C-N 120.414 -1.429 . . . . 85.0 112.195 172.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -65.38 -37.76 87.98 Favored 'General case' 0 C--O 1.239 0.514 0 O-C-N 120.209 -1.557 . . . . 85.0 112.843 -179.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -71.29 -37.04 71.88 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 119.753 -1.842 . . . . 85.0 109.349 175.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -76.77 -63.57 1.32 Allowed 'General case' 0 CA--C 1.529 0.138 0 O-C-N 120.872 -1.142 . . . . 85.0 110.501 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -87.86 -30.27 20.28 Favored 'General case' 0 C--O 1.253 1.256 0 O-C-N 119.929 -1.732 . . . . 85.0 112.806 -174.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 96.5 6.15 58.67 Favored Glycine 0 N--CA 1.485 1.9 0 O-C-N 120.715 -1.241 . . . . 85.0 113.332 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 14.5 mt -86.39 115.06 60.72 Favored Pre-proline 0 N--CA 1.451 -0.402 0 O-C-N 120.108 -1.819 . . . . 85.0 106.549 -177.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -50.63 140.0 37.66 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 120.05 0.5 . . . . 85.0 111.168 177.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -44.16 -50.26 7.86 Favored 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 121.5 1.467 . . . . 85.0 114.573 174.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -70.78 -11.0 60.68 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 122.714 2.506 . . . . 85.0 112.945 -177.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -84.37 -3.28 58.2 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 121.597 1.999 . . . . 85.0 112.876 165.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -99.81 146.63 26.37 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 118.952 -2.343 . . . . 85.0 111.215 -177.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 13.0 ttm105 -129.21 134.75 48.14 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 107.226 -1.398 . . . . 85.0 107.226 160.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 40.5 mt -114.94 130.9 57.01 Favored 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 119.869 -1.769 . . . . 85.0 110.523 -174.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.6 mm -116.38 132.64 65.4 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 O-C-N 121.058 -1.026 . . . . 85.0 109.466 -175.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -130.8 115.94 17.29 Favored 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 119.939 -1.726 . . . . 85.0 108.271 169.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.92 51.22 16.94 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.267 -0.896 . . . . 85.0 111.775 173.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.15 -36.89 2.37 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 119.71 -1.869 . . . . 85.0 114.6 -178.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -75.81 129.65 37.37 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-N 121.882 2.841 . . . . 85.0 110.385 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -75.08 132.71 41.46 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 107.387 -1.338 . . . . 85.0 107.387 169.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 43.6 mt -84.36 143.59 29.38 Favored 'General case' 0 CA--C 1.498 -1.051 0 O-C-N 120.521 -1.362 . . . . 85.0 107.605 -175.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -112.23 133.56 54.29 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 119.641 -1.912 . . . . 85.0 109.472 -171.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -39.42 -50.49 2.1 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.802 1.241 . . . . 85.0 113.555 -169.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.64 -22.1 77.69 Favored Glycine 0 CA--C 1.534 1.224 0 O-C-N 119.472 -2.018 . . . . 85.0 117.65 -173.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -84.83 172.42 11.45 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 122.062 2.931 . . . . 85.0 109.655 -174.64 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 64.8 p -110.75 164.92 12.27 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 121.036 -1.04 . . . . 85.0 112.391 -174.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 mt -55.74 -44.39 77.52 Favored 'General case' 0 C--O 1.245 0.851 0 O-C-N 120.803 -1.186 . . . . 85.0 111.242 178.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 1.3 t -49.34 -50.55 39.26 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 120.86 -1.15 . . . . 85.0 111.549 169.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -54.41 -27.2 35.2 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 120.588 -1.32 . . . . 85.0 111.922 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -104.77 4.63 32.53 Favored 'General case' 0 C--O 1.239 0.508 0 O-C-N 119.598 -1.939 . . . . 85.0 111.51 177.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 61.67 56.18 2.54 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 120.107 -1.621 . . . . 85.0 108.149 174.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 22.4 mt -110.84 87.68 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 O-C-N 120.014 -1.679 . . . . 85.0 108.927 -177.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -82.05 -169.9 2.61 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 119.971 -1.706 . . . . 85.0 112.038 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.79 157.53 37.73 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 119.141 -2.224 . . . . 85.0 114.03 -168.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 63.37 4.84 1.82 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 125.451 1.5 . . . . 85.0 110.221 -174.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.9 m -63.29 164.97 8.08 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 119.885 -1.759 . . . . 85.0 109.273 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 10.4 m -141.79 125.17 16.56 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 119.847 -1.783 . . . . 85.0 112.553 -168.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 12.8 mt -112.04 121.43 44.96 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 120.898 -1.126 . . . . 85.0 109.924 -175.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' HIS . . . . . 1.07 ' NE2' ' HE3' ' B' ' 6' ' ' LYS . 58.5 m80 -76.38 124.08 26.98 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 107.154 -1.425 . . . . 85.0 107.154 172.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 22.0 tp -88.83 129.52 35.57 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 119.868 -1.77 . . . . 85.0 111.236 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 89.7 t -113.53 144.75 20.52 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.339 0 O-C-N 120.128 -1.607 . . . . 85.0 109.747 175.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 14.3 tp -79.93 128.3 33.3 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 119.464 -2.023 . . . . 85.0 109.817 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -92.93 148.37 22.07 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 120.144 -1.598 . . . . 85.0 108.952 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 39.9 mt . . . . . 0 CA--C 1.55 0.977 0 O-C-N 119.356 -2.09 . . . . 85.0 114.409 -165.11 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 300' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 400' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 600' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 700' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 800' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.8 tp . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 120.536 0.208 . . . . 85.0 110.802 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -131.59 139.01 49.07 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 120.777 -1.202 . . . . 85.0 107.846 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 19.1 pt -134.43 161.93 39.77 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 O-C-N 119.114 -2.241 . . . . 85.0 109.739 174.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -104.49 141.92 35.52 Favored 'General case' 0 N--CA 1.444 -0.742 0 O-C-N 120.163 -1.586 . . . . 85.0 110.813 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 37.6 t -118.78 118.21 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 O-C-N 120.147 -1.596 . . . . 85.0 108.616 173.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -84.17 126.01 32.72 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.892 -1.13 . . . . 85.0 110.15 178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.3 p -85.97 160.82 19.26 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 120.709 -1.244 . . . . 85.0 109.962 173.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.52 -39.15 22.33 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.575 1.15 . . . . 85.0 110.523 164.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.8 p -54.7 -31.54 58.16 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.053 -1.654 . . . . 85.0 110.259 177.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.3 -23.1 31.22 Favored Glycine 0 C--N 1.342 0.862 0 N-CA-C 108.503 -1.839 . . . . 85.0 108.503 -168.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -66.33 142.05 57.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.245 -1.738 . . . . 85.0 108.958 -169.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.2 m -109.32 129.57 55.52 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 120.934 -1.103 . . . . 85.0 108.958 -170.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.0 pt -119.54 122.02 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.28 0 O-C-N 120.784 -1.197 . . . . 85.0 108.62 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . 0.429 ' O ' HD12 ' A' ' 15' ' ' LEU . 64.2 p -71.4 147.13 48.24 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 120.749 -1.219 . . . . 85.0 108.902 172.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.429 HD12 ' O ' ' A' ' 14' ' ' THR . 5.0 mp -130.65 129.77 43.07 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 120.612 -1.305 . . . . 85.0 108.885 176.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -85.43 117.32 24.28 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 106.098 -1.816 . . . . 85.0 106.098 172.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.1 m -130.12 144.45 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.596 0 O-C-N 120.74 -1.225 . . . . 85.0 109.565 -175.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -76.81 152.73 82.94 Favored Pre-proline 0 CA--C 1.542 0.652 0 N-CA-C 104.645 -2.354 . . . . 85.0 104.645 167.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.38 -26.11 20.86 Favored 'Trans proline' 0 C--N 1.325 -0.691 0 C-N-CA 121.717 1.611 . . . . 85.0 113.475 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -93.15 15.06 16.15 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 119.443 -2.036 . . . . 85.0 110.933 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -68.36 138.26 55.25 Favored 'General case' 0 CA--C 1.518 -0.258 0 O-C-N 119.138 -2.226 . . . . 85.0 106.128 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.9 p -76.02 165.06 25.5 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.276 -1.515 . . . . 85.0 110.859 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 25.8 mm -61.54 -32.21 52.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 O-C-N 119.821 -1.799 . . . . 85.0 109.877 175.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.588 ' OE1' ' N ' ' A' ' 53' ' ' GLY . 3.5 mp0 -58.09 -50.33 73.84 Favored 'General case' 0 CA--C 1.504 -0.799 0 O-C-N 119.127 -2.233 . . . . 85.0 109.059 172.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -53.28 -41.78 65.89 Favored 'General case' 0 N--CA 1.441 -0.899 0 O-C-N 120.598 -1.314 . . . . 85.0 108.387 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 67.2 t -64.15 -50.27 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 O-C-N 120.083 -1.635 . . . . 85.0 110.784 175.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -57.91 -40.29 80.03 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 118.826 -2.421 . . . . 85.0 110.823 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.11 -23.67 62.15 Favored 'General case' 0 C--N 1.32 -0.709 0 O-C-N 119.289 -2.132 . . . . 85.0 110.771 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -70.25 -38.05 75.07 Favored 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 119.752 -1.843 . . . . 85.0 108.19 173.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 91.8 mt -71.84 -45.95 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 125.076 1.35 . . . . 85.0 109.674 178.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -34.56 -52.17 0.5 Allowed 'General case' 0 C--O 1.222 -0.364 0 O-C-N 120.125 -1.61 . . . . 85.0 109.4 161.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -61.08 -67.96 0.35 Allowed 'General case' 0 C--O 1.213 -0.841 0 O-C-N 119.667 -1.895 . . . . 85.0 111.392 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -71.12 -26.39 63.0 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 118.27 -2.769 . . . . 85.0 112.386 -163.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -110.42 -52.67 2.76 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.723 -1.236 . . . . 85.0 112.947 -178.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.89 46.12 1.22 Allowed Glycine 0 CA--C 1.542 1.727 0 O-C-N 126.016 2.073 . . . . 85.0 111.552 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 8.6 mt -117.54 109.53 41.76 Favored Pre-proline 0 C--O 1.246 0.897 0 N-CA-C 108.481 -0.933 . . . . 85.0 108.481 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_exo -47.73 123.94 9.04 Favored 'Trans proline' 0 N--CA 1.462 -0.343 0 C-N-CA 121.387 1.391 . . . . 85.0 114.081 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -38.38 -31.31 0.2 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.403 2.069 . . . . 85.0 114.456 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -65.08 -33.31 75.72 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 120.669 -1.269 . . . . 85.0 110.969 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -85.57 -10.46 55.87 Favored 'General case' 0 CA--C 1.511 -0.546 0 O-C-N 119.442 -2.036 . . . . 85.0 111.269 176.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -82.54 137.29 34.63 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 119.783 -1.823 . . . . 85.0 110.171 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.0 ttm-85 -130.04 117.06 19.44 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.156 -1.794 . . . . 85.0 106.156 165.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.9 mt -98.48 145.55 26.66 Favored 'General case' 0 CA--C 1.511 -0.519 0 O-C-N 120.09 -1.631 . . . . 85.0 111.246 -178.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 5.2 mm -126.19 140.09 49.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 120.842 -1.161 . . . . 85.0 111.331 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -134.85 118.5 17.04 Favored 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 119.703 -1.873 . . . . 85.0 108.556 176.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 43.03 55.6 4.43 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 120.597 1.544 . . . . 85.0 108.767 -173.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.54 -27.42 1.06 Allowed Glycine 0 N--CA 1.468 0.811 0 O-C-N 120.186 -1.571 . . . . 85.0 114.807 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -72.48 117.01 13.62 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 120.284 2.042 . . . . 85.0 109.457 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.5 ' HB3' HG23 ' B' ' 9' ' ' THR . 53.4 tt0 -68.91 114.7 7.46 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 120.313 -1.492 . . . . 85.0 108.141 170.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 65.8 mt -73.8 147.25 43.58 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 120.434 -1.416 . . . . 85.0 112.432 -175.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -109.14 129.82 55.48 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.341 -1.475 . . . . 85.0 111.388 -172.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -35.73 138.75 0.15 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 120.45 1.477 . . . . 85.0 109.685 166.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.588 ' N ' ' OE1' ' A' ' 24' ' ' GLU . . . 96.43 -41.84 2.33 Favored Glycine 0 C--O 1.225 -0.462 0 O-C-N 118.251 -2.781 . . . . 85.0 114.235 170.258 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -71.93 153.21 41.98 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 121.502 2.651 . . . . 85.0 108.293 167.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 71.7 p -101.51 162.21 13.07 Favored 'General case' 0 CA--C 1.517 -0.326 0 O-C-N 118.917 -2.365 . . . . 85.0 112.897 -175.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 92.3 mt -44.13 -47.5 9.02 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 119.82 -1.8 . . . . 85.0 109.789 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.4 p -66.6 -33.47 75.73 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.386 -1.446 . . . . 85.0 111.268 -175.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -57.49 -44.19 84.74 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 120.901 1.682 . . . . 85.0 108.508 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -87.69 10.8 16.97 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 118.72 -2.487 . . . . 85.0 112.324 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 56.63 39.58 29.72 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 119.998 -1.689 . . . . 85.0 112.311 179.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 56.2 mt -84.47 131.62 33.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 O-C-N 119.489 -2.007 . . . . 85.0 106.536 173.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -131.45 -176.4 4.02 Favored 'General case' 0 CA--C 1.485 -1.548 0 O-C-N 119.931 -1.731 . . . . 85.0 111.461 -169.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -47.97 134.66 13.41 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 120.782 -1.199 . . . . 85.0 109.372 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 62.5 26.67 15.86 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 120.729 -1.232 . . . . 85.0 113.263 173.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 58.4 m -82.85 147.1 28.53 Favored 'General case' 0 C--O 1.212 -0.871 0 O-C-N 120.023 -1.673 . . . . 85.0 108.397 175.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.8 m -104.35 126.72 51.69 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 118.672 -2.518 . . . . 85.0 111.546 -177.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 32.0 mt -104.09 137.88 41.4 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 119.61 -1.931 . . . . 85.0 107.998 171.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -98.67 122.4 41.84 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 119.649 -1.907 . . . . 85.0 108.093 175.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 32.9 tp -87.14 130.73 34.4 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.955 0.902 . . . . 85.0 112.038 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.4 m -139.45 155.56 25.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 119.991 -1.693 . . . . 85.0 108.562 172.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -91.96 161.85 14.63 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 119.852 -1.78 . . . . 85.0 111.845 -166.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 67.1 mtp85 -120.25 100.0 6.92 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.122 -1.436 . . . . 85.0 107.122 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 58.9 mt . . . . . 0 N--CA 1.467 0.405 0 C-N-CA 124.614 1.166 . . . . 85.0 112.241 173.063 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' LEU . . . . . . . . . . . . . 1.4 tp . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 108.748 -0.834 . . . . 85.0 108.748 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -157.99 118.44 3.39 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 120.093 -1.63 . . . . 85.0 110.779 -174.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 33.0 pt -122.08 153.02 26.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 O-C-N 120.502 -1.374 . . . . 85.0 108.654 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -95.38 163.13 13.37 Favored 'General case' 0 C--N 1.329 -0.288 0 O-C-N 120.512 -1.368 . . . . 85.0 109.928 177.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 55.1 t -146.19 105.59 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 O-C-N 119.687 -1.883 . . . . 85.0 110.691 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LYS . . . . . 1.27 ' HE3' ' CE1' ' B' ' 68' ' ' HIS . 13.4 ttmm -65.42 108.63 2.03 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 119.61 -1.931 . . . . 85.0 108.827 175.273 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 17.9 p -79.56 -173.31 3.69 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 119.388 -2.07 . . . . 85.0 111.574 -175.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 23.3 mt -71.26 -3.65 21.54 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 120.356 -1.465 . . . . 85.0 112.582 -177.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' THR . . . . . 0.5 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -107.02 -4.55 18.87 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.334 -1.479 . . . . 85.0 110.431 -178.894 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.28 -24.53 18.72 Favored Glycine 0 N--CA 1.47 0.93 0 O-C-N 119.512 -1.992 . . . . 85.0 110.667 -172.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 37.6 tttt -55.07 148.85 13.04 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.645 1.578 . . . . 85.0 110.03 169.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 48.3 m -123.56 108.45 12.63 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.456 -1.403 . . . . 85.0 111.419 -179.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 30.1 pt -82.96 138.42 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 O-C-N 119.475 -2.016 . . . . 85.0 113.009 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 92.4 m -79.16 125.25 29.19 Favored 'General case' 0 CA--C 1.508 -0.645 0 O-C-N 120.686 -1.259 . . . . 85.0 108.699 172.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.7 mp -107.5 126.98 53.2 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 120.705 -1.247 . . . . 85.0 110.724 175.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -86.8 117.73 25.74 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 106.672 -1.603 . . . . 85.0 106.672 169.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 17.0 m -131.22 168.6 23.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 O-C-N 120.395 -1.441 . . . . 85.0 114.681 -176.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -108.09 144.56 29.64 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 106.58 -1.637 . . . . 85.0 106.58 176.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.75 -12.48 35.37 Favored 'Trans proline' 0 C--O 1.238 0.48 0 C-N-CA 122.288 1.992 . . . . 85.0 114.516 -178.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 52.3 m -113.11 26.48 10.43 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 120.183 -1.573 . . . . 85.0 109.899 171.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -76.12 139.1 41.16 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 119.851 -1.781 . . . . 85.0 106.889 172.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 70.1 p -79.81 163.12 24.66 Favored 'General case' 0 CA--C 1.508 -0.668 0 O-C-N 119.547 -1.971 . . . . 85.0 109.656 -178.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 13.6 mm -59.25 -41.26 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.824 0 N-CA-C 104.757 -2.312 . . . . 85.0 104.757 174.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.15 -39.43 69.48 Favored 'General case' 0 C--O 1.218 -0.558 0 O-C-N 120.267 -1.521 . . . . 85.0 110.067 176.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 -63.71 -38.8 92.47 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 119.155 -2.215 . . . . 85.0 110.443 176.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 42.7 t -66.14 -44.33 91.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 O-C-N 119.752 -1.842 . . . . 85.0 112.332 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -58.86 -39.51 81.56 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 120.818 -1.176 . . . . 85.0 110.811 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -75.48 -21.62 57.91 Favored 'General case' 0 C--O 1.239 0.509 0 O-C-N 120.265 -1.522 . . . . 85.0 111.87 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -71.53 -53.95 12.14 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 106.628 -1.619 . . . . 85.0 106.628 171.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 57.1 mt -50.75 -37.87 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 O-C-N 120.414 -1.429 . . . . 85.0 112.195 172.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.38 -37.76 87.98 Favored 'General case' 0 C--O 1.239 0.514 0 O-C-N 120.209 -1.557 . . . . 85.0 112.843 -179.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -71.29 -37.04 71.88 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 119.753 -1.842 . . . . 85.0 109.349 175.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 tppt? -76.77 -63.57 1.32 Allowed 'General case' 0 CA--C 1.529 0.138 0 O-C-N 120.872 -1.142 . . . . 85.0 110.501 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -87.86 -30.27 20.28 Favored 'General case' 0 C--O 1.253 1.256 0 O-C-N 119.929 -1.732 . . . . 85.0 112.806 -174.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 96.5 6.15 58.67 Favored Glycine 0 N--CA 1.485 1.9 0 O-C-N 120.715 -1.241 . . . . 85.0 113.332 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 14.5 mt -86.39 115.06 60.72 Favored Pre-proline 0 N--CA 1.451 -0.402 0 O-C-N 120.108 -1.819 . . . . 85.0 106.549 -177.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -50.63 140.0 37.66 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 120.05 0.5 . . . . 85.0 111.168 177.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -44.16 -50.26 7.86 Favored 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 121.5 1.467 . . . . 85.0 114.573 174.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -70.78 -11.0 60.68 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 122.714 2.506 . . . . 85.0 112.945 -177.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -84.37 -3.28 58.2 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 121.597 1.999 . . . . 85.0 112.876 165.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -99.81 146.63 26.37 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 118.952 -2.343 . . . . 85.0 111.215 -177.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 13.0 ttm105 -129.21 134.75 48.14 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 107.226 -1.398 . . . . 85.0 107.226 160.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 40.5 mt -114.94 130.9 57.01 Favored 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 119.869 -1.769 . . . . 85.0 110.523 -174.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.6 mm -116.38 132.64 65.4 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 O-C-N 121.058 -1.026 . . . . 85.0 109.466 -175.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -130.8 115.94 17.29 Favored 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 119.939 -1.726 . . . . 85.0 108.271 169.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.92 51.22 16.94 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.267 -0.896 . . . . 85.0 111.775 173.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.15 -36.89 2.37 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 119.71 -1.869 . . . . 85.0 114.6 -178.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -75.81 129.65 37.37 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-N 121.882 2.841 . . . . 85.0 110.385 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -75.08 132.71 41.46 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 107.387 -1.338 . . . . 85.0 107.387 169.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 43.6 mt -84.36 143.59 29.38 Favored 'General case' 0 CA--C 1.498 -1.051 0 O-C-N 120.521 -1.362 . . . . 85.0 107.605 -175.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -112.23 133.56 54.29 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 119.641 -1.912 . . . . 85.0 109.472 -171.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -39.42 -50.49 2.1 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.802 1.241 . . . . 85.0 113.555 -169.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.64 -22.1 77.69 Favored Glycine 0 CA--C 1.534 1.224 0 O-C-N 119.472 -2.018 . . . . 85.0 117.65 -173.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -84.83 172.42 11.45 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 122.062 2.931 . . . . 85.0 109.655 -174.64 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 64.8 p -110.75 164.92 12.27 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 121.036 -1.04 . . . . 85.0 112.391 -174.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 mt -55.74 -44.39 77.52 Favored 'General case' 0 C--O 1.245 0.851 0 O-C-N 120.803 -1.186 . . . . 85.0 111.242 178.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 1.3 t -49.34 -50.55 39.26 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 120.86 -1.15 . . . . 85.0 111.549 169.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -54.41 -27.2 35.2 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 120.588 -1.32 . . . . 85.0 111.922 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -104.77 4.63 32.53 Favored 'General case' 0 C--O 1.239 0.508 0 O-C-N 119.598 -1.939 . . . . 85.0 111.51 177.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 61.67 56.18 2.54 Favored 'General case' 0 N--CA 1.451 -0.375 0 O-C-N 120.107 -1.621 . . . . 85.0 108.149 174.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 22.4 mt -110.84 87.68 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 O-C-N 120.014 -1.679 . . . . 85.0 108.927 -177.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -82.05 -169.9 2.61 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 119.971 -1.706 . . . . 85.0 112.038 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.79 157.53 37.73 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 119.141 -2.224 . . . . 85.0 114.03 -168.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 63.37 4.84 1.82 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 125.451 1.5 . . . . 85.0 110.221 -174.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.9 m -63.29 164.97 8.08 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 119.885 -1.759 . . . . 85.0 109.273 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 10.4 m -141.79 125.17 16.56 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 119.847 -1.783 . . . . 85.0 112.553 -168.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 12.8 mt -112.04 121.43 44.96 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 120.898 -1.126 . . . . 85.0 109.924 -175.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' HIS . . . . . 1.27 ' CE1' ' HE3' ' B' ' 6' ' ' LYS . 39.4 m-70 -76.38 124.08 26.98 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 107.154 -1.425 . . . . 85.0 107.154 172.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 22.0 tp -88.83 129.52 35.57 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 119.868 -1.77 . . . . 85.0 111.236 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 89.7 t -113.53 144.75 20.52 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.339 0 O-C-N 120.128 -1.607 . . . . 85.0 109.747 175.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 14.3 tp -79.93 128.3 33.3 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 119.464 -2.023 . . . . 85.0 109.817 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -92.93 148.37 22.07 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 120.144 -1.598 . . . . 85.0 108.952 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 39.9 mt . . . . . 0 CA--C 1.55 0.977 0 O-C-N 119.356 -2.09 . . . . 85.0 114.409 -165.11 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 600' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 700' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 800' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_