data_2ay0_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 2ay0 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.6 m . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 120.841 0.353 . . . . 45.91 110.328 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.3 p -146.56 164.16 33.48 Favored 'General case' 0 C--O 1.247 0.936 0 N-CA-C 107.328 -1.36 . . . . 44.6 107.328 174.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.8 m -119.23 126.91 52.64 Favored 'General case' 0 C--O 1.213 -0.834 0 C-N-CA 120.734 -0.387 . . . . 42.96 110.835 -177.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 31.1 ttm -111.34 148.3 33.28 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.018 -1.104 . . . . 43.0 108.018 179.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -84.05 146.35 22.96 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.956 -0.858 . . . . 39.89 110.956 174.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.1 p -128.73 121.87 55.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 108.2 -1.037 . . . . 41.05 108.2 169.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 79.3 mtp -85.28 123.74 31.11 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.112 -0.495 . . . . 37.22 110.094 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.2 mt -128.27 130.04 47.27 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 124.078 0.862 . . . . 41.46 111.815 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 43.7 p30 -74.55 165.47 25.15 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 109.33 -0.619 . . . . 39.35 109.33 170.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -62.86 -39.57 94.83 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.028 -0.533 . . . . 40.03 111.519 -173.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.97 -45.75 89.77 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.452 0.644 . . . . 36.4 112.701 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 87.8 m -67.16 -43.25 82.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.096 -0.502 . . . . 37.49 109.745 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -61.59 -39.75 92.3 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 112.834 0.679 . . . . 50.15 112.834 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -64.63 -45.53 86.43 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 111.506 0.187 . . . . 45.64 111.506 176.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -52.14 -49.64 63.32 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 123.132 0.573 . . . . 47.05 111.094 173.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 91.3 mt -60.14 -53.42 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.192 0 O-C-N 123.776 0.672 . . . . 40.75 110.217 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . . . -58.54 -43.45 89.28 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 119.906 -0.718 . . . . 41.14 111.68 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.9 m -65.36 -47.95 74.65 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 118.126 0.421 . . . . 41.7 112.072 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.09 -44.46 91.93 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.348 0.594 . . . . 39.59 111.745 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.81 -41.35 83.25 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.586 -0.733 . . . . 39.33 110.978 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.9 m -60.56 -41.73 95.16 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 111.989 0.366 . . . . 41.66 111.989 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.36 -32.75 26.81 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 113.322 0.86 . . . . 54.34 113.322 176.019 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 37.9 pt -113.2 21.78 5.96 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.619 0 N-CA-C 112.986 0.736 . . . . 41.18 112.986 -175.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 38.2 t0 53.33 45.03 29.27 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 113.804 1.038 . . . . 38.32 113.804 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 90.2 mmt-85 -130.39 176.91 7.75 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.85 -0.796 . . . . 39.33 108.85 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -106.59 159.13 30.92 Favored Pre-proline 0 N--CA 1.447 -0.583 0 CA-C-N 115.863 -0.608 . . . . 38.65 111.386 -178.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -46.11 -47.93 13.78 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.843 2.362 . . . . 39.14 114.434 169.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 56.8 m-70 -57.93 -42.43 84.82 Favored 'General case' 0 C--O 1.245 0.84 0 N-CA-C 112.972 0.73 . . . . 38.46 112.972 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 72.3 t90 -58.93 -50.57 73.54 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 108.044 -1.095 . . . . 39.25 108.044 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -57.85 -46.63 84.52 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.582 0.753 . . . . 49.19 112.772 -176.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.94 -43.57 97.69 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 CA-C-N 115.471 -0.786 . . . . 41.6 111.398 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -64.29 -41.65 96.78 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 119.745 -0.782 . . . . 39.89 110.268 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -57.03 -44.18 82.66 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 112.538 0.57 . . . . 45.82 112.538 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.19 -44.2 97.67 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 120.942 0.401 . . . . 38.02 111.976 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.2 mt -62.92 -47.81 91.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.512 0.673 . . . . 39.42 110.368 -178.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -67.88 -42.94 80.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 114.278 1.214 . . . . 47.28 114.278 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.2 t -53.31 -45.07 68.84 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 121.32 0.581 . . . . 42.81 111.554 170.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -65.2 -44.44 88.34 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.202 0.445 . . . . 43.61 112.202 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 79.7 mt -62.5 -39.78 94.59 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.027 0.204 . . . . 42.74 110.548 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -66.29 -38.78 88.56 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.12 -0.491 . . . . 46.62 112.163 -179.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . . . -67.09 -37.86 84.68 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.226 0.824 . . . . 49.07 113.226 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . 0.456 ' O ' ' CB ' ' A' ' 45' ' ' GLU . 98.2 mt -67.6 75.48 0.18 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 110.527 -0.175 . . . . 52.41 110.527 172.603 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . 0.456 ' CB ' ' O ' ' A' ' 44' ' ' LEU . 6.0 pt-20 . . . . . 0 N--CA 1.477 0.9 0 C-N-CA 125.788 1.635 . . . . 56.13 108.659 -172.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 112.104 0.409 . . . . 49.26 112.104 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 42.8 p -144.49 166.52 24.91 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 108.632 -0.877 . . . . 47.21 108.632 174.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 61.9 m -119.91 121.8 39.82 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.495 -0.558 . . . . 44.15 109.495 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 56.7 mtp -101.13 151.56 21.68 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 124.077 0.861 . . . . 42.89 109.905 172.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.51 142.01 18.43 Favored Glycine 0 C--N 1.331 0.291 0 N-CA-C 111.044 -0.822 . . . . 40.06 111.044 175.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 15.3 t -119.18 119.28 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 123.894 0.878 . . . . 39.56 108.908 170.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' MET . . . . . . . . . . . . . 97.3 mtp -85.24 126.33 33.6 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.249 -0.649 . . . . 38.11 109.249 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 80.2 mt -126.88 126.14 42.78 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.65 0.78 . . . . 41.01 110.992 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.26 155.53 39.41 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.275 -1.38 . . . . 45.68 107.275 171.569 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -63.37 -33.27 75.16 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.73 1.011 . . . . 43.28 113.73 -167.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.03 -43.09 95.54 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.645 0.609 . . . . 38.36 112.645 175.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 25.6 m -68.15 -41.66 81.25 Favored 'General case' 0 C--O 1.217 -0.643 0 CA-C-O 121.348 0.594 . . . . 39.06 110.492 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 35.0 ttt180 -63.01 -41.17 99.5 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.832 -0.622 . . . . 52.63 111.774 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -63.27 -41.2 98.99 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.272 0.558 . . . . 48.74 111.413 175.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 29.2 ttm-85 -59.8 -50.05 75.34 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.42 -0.809 . . . . 48.03 111.423 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 54.4 mt -57.83 -46.7 87.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.39 0.614 . . . . 41.69 110.804 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . . . -62.99 -40.25 97.2 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.674 -0.694 . . . . 44.5 110.734 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 22.5 t -69.15 -43.04 75.13 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 112.244 0.461 . . . . 39.35 112.244 179.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.01 -38.74 86.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.723 0.773 . . . . 38.62 110.694 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.59 -50.22 39.5 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 121.603 -0.686 . . . . 40.78 110.599 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 37.5 p -58.67 -39.9 81.99 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.676 0.621 . . . . 42.12 112.676 -174.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . . . -64.05 -17.4 63.33 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 114.71 1.374 . . . . 42.22 114.71 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 29.9 pt -116.94 23.01 5.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 123.755 0.659 . . . . 39.3 111.271 176.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 61.92 33.41 17.48 Favored 'General case' 0 C--O 1.254 1.331 0 N-CA-C 113.971 1.1 . . . . 39.86 113.971 173.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 84.9 mmt-85 -124.05 179.83 4.7 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 115.44 -0.8 . . . . 40.36 111.158 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.7 p -116.06 159.14 40.59 Favored Pre-proline 0 N--CA 1.473 0.713 0 CA-C-N 116.117 -0.492 . . . . 41.1 110.919 -175.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -49.01 -46.61 24.61 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 120.768 0.979 . . . . 40.53 114.628 169.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -60.56 -39.21 87.17 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 119.541 1.064 . . . . 39.17 113.106 178.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -59.32 -47.58 84.87 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.754 -0.657 . . . . 38.81 109.891 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.79 -41.13 99.13 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.795 0.807 . . . . 45.41 111.989 -175.784 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 69.7 mt -68.87 -41.3 82.04 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-N 114.904 -1.044 . . . . 42.23 109.082 -175.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' LYS . . . . . 0.507 ' NZ ' ' O ' ' C' ' 64' ' ' HOH . 13.2 mmmm -64.41 -42.96 95.79 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 119.076 -1.05 . . . . 44.75 110.013 175.041 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -54.45 -48.97 71.11 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.812 0.671 . . . . 42.46 112.812 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.23 -52.49 58.75 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 124.135 0.897 . . . . 39.0 112.255 177.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 78.1 mt -60.43 -46.51 95.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 113.15 0.796 . . . . 39.93 113.15 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' PHE . . . . . 0.558 ' CD1' ' CD2' ' C' ' 38' ' ' PHE . 19.3 m-85 -69.1 -44.32 72.69 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 119.713 -0.795 . . . . 47.73 111.813 -178.448 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 12.7 t -51.78 -48.14 63.9 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 124.257 0.973 . . . . 44.36 110.53 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -61.96 -50.68 71.12 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.078 -0.51 . . . . 45.43 111.637 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.48 -35.46 81.0 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 111.792 0.293 . . . . 42.64 111.792 -178.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.42 -54.03 51.39 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.902 0.705 . . . . 48.35 112.902 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . . . -53.52 -30.8 43.37 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.441 0.696 . . . . 45.01 112.414 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 C--O 1.22 -0.454 0 N-CA-C 109.354 -0.61 . . . . 44.91 109.354 169.943 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 111.967 -0.453 . . . . 47.02 111.967 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' THR . . . . . . . . . . . . . 85.0 m -145.48 140.08 27.28 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.966 0.412 . . . . 47.5 111.717 178.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 55.8 p -124.68 159.17 31.43 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.391 -0.966 . . . . 45.21 108.391 172.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 70.4 m -117.38 119.35 34.85 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.695 0.283 . . . . 42.94 110.835 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' MET . . . . . . . . . . . . . 29.4 mtp -100.96 142.78 31.94 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.841 0.856 . . . . 42.82 109.875 173.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.48 140.78 17.66 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 111.837 -0.505 . . . . 42.08 111.837 176.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' VAL . . . . . . . . . . . . . 18.8 t -123.21 121.73 63.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.598 0 N-CA-C 108.408 -0.96 . . . . 42.72 108.408 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' MET . . . . . . . . . . . . . 30.1 mtm -84.37 122.81 29.46 Favored 'General case' 0 C--O 1.245 0.849 0 O-C-N 123.966 0.791 . . . . 40.42 109.502 177.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' LEU . . . . . . . . . . . . . 26.0 mt -127.53 129.45 47.39 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 124.163 0.915 . . . . 47.19 111.725 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 17.4 p30 -73.74 170.8 14.54 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 120.881 -0.328 . . . . 44.07 110.986 169.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ASP . . . . . 0.422 ' OD1' ' NH1' ' C' ' 15' ' ' ARG . 67.2 m-20 -58.72 -44.67 90.49 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.536 0.734 . . . . 42.51 112.899 -177.122 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.5 -44.5 96.97 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 112.529 0.566 . . . . 39.55 112.529 -179.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' THR . . . . . . . . . . . . . 34.1 m -63.84 -43.26 96.69 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-N 116.387 -0.37 . . . . 40.04 110.097 177.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' ARG . . . . . 0.422 ' NH1' ' OD1' ' C' ' 12' ' ' ASP . 18.3 mtm180 -60.22 -41.38 92.94 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.411 0.893 . . . . 51.7 113.411 177.217 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -65.87 -40.84 92.03 Favored 'General case' 0 C--O 1.223 -0.323 0 O-C-N 123.176 0.298 . . . . 46.08 111.042 176.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ARG . . . . . . . . . . . . . 60.6 mtp180 -60.58 -42.27 96.33 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.986 0.422 . . . . 50.26 112.117 176.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.09 -44.92 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-N 115.516 -0.765 . . . . 40.05 112.291 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -62.89 -44.65 95.53 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 109.302 -0.629 . . . . 38.11 109.302 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' SER . . . . . . . . . . . . . 16.8 m -60.37 -49.2 78.53 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.373 0.509 . . . . 39.22 112.373 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.12 -38.14 87.46 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 116.228 -0.442 . . . . 42.42 111.213 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.82 -40.99 92.37 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.695 0.759 . . . . 41.76 112.725 176.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 97.5 m -56.78 -46.78 81.29 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.64 -0.709 . . . . 41.43 110.754 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . . . -71.62 -27.52 63.17 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.834 1.05 . . . . 43.65 113.834 -175.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' ILE . . . . . . . . . . . . . 45.8 pt -95.39 3.34 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 114.009 1.114 . . . . 43.29 114.009 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 54.37 44.62 28.65 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.832 0.853 . . . . 45.99 112.239 -176.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' ARG . . . . . . . . . . . . . 90.0 mmt-85 -131.45 165.81 22.7 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.875 -0.787 . . . . 38.38 108.875 174.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' THR . . . . . . . . . . . . . 78.5 p -80.42 157.74 72.36 Favored Pre-proline 0 C--O 1.25 1.124 0 C-N-CA 120.574 -0.45 . . . . 39.56 112.195 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_exo -50.33 -42.24 48.4 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 121.428 1.419 . . . . 38.86 115.767 166.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' HIS . . . . . . . . . . . . . 58.5 m-70 -56.22 -45.54 79.88 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 118.658 0.663 . . . . 39.86 110.671 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -59.93 -45.48 92.48 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.858 -0.61 . . . . 40.13 110.654 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' LEU . . . . . . . . . . . . . 8.1 tt -62.6 -43.61 98.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.935 0.894 . . . . 48.88 112.169 -178.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.81 -42.67 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 CA-C-N 115.561 -0.745 . . . . 39.63 111.938 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -64.88 -44.23 90.34 Favored 'General case' 0 C--O 1.205 -1.262 0 C-N-CA 119.981 -0.688 . . . . 38.38 109.996 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -56.07 -45.7 79.22 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-O 121.116 0.484 . . . . 44.93 112.073 176.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.78 -45.03 78.27 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.648 -0.705 . . . . 37.04 111.686 175.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' ILE . . . . . . . . . . . . . 96.5 mt -64.25 -52.96 49.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 121.015 -0.274 . . . . 38.49 110.768 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' PHE . . . . . 0.558 ' CD2' ' CD1' ' B' ' 38' ' ' PHE . 20.8 m-85 -57.07 -46.83 82.18 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.104 0.478 . . . . 44.65 111.397 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' SER . . . . . . . . . . . . . 40.9 t -55.97 -46.13 78.71 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.008 0.744 . . . . 42.07 113.008 177.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -63.34 -43.46 97.67 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.157 -0.474 . . . . 40.64 110.84 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.76 -38.84 92.61 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 112.953 0.723 . . . . 40.19 112.953 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -63.08 -43.96 97.06 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 123.262 0.352 . . . . 47.97 110.842 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -60.17 -37.93 81.65 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.548 0.573 . . . . 51.68 112.548 176.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' LEU . . . . . . . . . . . . . 97.1 mt -68.93 -29.19 67.39 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.841 0.312 . . . . 48.81 111.841 174.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.995 0.426 . . . . 48.16 110.188 171.804 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' THR . . . . . . . . . . . . . 15.1 t . . . . . 0 N--CA 1.495 1.823 0 N-CA-C 112.02 0.378 . . . . 49.49 112.02 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 54.2 p -117.74 168.18 10.69 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.508 -0.553 . . . . 48.49 109.508 171.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' THR . . . . . . . . . . . . . 54.1 m -118.22 117.82 30.16 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.515 -0.55 . . . . 46.53 109.515 173.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' MET . . . . . . . . . . . . . 2.8 ptm -103.88 163.87 12.07 Favored 'General case' 0 CA--C 1.506 -0.717 0 C-N-CA 119.138 -1.025 . . . . 45.49 110.819 172.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' GLY . . . . . . . . . . . . . . . -98.14 137.99 13.61 Favored Glycine 0 N--CA 1.437 -1.234 0 N-CA-C 107.894 -2.082 . . . . 41.22 107.894 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' VAL . . . . . . . . . . . . . 51.8 t -117.3 117.74 56.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.165 -1.421 . . . . 41.36 107.165 172.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' MET . . . . . . . . . . . . . 89.3 mtp -80.81 130.3 34.99 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.131 -1.062 . . . . 36.87 108.131 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' LEU . . . . . . . . . . . . . 95.1 mt -130.51 125.52 34.51 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 109.374 -0.602 . . . . 39.02 109.374 -176.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.1 157.55 37.06 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 107.816 -1.179 . . . . 45.97 107.816 172.57 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -62.08 -38.0 87.16 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.577 0.954 . . . . 42.05 113.577 -170.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.03 -49.66 73.1 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.195 0.31 . . . . 39.53 110.981 173.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' THR . . . . . . . . . . . . . 26.2 m -67.51 -41.21 84.83 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 111.634 0.235 . . . . 40.01 111.634 -176.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -59.99 -41.71 92.65 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.392 0.886 . . . . 52.8 113.392 175.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.53 -32.6 74.29 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.059 0.392 . . . . 46.55 112.059 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -75.69 -37.73 59.28 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.34 0.591 . . . . 55.33 110.732 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 67.0 mt -60.62 -50.09 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.447 -0.797 . . . . 41.71 110.143 172.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' LYS . . . . . . . . . . . . . . . -61.92 -40.03 94.07 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.392 0.615 . . . . 41.55 111.845 -176.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' SER . . . . . . . . . . . . . 2.2 t -69.38 -46.84 65.96 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 115.03 -0.986 . . . . 41.35 112.154 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.36 -43.06 99.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.338 -0.392 . . . . 39.38 110.68 177.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.32 99.29 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.583 -0.28 . . . . 39.49 111.682 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' THR . . . . . . . . . . . . . 85.7 m -64.6 -36.48 84.38 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 122.819 0.447 . . . . 40.95 110.651 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . . . -60.74 -38.23 84.43 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.714 0.635 . . . . 41.36 112.714 177.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' ILE . . . . . . . . . . . . . 9.7 pt -99.53 13.81 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 113.61 0.967 . . . . 42.44 113.61 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' ASP . . . . . . . . . . . . . 37.1 t0 57.96 42.43 22.85 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.68 0.792 . . . . 45.55 112.952 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -131.16 -173.88 3.23 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.539 -0.755 . . . . 37.82 109.223 176.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' THR . . . . . . . . . . . . . 73.1 p -115.39 162.09 26.54 Favored Pre-proline 0 C--N 1.327 -0.393 0 N-CA-C 110.087 -0.338 . . . . 37.66 110.087 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.32 -46.02 31.04 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 121.922 1.748 . . . . 38.27 115.415 172.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' HIS . . . . . . . . . . . . . 18.8 m170 -60.26 -41.54 93.45 Favored 'General case' 0 C--O 1.214 -0.799 0 N-CA-C 110.001 -0.37 . . . . 39.71 110.001 178.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -56.92 -49.78 74.56 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 108.965 -0.754 . . . . 37.41 108.965 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.33 -41.15 96.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.487 -0.779 . . . . 41.78 111.29 -173.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' ILE . . . . . . . . . . . . . 65.9 mt -64.39 -42.86 96.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 120.069 -0.652 . . . . 45.26 111.739 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -64.64 -43.4 93.79 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 119.51 -0.876 . . . . 40.56 110.683 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -56.67 -46.3 81.18 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.967 -0.56 . . . . 48.92 110.742 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' ALA . . . . . . . . . . . . . . . -56.32 -48.06 77.47 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 121.522 0.677 . . . . 36.54 112.05 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' ILE . . . . . . . . . . . . . 74.2 mt -63.39 -48.57 86.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 CA-C-N 115.566 -0.743 . . . . 36.12 110.427 -176.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' PHE . . . . . 0.463 ' CD1' ' CD1' ' E' ' 38' ' ' PHE . 17.1 m-85 -64.53 -45.69 86.11 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 115.681 -0.691 . . . . 46.1 112.733 -177.147 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' SER . . . . . . . . . . . . . 97.2 p -64.44 -40.63 96.1 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.666 -0.697 . . . . 42.12 111.018 -179.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -63.89 -39.86 95.17 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.191 0.811 . . . . 43.75 113.191 176.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.0 -43.68 91.73 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.953 -0.467 . . . . 38.56 111.499 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' GLU . . . . . . . . . . . . . 76.6 mt-10 -58.43 -52.0 67.45 Favored 'General case' 0 C--O 1.224 -0.264 0 N-CA-C 112.765 0.654 . . . . 43.88 112.765 174.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' GLN . . . . . . . . . . . . . 43.6 tt0 -48.06 -51.17 25.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.929 0.892 . . . . 48.48 111.56 173.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' LEU . . . . . . . . . . . . . 55.0 mt -61.62 -54.23 45.67 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 116.526 -0.306 . . . . 45.6 110.843 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -51.77 -46.97 64.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.123 -0.489 . . . . 50.57 112.007 175.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -59.37 -37.49 78.05 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.641 0.608 . . . . 49.95 112.641 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' SER . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.469 0.491 0 CA-C-O 120.67 0.272 . . . . 49.23 111.218 178.203 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.457 0 N-CA-C 110.622 -0.991 . . . . 45.37 110.622 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -101.41 152.46 20.7 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.365 0.602 . . . . 45.71 111.579 174.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 4' ' ' THR . . . . . . . . . . . . . 32.9 p -127.95 173.06 10.34 Favored 'General case' 0 C--O 1.248 1.014 0 N-CA-C 108.521 -0.918 . . . . 39.63 108.521 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 5' ' ' THR . . . . . . . . . . . . . 87.2 m -115.79 142.04 47.29 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.781 -0.822 . . . . 42.41 108.781 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 6' ' ' MET . . . . . . . . . . . . . 23.9 ttm -123.81 142.6 50.95 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 108.04 -1.096 . . . . 45.95 108.04 175.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.94 138.07 18.16 Favored Glycine 0 CA--C 1.518 0.229 0 N-CA-C 112.209 -0.356 . . . . 41.49 112.209 174.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 8' ' ' VAL . . . . . . . . . . . . . 52.5 t -125.69 116.47 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 108.088 -1.078 . . . . 41.27 108.088 174.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 9' ' ' MET . . . . . . . . . . . . . 73.4 mtm -78.59 124.2 27.91 Favored 'General case' 0 C--O 1.246 0.873 0 O-C-N 123.903 0.752 . . . . 37.6 110.669 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 10' ' ' LEU . . . . . . . . . . . . . 96.1 mt -126.9 129.34 48.01 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.47 -0.786 . . . . 40.33 111.648 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -77.14 162.22 27.61 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 119.176 -1.01 . . . . 44.21 108.777 171.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 12' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -65.35 -35.68 81.72 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.013 0.375 . . . . 43.49 112.013 -167.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.55 99.09 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 111.9 0.333 . . . . 38.21 111.9 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 14' ' ' THR . . . . . . . . . . . . . 20.5 m -67.58 -45.33 75.86 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 111.541 0.2 . . . . 39.01 111.541 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 15' ' ' ARG . . . . . 0.403 ' NH2' ' O ' ' E' ' 67' ' ' HOH . 2.9 mmt180 -50.23 -49.41 52.95 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 123.389 0.431 . . . . 51.78 112.073 170.238 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 16' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -59.78 -46.07 90.33 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.948 -0.569 . . . . 45.09 109.655 -179.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -59.22 -37.26 77.08 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.444 0.535 . . . . 47.95 112.444 177.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 18' ' ' ILE . . . . . . . . . . . . . 57.8 mt -68.64 -45.04 82.1 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 C-N-CA 122.485 0.314 . . . . 40.84 110.264 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 19' ' ' LYS . . . . . . . . . . . . . . . -62.09 -48.72 78.91 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.162 0.43 . . . . 40.94 112.162 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 20' ' ' SER . . . . . . . . . . . . . 84.1 p -64.94 -41.08 95.83 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.622 -0.431 . . . . 41.89 110.753 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.11 -43.55 87.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.925 0.393 . . . . 39.53 111.551 174.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.77 -42.6 73.6 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.242 0.544 . . . . 39.23 111.618 -177.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 23' ' ' THR . . . . . . . . . . . . . 87.8 m -59.94 -40.43 88.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.996 -0.547 . . . . 40.09 110.571 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 24' ' ' ARG . . . . . . . . . . . . . . . -57.55 -45.84 84.64 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.504 -0.771 . . . . 41.86 112.501 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 25' ' ' ILE . . . . . . . . . . . . . 20.6 pt -94.42 9.33 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 N-CA-C 113.171 0.804 . . . . 41.78 113.171 -179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 26' ' ' ASP . . . . . . . . . . . . . 29.8 t0 60.86 44.78 10.41 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.918 0.71 . . . . 44.82 112.918 175.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 27' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -136.37 175.56 9.5 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 108.701 -0.851 . . . . 38.78 108.701 176.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 28' ' ' THR . . . . . . . . . . . . . 53.8 p -93.67 161.5 30.14 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.659 0.244 . . . . 37.83 111.659 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 29' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.69 -45.49 35.04 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 121.436 1.424 . . . . 38.46 113.768 169.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 30' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -62.73 -38.21 89.61 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.328 0.492 . . . . 42.57 112.328 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 31' ' ' TRP . . . . . . . . . . . . . 55.2 t90 -60.85 -47.62 85.55 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 115.735 -0.666 . . . . 37.1 109.378 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 32' ' ' LEU . . . . . . . . . . . . . 9.7 tt -63.3 -41.09 98.92 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.334 0.494 . . . . 40.32 112.334 -176.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 33' ' ' ILE . . . . . . . . . . . . . 67.0 mt -66.39 -42.24 90.17 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 C-N-CA 120.96 -0.296 . . . . 41.65 111.334 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 34' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -62.78 -43.37 98.99 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 119.905 -0.718 . . . . 39.9 112.014 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 35' ' ' GLN . . . . . . . . . . . . . 46.9 tp60 -57.2 -40.85 78.27 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 120.911 -0.316 . . . . 49.53 111.691 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.35 93.0 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.312 0.577 . . . . 36.37 111.061 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 37' ' ' ILE . . . . . . . . . . . . . 65.9 mt -61.71 -50.36 80.53 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 116.018 -0.537 . . . . 37.54 110.517 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 38' ' ' PHE . . . . . 0.463 ' CD1' ' CD1' ' D' ' 38' ' ' PHE . 23.7 m-85 -60.49 -47.18 87.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.227 -0.442 . . . . 46.71 111.463 179.509 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.3 t -60.09 -42.51 94.78 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.051 0.389 . . . . 42.34 112.051 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 40' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -69.16 -39.64 78.65 Favored 'General case' 0 C--O 1.243 0.748 0 O-C-N 122.339 -0.226 . . . . 45.3 111.278 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 41' ' ' LEU . . . . . . . . . . . . . 29.0 mt -58.42 -46.12 87.1 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.356 -0.384 . . . . 43.07 110.825 175.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 42' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -60.87 -45.5 94.29 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.03 0.752 . . . . 46.72 113.03 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 43' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -55.98 -45.37 79.0 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.751 0.649 . . . . 51.44 112.751 170.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 32.0 mt -64.18 -48.18 76.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 121.118 -0.233 . . . . 49.52 111.353 175.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 . . . . . 0 N--CA 1.469 0.518 0 N-CA-C 109.05 -0.722 . . . . 52.24 109.05 171.62 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 3' ' ' THR . . . . . . . . . . . . . 9.5 m . . . . . 0 N--CA 1.498 1.969 0 N-CA-C 113.035 0.754 . . . . 41.59 113.035 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 4' ' ' THR . . . . . . . . . . . . . 81.9 p -137.86 166.02 25.06 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 107.047 -1.464 . . . . 40.7 107.047 172.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 5' ' ' THR . . . . . . . . . . . . . 92.5 m -118.61 124.54 47.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.098 0.475 . . . . 39.38 110.966 176.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 6' ' ' MET . . . . . . . . . . . . . 63.4 mtp -101.44 145.49 28.89 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 115.765 -0.652 . . . . 43.79 110.755 171.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.66 138.32 15.15 Favored Glycine 0 C--O 1.222 -0.596 0 N-CA-C 109.575 -1.41 . . . . 41.89 109.575 173.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 8' ' ' VAL . . . . . . . . . . . . . 44.1 t -121.11 120.26 61.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 107.51 -1.292 . . . . 42.18 107.51 174.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 9' ' ' MET . . . . . . . . . . . . . 44.1 mtm -81.01 130.82 35.19 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 110.211 -0.292 . . . . 38.49 110.211 174.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 10' ' ' LEU . . . . . . . . . . . . . 91.2 mt -129.49 124.77 34.81 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 122.963 0.505 . . . . 41.59 110.838 -177.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.67 150.36 41.17 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 108.172 -1.047 . . . . 46.8 108.172 169.703 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 12' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -61.75 -37.41 84.15 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 112.357 0.503 . . . . 50.09 112.357 -173.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.71 -41.7 95.77 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.075 0.768 . . . . 40.67 113.075 175.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 14' ' ' THR . . . . . . . . . . . . . 92.0 m -67.11 -41.8 85.61 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 121.22 0.533 . . . . 40.97 110.155 179.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 15' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -63.71 -39.0 93.21 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 115.632 -0.713 . . . . 42.79 112.082 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -65.31 -37.92 88.59 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 120.153 -0.619 . . . . 51.34 110.784 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -47.2 86.92 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.723 -0.671 . . . . 54.37 112.198 174.724 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 18' ' ' ILE . . . . . . . . . . . . . 80.0 mt -58.33 -46.28 89.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 115.753 -0.658 . . . . 39.67 109.949 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 19' ' ' LYS . . . . . . . . . . . . . . . -65.24 -45.85 82.95 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 124.235 0.959 . . . . 41.1 109.669 -175.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 20' ' ' SER . . . . . . . . . . . . . 41.4 t -62.11 -44.17 97.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.202 -0.454 . . . . 39.1 111.718 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.47 -42.62 82.72 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 116.602 -0.272 . . . . 36.51 111.708 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.54 -46.99 83.47 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.025 0.53 . . . . 36.29 112.43 178.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 23' ' ' THR . . . . . . . . . . . . . 50.8 m -57.62 -42.21 82.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.867 -0.606 . . . . 37.97 112.026 175.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 24' ' ' ARG . . . . . . . . . . . . . 65.6 mtm-85 -56.11 -36.51 68.26 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 113.486 0.921 . . . . 45.24 113.486 176.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 25' ' ' ILE . . . . . . . . . . . . . 39.1 pt -101.74 13.35 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 N-CA-C 112.562 0.579 . . . . 41.14 112.562 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 26' ' ' ASP . . . . . . . . . . . . . 30.3 t0 65.73 39.18 4.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.374 0.607 . . . . 43.59 112.15 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 27' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 -132.6 -178.74 5.07 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.918 -0.771 . . . . 40.48 108.918 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 28' ' ' THR . . . . . . . . . . . . . 74.1 p -110.02 160.01 29.76 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 109.81 -0.441 . . . . 40.63 109.81 -176.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 29' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.89 -44.7 35.71 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 121.349 1.366 . . . . 38.5 114.706 173.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 30' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -61.12 -43.48 98.81 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.908 1.077 . . . . 42.67 113.908 177.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 31' ' ' TRP . . . . . . . . . . . . . 65.9 t90 -55.36 -48.59 74.03 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 123.379 0.424 . . . . 39.1 110.569 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 32' ' ' LEU . . . . . . . . . . . . . 10.1 tt -60.23 -43.41 96.08 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.634 0.605 . . . . 40.64 112.634 -177.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 33' ' ' ILE . . . . . . . . . . . . . 63.2 mt -66.05 -43.18 92.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 C-N-CA 120.6 -0.44 . . . . 45.13 111.773 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 34' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -64.21 -42.58 96.54 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 118.933 -1.107 . . . . 41.71 110.152 177.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 35' ' ' GLN . . . . . 0.494 ' NE2' ' O ' ' F' ' 60' ' ' HOH . 20.8 tp60 -58.84 -42.83 90.23 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.255 0.55 . . . . 50.47 110.613 178.476 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.13 -48.19 82.51 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.041 1.126 . . . . 38.42 114.041 174.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 37' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.37 -49.93 81.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 112.481 0.548 . . . . 38.8 112.481 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 38' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -56.46 -51.3 68.93 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.012 -0.54 . . . . 46.69 110.87 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 30.8 t -56.53 -50.34 72.13 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 125.78 1.632 . . . . 42.66 112.976 178.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 40' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -58.19 -45.67 87.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.117 -0.492 . . . . 45.62 111.808 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 41' ' ' LEU . . . . . . . . . . . . . 78.5 mt -61.79 -39.3 91.22 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 112.423 0.527 . . . . 40.61 112.423 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 42' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -65.91 -38.51 88.89 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.049 0.389 . . . . 45.75 112.049 177.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 43' ' ' GLN . . . . . . . . . . . . . . . -67.29 -38.19 84.62 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.052 -0.522 . . . . 44.49 111.868 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 46.8 mt -62.78 -46.43 88.06 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 109.488 -0.56 . . . . 46.98 109.488 172.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 45' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 . . . . . 0 N--CA 1.466 0.329 0 N-CA-C 109.722 -0.473 . . . . 51.47 109.722 165.655 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' HOH . . . . . 0.507 ' O ' ' NZ ' ' B' ' 34' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 67' ' ' HOH . . . . . 0.403 ' O ' ' NH2' ' E' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 60' ' ' HOH . . . . . 0.494 ' O ' ' NE2' ' F' ' 35' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.6 m . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 120.841 0.353 . . . . 45.91 110.328 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.3 p -146.56 164.16 33.48 Favored 'General case' 0 C--O 1.247 0.936 0 N-CA-C 107.328 -1.36 . . . . 44.6 107.328 174.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.8 m -119.23 126.91 52.64 Favored 'General case' 0 C--O 1.213 -0.834 0 C-N-CA 120.734 -0.387 . . . . 42.96 110.835 -177.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 31.1 ttm -111.34 148.3 33.28 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.018 -1.104 . . . . 43.0 108.018 179.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -84.05 146.35 22.96 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.956 -0.858 . . . . 39.89 110.956 174.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.1 p -128.73 121.87 55.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 108.2 -1.037 . . . . 41.05 108.2 169.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 79.3 mtp -85.28 123.74 31.11 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.112 -0.495 . . . . 37.22 110.094 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.2 mt -128.27 130.04 47.27 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 124.078 0.862 . . . . 41.46 111.815 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 43.7 p30 -74.55 165.47 25.15 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 109.33 -0.619 . . . . 39.35 109.33 170.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -62.86 -39.57 94.83 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.028 -0.533 . . . . 40.03 111.519 -173.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.97 -45.75 89.77 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.452 0.644 . . . . 36.4 112.701 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 87.8 m -67.16 -43.25 82.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.096 -0.502 . . . . 37.49 109.745 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -61.59 -39.75 92.3 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 112.834 0.679 . . . . 50.15 112.834 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -64.63 -45.53 86.43 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 111.506 0.187 . . . . 45.64 111.506 176.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . 0.42 ' HD3' HD13 ' B' ' 41' ' ' LEU . 16.5 mtt180 -52.14 -49.64 63.32 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 123.132 0.573 . . . . 47.05 111.094 173.596 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 91.3 mt -60.14 -53.42 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.192 0 O-C-N 123.776 0.672 . . . . 40.75 110.217 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . . . -58.54 -43.45 89.28 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 119.906 -0.718 . . . . 41.14 111.68 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.9 m -65.36 -47.95 74.65 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 118.126 0.421 . . . . 41.7 112.072 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.09 -44.46 91.93 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.348 0.594 . . . . 39.59 111.745 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.81 -41.35 83.25 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.586 -0.733 . . . . 39.33 110.978 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.9 m -60.56 -41.73 95.16 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 111.989 0.366 . . . . 41.66 111.989 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ARG . . . . . 0.491 ' HB3' ' CZ ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER -51.36 -32.75 26.81 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 113.322 0.86 . . . . 54.34 113.322 176.019 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 37.9 pt -113.2 21.78 5.96 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.619 0 N-CA-C 112.986 0.736 . . . . 41.18 112.986 -175.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 38.2 t0 53.33 45.03 29.27 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 113.804 1.038 . . . . 38.32 113.804 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 90.2 mmt-85 -130.39 176.91 7.75 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.85 -0.796 . . . . 39.33 108.85 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -106.59 159.13 30.92 Favored Pre-proline 0 N--CA 1.447 -0.583 0 CA-C-N 115.863 -0.608 . . . . 38.65 111.386 -178.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -46.11 -47.93 13.78 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.843 2.362 . . . . 39.14 114.434 169.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HIS . . . . . 0.595 ' HD2' ' O ' ' A' ' 68' ' ' HOH . 25.9 m170 -57.93 -42.43 84.82 Favored 'General case' 0 C--O 1.245 0.84 0 N-CA-C 112.972 0.73 . . . . 38.46 112.972 176.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 72.3 t90 -58.93 -50.57 73.54 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 108.044 -1.095 . . . . 39.25 108.044 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -57.85 -46.63 84.52 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.582 0.753 . . . . 49.19 112.772 -176.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.94 -43.57 97.69 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 CA-C-N 115.471 -0.786 . . . . 41.6 111.398 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -64.29 -41.65 96.78 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 119.745 -0.782 . . . . 39.89 110.268 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -57.03 -44.18 82.66 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 112.538 0.57 . . . . 45.82 112.538 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.19 -44.2 97.67 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 120.942 0.401 . . . . 38.02 111.976 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.2 mt -62.92 -47.81 91.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.512 0.673 . . . . 39.42 110.368 -178.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -67.88 -42.94 80.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 114.278 1.214 . . . . 47.28 114.278 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.2 t -53.31 -45.07 68.84 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 121.32 0.581 . . . . 42.81 111.554 170.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -65.2 -44.44 88.34 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.202 0.445 . . . . 43.61 112.202 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 79.7 mt -62.5 -39.78 94.59 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.027 0.204 . . . . 42.74 110.548 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -66.29 -38.78 88.56 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.12 -0.491 . . . . 46.62 112.163 -179.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . . . -67.09 -37.86 84.68 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.226 0.824 . . . . 49.07 113.226 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . 0.456 ' O ' ' CB ' ' A' ' 45' ' ' GLU . 98.2 mt -67.6 75.48 0.18 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 110.527 -0.175 . . . . 52.41 110.527 172.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . 0.456 ' CB ' ' O ' ' A' ' 44' ' ' LEU . 6.0 pt-20 . . . . . 0 N--CA 1.477 0.9 0 C-N-CA 125.788 1.635 . . . . 56.13 108.659 -172.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 112.104 0.409 . . . . 49.26 112.104 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 42.8 p -144.49 166.52 24.91 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 108.632 -0.877 . . . . 47.21 108.632 174.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 61.9 m -119.91 121.8 39.82 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.495 -0.558 . . . . 44.15 109.495 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 56.7 mtp -101.13 151.56 21.68 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 124.077 0.861 . . . . 42.89 109.905 172.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.51 142.01 18.43 Favored Glycine 0 C--N 1.331 0.291 0 N-CA-C 111.044 -0.822 . . . . 40.06 111.044 175.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 15.3 t -119.18 119.28 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 123.894 0.878 . . . . 39.56 108.908 170.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' MET . . . . . . . . . . . . . 97.3 mtp -85.24 126.33 33.6 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.249 -0.649 . . . . 38.11 109.249 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 80.2 mt -126.88 126.14 42.78 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.65 0.78 . . . . 41.01 110.992 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.26 155.53 39.41 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.275 -1.38 . . . . 45.68 107.275 171.569 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -63.37 -33.27 75.16 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.73 1.011 . . . . 43.28 113.73 -167.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.03 -43.09 95.54 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.645 0.609 . . . . 38.36 112.645 175.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 25.6 m -68.15 -41.66 81.25 Favored 'General case' 0 C--O 1.217 -0.643 0 CA-C-O 121.348 0.594 . . . . 39.06 110.492 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 35.0 ttt180 -63.01 -41.17 99.5 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.832 -0.622 . . . . 52.63 111.774 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -63.27 -41.2 98.99 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.272 0.558 . . . . 48.74 111.413 175.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 29.2 ttm-85 -59.8 -50.05 75.34 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.42 -0.809 . . . . 48.03 111.423 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 54.4 mt -57.83 -46.7 87.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.39 0.614 . . . . 41.69 110.804 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LYS . . . . . 0.521 ' O ' HG23 ' B' ' 23' ' ' THR . . . -62.99 -40.25 97.2 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.674 -0.694 . . . . 44.5 110.734 -179.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 22.5 t -69.15 -43.04 75.13 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 112.244 0.461 . . . . 39.35 112.244 179.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.01 -38.74 86.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.723 0.773 . . . . 38.62 110.694 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.59 -50.22 39.5 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 121.603 -0.686 . . . . 40.78 110.599 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' THR . . . . . 0.521 HG23 ' O ' ' B' ' 19' ' ' LYS . 37.5 p -58.67 -39.9 81.99 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.676 0.621 . . . . 42.12 112.676 -174.291 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . . . -64.05 -17.4 63.33 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 114.71 1.374 . . . . 42.22 114.71 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 29.9 pt -116.94 23.01 5.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 123.755 0.659 . . . . 39.3 111.271 176.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 61.92 33.41 17.48 Favored 'General case' 0 C--O 1.254 1.331 0 N-CA-C 113.971 1.1 . . . . 39.86 113.971 173.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 84.9 mmt-85 -124.05 179.83 4.7 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 115.44 -0.8 . . . . 40.36 111.158 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.7 p -116.06 159.14 40.59 Favored Pre-proline 0 N--CA 1.473 0.713 0 CA-C-N 116.117 -0.492 . . . . 41.1 110.919 -175.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -49.01 -46.61 24.61 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 120.768 0.979 . . . . 40.53 114.628 169.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -60.56 -39.21 87.17 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 119.541 1.064 . . . . 39.17 113.106 178.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -59.32 -47.58 84.87 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.754 -0.657 . . . . 38.81 109.891 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.79 -41.13 99.13 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.795 0.807 . . . . 45.41 111.989 -175.784 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 69.7 mt -68.87 -41.3 82.04 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-N 114.904 -1.044 . . . . 42.23 109.082 -175.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -64.41 -42.96 95.79 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 119.076 -1.05 . . . . 44.75 110.013 175.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -54.45 -48.97 71.11 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.812 0.671 . . . . 42.46 112.812 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.23 -52.49 58.75 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 124.135 0.897 . . . . 39.0 112.255 177.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 78.1 mt -60.43 -46.51 95.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 113.15 0.796 . . . . 39.93 113.15 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' PHE . . . . . 0.558 ' CD1' ' CD2' ' C' ' 38' ' ' PHE . 19.3 m-85 -69.1 -44.32 72.69 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 119.713 -0.795 . . . . 47.73 111.813 -178.448 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 12.7 t -51.78 -48.14 63.9 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 124.257 0.973 . . . . 44.36 110.53 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -61.96 -50.68 71.12 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.078 -0.51 . . . . 45.43 111.637 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' LEU . . . . . 0.42 HD13 ' HD3' ' A' ' 17' ' ' ARG . 94.5 mt -64.48 -35.46 81.0 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 111.792 0.293 . . . . 42.64 111.792 -178.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.42 -54.03 51.39 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.902 0.705 . . . . 48.35 112.902 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . . . -53.52 -30.8 43.37 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.441 0.696 . . . . 45.01 112.414 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 C--O 1.22 -0.454 0 N-CA-C 109.354 -0.61 . . . . 44.91 109.354 169.943 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 111.967 -0.453 . . . . 47.02 111.967 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 3' ' ' THR . . . . . . . . . . . . . 85.0 m -145.48 140.08 27.28 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.966 0.412 . . . . 47.5 111.717 178.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 55.8 p -124.68 159.17 31.43 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.391 -0.966 . . . . 45.21 108.391 172.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 70.4 m -117.38 119.35 34.85 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.695 0.283 . . . . 42.94 110.835 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' MET . . . . . . . . . . . . . 29.4 mtp -100.96 142.78 31.94 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.841 0.856 . . . . 42.82 109.875 173.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.48 140.78 17.66 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 111.837 -0.505 . . . . 42.08 111.837 176.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' VAL . . . . . . . . . . . . . 18.8 t -123.21 121.73 63.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.598 0 N-CA-C 108.408 -0.96 . . . . 42.72 108.408 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' MET . . . . . . . . . . . . . 30.1 mtm -84.37 122.81 29.46 Favored 'General case' 0 C--O 1.245 0.849 0 O-C-N 123.966 0.791 . . . . 40.42 109.502 177.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' LEU . . . . . . . . . . . . . 26.0 mt -127.53 129.45 47.39 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 124.163 0.915 . . . . 47.19 111.725 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 17.4 p30 -73.74 170.8 14.54 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 120.881 -0.328 . . . . 44.07 110.986 169.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ASP . . . . . 0.422 ' OD1' ' NH1' ' C' ' 15' ' ' ARG . 67.2 m-20 -58.72 -44.67 90.49 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.536 0.734 . . . . 42.51 112.899 -177.122 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.5 -44.5 96.97 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 112.529 0.566 . . . . 39.55 112.529 -179.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' THR . . . . . . . . . . . . . 34.1 m -63.84 -43.26 96.69 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-N 116.387 -0.37 . . . . 40.04 110.097 177.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' ARG . . . . . 0.422 ' NH1' ' OD1' ' C' ' 12' ' ' ASP . 18.3 mtm180 -60.22 -41.38 92.94 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.411 0.893 . . . . 51.7 113.411 177.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -65.87 -40.84 92.03 Favored 'General case' 0 C--O 1.223 -0.323 0 O-C-N 123.176 0.298 . . . . 46.08 111.042 176.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ARG . . . . . . . . . . . . . 60.6 mtp180 -60.58 -42.27 96.33 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.986 0.422 . . . . 50.26 112.117 176.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.09 -44.92 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-N 115.516 -0.765 . . . . 40.05 112.291 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -62.89 -44.65 95.53 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 109.302 -0.629 . . . . 38.11 109.302 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' SER . . . . . . . . . . . . . 16.8 m -60.37 -49.2 78.53 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.373 0.509 . . . . 39.22 112.373 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.12 -38.14 87.46 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 116.228 -0.442 . . . . 42.42 111.213 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' ALA . . . . . 0.453 ' HB1' ' O ' ' C' ' 27' ' ' ARG . . . -65.82 -40.99 92.37 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.695 0.759 . . . . 41.76 112.725 176.88 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 97.5 m -56.78 -46.78 81.29 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.64 -0.709 . . . . 41.43 110.754 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . . . -71.62 -27.52 63.17 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.834 1.05 . . . . 43.65 113.834 -175.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' ILE . . . . . . . . . . . . . 45.8 pt -95.39 3.34 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 114.009 1.114 . . . . 43.29 114.009 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 54.37 44.62 28.65 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.832 0.853 . . . . 45.99 112.239 -176.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' ARG . . . . . 0.453 ' O ' ' HB1' ' C' ' 22' ' ' ALA . 90.0 mmt-85 -131.45 165.81 22.7 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.875 -0.787 . . . . 38.38 108.875 174.573 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 28' ' ' THR . . . . . . . . . . . . . 78.5 p -80.42 157.74 72.36 Favored Pre-proline 0 C--O 1.25 1.124 0 C-N-CA 120.574 -0.45 . . . . 39.56 112.195 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_exo -50.33 -42.24 48.4 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 121.428 1.419 . . . . 38.86 115.767 166.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' HIS . . . . . . . . . . . . . 58.5 m-70 -56.22 -45.54 79.88 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 118.658 0.663 . . . . 39.86 110.671 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -59.93 -45.48 92.48 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.858 -0.61 . . . . 40.13 110.654 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' LEU . . . . . 0.426 ' HG ' ' HE2' ' D' ' 40' ' ' TYR . 8.1 tt -62.6 -43.61 98.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.935 0.894 . . . . 48.88 112.169 -178.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 33' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.81 -42.67 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 CA-C-N 115.561 -0.745 . . . . 39.63 111.938 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -64.88 -44.23 90.34 Favored 'General case' 0 C--O 1.205 -1.262 0 C-N-CA 119.981 -0.688 . . . . 38.38 109.996 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -56.07 -45.7 79.22 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-O 121.116 0.484 . . . . 44.93 112.073 176.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.78 -45.03 78.27 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.648 -0.705 . . . . 37.04 111.686 175.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' ILE . . . . . . . . . . . . . 96.5 mt -64.25 -52.96 49.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 121.015 -0.274 . . . . 38.49 110.768 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' PHE . . . . . 0.558 ' CD2' ' CD1' ' B' ' 38' ' ' PHE . 20.8 m-85 -57.07 -46.83 82.18 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.104 0.478 . . . . 44.65 111.397 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 39' ' ' SER . . . . . . . . . . . . . 40.9 t -55.97 -46.13 78.71 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.008 0.744 . . . . 42.07 113.008 177.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -63.34 -43.46 97.67 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.157 -0.474 . . . . 40.64 110.84 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.76 -38.84 92.61 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 112.953 0.723 . . . . 40.19 112.953 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -63.08 -43.96 97.06 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 123.262 0.352 . . . . 47.97 110.842 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -60.17 -37.93 81.65 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.548 0.573 . . . . 51.68 112.548 176.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' LEU . . . . . . . . . . . . . 97.1 mt -68.93 -29.19 67.39 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.841 0.312 . . . . 48.81 111.841 174.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.995 0.426 . . . . 48.16 110.188 171.804 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 3' ' ' THR . . . . . . . . . . . . . 15.1 t . . . . . 0 N--CA 1.495 1.823 0 N-CA-C 112.02 0.378 . . . . 49.49 112.02 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 4' ' ' THR . . . . . 0.42 HG23 ' CZ ' ' C' ' 15' ' ' ARG . 54.2 p -117.74 168.18 10.69 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.508 -0.553 . . . . 48.49 109.508 171.512 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 5' ' ' THR . . . . . . . . . . . . . 54.1 m -118.22 117.82 30.16 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.515 -0.55 . . . . 46.53 109.515 173.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' MET . . . . . . . . . . . . . 2.8 ptm -103.88 163.87 12.07 Favored 'General case' 0 CA--C 1.506 -0.717 0 C-N-CA 119.138 -1.025 . . . . 45.49 110.819 172.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' GLY . . . . . . . . . . . . . . . -98.14 137.99 13.61 Favored Glycine 0 N--CA 1.437 -1.234 0 N-CA-C 107.894 -2.082 . . . . 41.22 107.894 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' VAL . . . . . . . . . . . . . 51.8 t -117.3 117.74 56.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.165 -1.421 . . . . 41.36 107.165 172.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' MET . . . . . . . . . . . . . 89.3 mtp -80.81 130.3 34.99 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.131 -1.062 . . . . 36.87 108.131 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' LEU . . . . . . . . . . . . . 95.1 mt -130.51 125.52 34.51 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 109.374 -0.602 . . . . 39.02 109.374 -176.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.1 157.55 37.06 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 107.816 -1.179 . . . . 45.97 107.816 172.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 12' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -62.08 -38.0 87.16 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.577 0.954 . . . . 42.05 113.577 -170.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.03 -49.66 73.1 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.195 0.31 . . . . 39.53 110.981 173.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' THR . . . . . . . . . . . . . 26.2 m -67.51 -41.21 84.83 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 111.634 0.235 . . . . 40.01 111.634 -176.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -59.99 -41.71 92.65 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.392 0.886 . . . . 52.8 113.392 175.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.53 -32.6 74.29 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.059 0.392 . . . . 46.55 112.059 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -75.69 -37.73 59.28 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.34 0.591 . . . . 55.33 110.732 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 67.0 mt -60.62 -50.09 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.447 -0.797 . . . . 41.71 110.143 172.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' LYS . . . . . . . . . . . . . . . -61.92 -40.03 94.07 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.392 0.615 . . . . 41.55 111.845 -176.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' SER . . . . . . . . . . . . . 2.2 t -69.38 -46.84 65.96 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 115.03 -0.986 . . . . 41.35 112.154 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.36 -43.06 99.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.338 -0.392 . . . . 39.38 110.68 177.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.32 99.29 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.583 -0.28 . . . . 39.49 111.682 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' THR . . . . . . . . . . . . . 85.7 m -64.6 -36.48 84.38 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 122.819 0.447 . . . . 40.95 110.651 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . . . -60.74 -38.23 84.43 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.714 0.635 . . . . 41.36 112.714 177.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' ILE . . . . . . . . . . . . . 9.7 pt -99.53 13.81 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 113.61 0.967 . . . . 42.44 113.61 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' ASP . . . . . . . . . . . . . 37.1 t0 57.96 42.43 22.85 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.68 0.792 . . . . 45.55 112.952 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -131.16 -173.88 3.23 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.539 -0.755 . . . . 37.82 109.223 176.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' THR . . . . . . . . . . . . . 73.1 p -115.39 162.09 26.54 Favored Pre-proline 0 C--N 1.327 -0.393 0 N-CA-C 110.087 -0.338 . . . . 37.66 110.087 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.32 -46.02 31.04 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 121.922 1.748 . . . . 38.27 115.415 172.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -60.26 -41.54 93.45 Favored 'General case' 0 C--O 1.214 -0.799 0 N-CA-C 110.001 -0.37 . . . . 39.71 110.001 178.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 31' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -56.92 -49.78 74.56 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 108.965 -0.754 . . . . 37.41 108.965 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 32' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.33 -41.15 96.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.487 -0.779 . . . . 41.78 111.29 -173.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 33' ' ' ILE . . . . . . . . . . . . . 65.9 mt -64.39 -42.86 96.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 120.069 -0.652 . . . . 45.26 111.739 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 34' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -64.64 -43.4 93.79 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 119.51 -0.876 . . . . 40.56 110.683 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 35' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -56.67 -46.3 81.18 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.967 -0.56 . . . . 48.92 110.742 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 36' ' ' ALA . . . . . . . . . . . . . . . -56.32 -48.06 77.47 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 121.522 0.677 . . . . 36.54 112.05 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 37' ' ' ILE . . . . . . . . . . . . . 74.2 mt -63.39 -48.57 86.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 CA-C-N 115.566 -0.743 . . . . 36.12 110.427 -176.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 38' ' ' PHE . . . . . 0.463 ' CD1' ' CD1' ' E' ' 38' ' ' PHE . 17.1 m-85 -64.53 -45.69 86.11 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 115.681 -0.691 . . . . 46.1 112.733 -177.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 39' ' ' SER . . . . . . . . . . . . . 97.2 p -64.44 -40.63 96.1 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.666 -0.697 . . . . 42.12 111.018 -179.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 40' ' ' TYR . . . . . 0.548 ' CE2' HD11 ' D' ' 44' ' ' LEU . 89.4 t80 -63.89 -39.86 95.17 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.191 0.811 . . . . 43.75 113.191 176.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.0 -43.68 91.73 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.953 -0.467 . . . . 38.56 111.499 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 42' ' ' GLU . . . . . . . . . . . . . 76.6 mt-10 -58.43 -52.0 67.45 Favored 'General case' 0 C--O 1.224 -0.264 0 N-CA-C 112.765 0.654 . . . . 43.88 112.765 174.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 43' ' ' GLN . . . . . . . . . . . . . 43.6 tt0 -48.06 -51.17 25.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.929 0.892 . . . . 48.48 111.56 173.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 44' ' ' LEU . . . . . 0.548 HD11 ' CE2' ' D' ' 40' ' ' TYR . 55.0 mt -61.62 -54.23 45.67 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 116.526 -0.306 . . . . 45.6 110.843 -179.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -51.77 -46.97 64.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.123 -0.489 . . . . 50.57 112.007 175.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 46' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -59.37 -37.49 78.05 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.641 0.608 . . . . 49.95 112.641 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 47' ' ' SER . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.469 0.491 0 CA-C-O 120.67 0.272 . . . . 49.23 111.218 178.203 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.457 0 N-CA-C 110.622 -0.991 . . . . 45.37 110.622 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -101.41 152.46 20.7 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.365 0.602 . . . . 45.71 111.579 174.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 4' ' ' THR . . . . . . . . . . . . . 32.9 p -127.95 173.06 10.34 Favored 'General case' 0 C--O 1.248 1.014 0 N-CA-C 108.521 -0.918 . . . . 39.63 108.521 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 5' ' ' THR . . . . . . . . . . . . . 87.2 m -115.79 142.04 47.29 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.781 -0.822 . . . . 42.41 108.781 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 6' ' ' MET . . . . . . . . . . . . . 23.9 ttm -123.81 142.6 50.95 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 108.04 -1.096 . . . . 45.95 108.04 175.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.94 138.07 18.16 Favored Glycine 0 CA--C 1.518 0.229 0 N-CA-C 112.209 -0.356 . . . . 41.49 112.209 174.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 8' ' ' VAL . . . . . 0.433 HG21 HG21 ' F' ' 8' ' ' VAL . 52.5 t -125.69 116.47 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 108.088 -1.078 . . . . 41.27 108.088 174.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 9' ' ' MET . . . . . . . . . . . . . 73.4 mtm -78.59 124.2 27.91 Favored 'General case' 0 C--O 1.246 0.873 0 O-C-N 123.903 0.752 . . . . 37.6 110.669 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 10' ' ' LEU . . . . . . . . . . . . . 96.1 mt -126.9 129.34 48.01 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.47 -0.786 . . . . 40.33 111.648 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -77.14 162.22 27.61 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 119.176 -1.01 . . . . 44.21 108.777 171.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 12' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -65.35 -35.68 81.72 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.013 0.375 . . . . 43.49 112.013 -167.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.55 99.09 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 111.9 0.333 . . . . 38.21 111.9 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 14' ' ' THR . . . . . . . . . . . . . 20.5 m -67.58 -45.33 75.86 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 111.541 0.2 . . . . 39.01 111.541 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 15' ' ' ARG . . . . . 0.403 ' NH2' ' O ' ' E' ' 67' ' ' HOH . 2.9 mmt180 -50.23 -49.41 52.95 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 123.389 0.431 . . . . 51.78 112.073 170.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 16' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -59.78 -46.07 90.33 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.948 -0.569 . . . . 45.09 109.655 -179.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -59.22 -37.26 77.08 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.444 0.535 . . . . 47.95 112.444 177.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 18' ' ' ILE . . . . . . . . . . . . . 57.8 mt -68.64 -45.04 82.1 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 C-N-CA 122.485 0.314 . . . . 40.84 110.264 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 19' ' ' LYS . . . . . . . . . . . . . . . -62.09 -48.72 78.91 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.162 0.43 . . . . 40.94 112.162 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 20' ' ' SER . . . . . . . . . . . . . 84.1 p -64.94 -41.08 95.83 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.622 -0.431 . . . . 41.89 110.753 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.11 -43.55 87.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.925 0.393 . . . . 39.53 111.551 174.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.77 -42.6 73.6 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.242 0.544 . . . . 39.23 111.618 -177.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 23' ' ' THR . . . . . . . . . . . . . 87.8 m -59.94 -40.43 88.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.996 -0.547 . . . . 40.09 110.571 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 24' ' ' ARG . . . . . . . . . . . . . . . -57.55 -45.84 84.64 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.504 -0.771 . . . . 41.86 112.501 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 25' ' ' ILE . . . . . . . . . . . . . 20.6 pt -94.42 9.33 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 N-CA-C 113.171 0.804 . . . . 41.78 113.171 -179.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 26' ' ' ASP . . . . . . . . . . . . . 29.8 t0 60.86 44.78 10.41 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.918 0.71 . . . . 44.82 112.918 175.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 27' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -136.37 175.56 9.5 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 108.701 -0.851 . . . . 38.78 108.701 176.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 28' ' ' THR . . . . . . . . . . . . . 53.8 p -93.67 161.5 30.14 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.659 0.244 . . . . 37.83 111.659 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 29' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.69 -45.49 35.04 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 121.436 1.424 . . . . 38.46 113.768 169.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 30' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -62.73 -38.21 89.61 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.328 0.492 . . . . 42.57 112.328 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 31' ' ' TRP . . . . . . . . . . . . . 55.2 t90 -60.85 -47.62 85.55 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 115.735 -0.666 . . . . 37.1 109.378 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 32' ' ' LEU . . . . . . . . . . . . . 9.7 tt -63.3 -41.09 98.92 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.334 0.494 . . . . 40.32 112.334 -176.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 33' ' ' ILE . . . . . . . . . . . . . 67.0 mt -66.39 -42.24 90.17 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 C-N-CA 120.96 -0.296 . . . . 41.65 111.334 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 34' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -62.78 -43.37 98.99 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 119.905 -0.718 . . . . 39.9 112.014 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 35' ' ' GLN . . . . . . . . . . . . . 46.9 tp60 -57.2 -40.85 78.27 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 120.911 -0.316 . . . . 49.53 111.691 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.35 93.0 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.312 0.577 . . . . 36.37 111.061 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 37' ' ' ILE . . . . . . . . . . . . . 65.9 mt -61.71 -50.36 80.53 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 116.018 -0.537 . . . . 37.54 110.517 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 38' ' ' PHE . . . . . 0.463 ' CD1' ' CD1' ' D' ' 38' ' ' PHE . 23.7 m-85 -60.49 -47.18 87.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.227 -0.442 . . . . 46.71 111.463 179.509 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.3 t -60.09 -42.51 94.78 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.051 0.389 . . . . 42.34 112.051 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 40' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -69.16 -39.64 78.65 Favored 'General case' 0 C--O 1.243 0.748 0 O-C-N 122.339 -0.226 . . . . 45.3 111.278 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 41' ' ' LEU . . . . . . . . . . . . . 29.0 mt -58.42 -46.12 87.1 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.356 -0.384 . . . . 43.07 110.825 175.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 42' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -60.87 -45.5 94.29 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.03 0.752 . . . . 46.72 113.03 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 43' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -55.98 -45.37 79.0 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.751 0.649 . . . . 51.44 112.751 170.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 32.0 mt -64.18 -48.18 76.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 121.118 -0.233 . . . . 49.52 111.353 175.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 . . . . . 0 N--CA 1.469 0.518 0 N-CA-C 109.05 -0.722 . . . . 52.24 109.05 171.62 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 3' ' ' THR . . . . . . . . . . . . . 9.5 m . . . . . 0 N--CA 1.498 1.969 0 N-CA-C 113.035 0.754 . . . . 41.59 113.035 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 4' ' ' THR . . . . . . . . . . . . . 81.9 p -137.86 166.02 25.06 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 107.047 -1.464 . . . . 40.7 107.047 172.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 5' ' ' THR . . . . . . . . . . . . . 92.5 m -118.61 124.54 47.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.098 0.475 . . . . 39.38 110.966 176.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 6' ' ' MET . . . . . . . . . . . . . 63.4 mtp -101.44 145.49 28.89 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 115.765 -0.652 . . . . 43.79 110.755 171.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.66 138.32 15.15 Favored Glycine 0 C--O 1.222 -0.596 0 N-CA-C 109.575 -1.41 . . . . 41.89 109.575 173.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 8' ' ' VAL . . . . . 0.433 HG21 HG21 ' E' ' 8' ' ' VAL . 44.1 t -121.11 120.26 61.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 107.51 -1.292 . . . . 42.18 107.51 174.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 9' ' ' MET . . . . . . . . . . . . . 44.1 mtm -81.01 130.82 35.19 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 110.211 -0.292 . . . . 38.49 110.211 174.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 10' ' ' LEU . . . . . . . . . . . . . 91.2 mt -129.49 124.77 34.81 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 122.963 0.505 . . . . 41.59 110.838 -177.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.67 150.36 41.17 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 108.172 -1.047 . . . . 46.8 108.172 169.703 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 12' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -61.75 -37.41 84.15 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 112.357 0.503 . . . . 50.09 112.357 -173.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.71 -41.7 95.77 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.075 0.768 . . . . 40.67 113.075 175.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 14' ' ' THR . . . . . . . . . . . . . 92.0 m -67.11 -41.8 85.61 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 121.22 0.533 . . . . 40.97 110.155 179.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 15' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -63.71 -39.0 93.21 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 115.632 -0.713 . . . . 42.79 112.082 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -65.31 -37.92 88.59 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 120.153 -0.619 . . . . 51.34 110.784 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -47.2 86.92 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.723 -0.671 . . . . 54.37 112.198 174.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 18' ' ' ILE . . . . . . . . . . . . . 80.0 mt -58.33 -46.28 89.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 115.753 -0.658 . . . . 39.67 109.949 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 19' ' ' LYS . . . . . . . . . . . . . . . -65.24 -45.85 82.95 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 124.235 0.959 . . . . 41.1 109.669 -175.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 20' ' ' SER . . . . . . . . . . . . . 41.4 t -62.11 -44.17 97.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.202 -0.454 . . . . 39.1 111.718 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.47 -42.62 82.72 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 116.602 -0.272 . . . . 36.51 111.708 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.54 -46.99 83.47 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.025 0.53 . . . . 36.29 112.43 178.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 23' ' ' THR . . . . . . . . . . . . . 50.8 m -57.62 -42.21 82.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.867 -0.606 . . . . 37.97 112.026 175.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 24' ' ' ARG . . . . . . . . . . . . . 65.6 mtm-85 -56.11 -36.51 68.26 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 113.486 0.921 . . . . 45.24 113.486 176.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 25' ' ' ILE . . . . . . . . . . . . . 39.1 pt -101.74 13.35 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 N-CA-C 112.562 0.579 . . . . 41.14 112.562 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 26' ' ' ASP . . . . . . . . . . . . . 30.3 t0 65.73 39.18 4.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.374 0.607 . . . . 43.59 112.15 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 27' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 -132.6 -178.74 5.07 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.918 -0.771 . . . . 40.48 108.918 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 28' ' ' THR . . . . . . . . . . . . . 74.1 p -110.02 160.01 29.76 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 109.81 -0.441 . . . . 40.63 109.81 -176.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 29' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.89 -44.7 35.71 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 121.349 1.366 . . . . 38.5 114.706 173.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 30' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -61.12 -43.48 98.81 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.908 1.077 . . . . 42.67 113.908 177.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 31' ' ' TRP . . . . . . . . . . . . . 65.9 t90 -55.36 -48.59 74.03 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 123.379 0.424 . . . . 39.1 110.569 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 32' ' ' LEU . . . . . . . . . . . . . 10.1 tt -60.23 -43.41 96.08 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.634 0.605 . . . . 40.64 112.634 -177.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 33' ' ' ILE . . . . . . . . . . . . . 63.2 mt -66.05 -43.18 92.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 C-N-CA 120.6 -0.44 . . . . 45.13 111.773 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 34' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -64.21 -42.58 96.54 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 118.933 -1.107 . . . . 41.71 110.152 177.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -58.84 -42.83 90.23 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.255 0.55 . . . . 50.47 110.613 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.13 -48.19 82.51 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.041 1.126 . . . . 38.42 114.041 174.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 37' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.37 -49.93 81.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 112.481 0.548 . . . . 38.8 112.481 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 38' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -56.46 -51.3 68.93 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.012 -0.54 . . . . 46.69 110.87 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 30.8 t -56.53 -50.34 72.13 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 125.78 1.632 . . . . 42.66 112.976 178.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 40' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -58.19 -45.67 87.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.117 -0.492 . . . . 45.62 111.808 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 41' ' ' LEU . . . . . . . . . . . . . 78.5 mt -61.79 -39.3 91.22 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 112.423 0.527 . . . . 40.61 112.423 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 42' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -65.91 -38.51 88.89 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.049 0.389 . . . . 45.75 112.049 177.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 43' ' ' GLN . . . . . . . . . . . . . . . -67.29 -38.19 84.62 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.052 -0.522 . . . . 44.49 111.868 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 46.8 mt -62.78 -46.43 88.06 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 109.488 -0.56 . . . . 46.98 109.488 172.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 45' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 . . . . . 0 N--CA 1.466 0.329 0 N-CA-C 109.722 -0.473 . . . . 51.47 109.722 165.655 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HOH . . . . . 0.595 ' O ' ' HD2' ' A' ' 30' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 67' ' ' HOH . . . . . 0.403 ' O ' ' NH2' ' E' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.6 m . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 120.841 0.353 . . . . 45.91 110.328 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.3 p -146.56 164.16 33.48 Favored 'General case' 0 C--O 1.247 0.936 0 N-CA-C 107.328 -1.36 . . . . 44.6 107.328 174.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.8 m -119.23 126.91 52.64 Favored 'General case' 0 C--O 1.213 -0.834 0 C-N-CA 120.734 -0.387 . . . . 42.96 110.835 -177.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 31.1 ttm -111.34 148.3 33.28 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.018 -1.104 . . . . 43.0 108.018 179.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -84.05 146.35 22.96 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.956 -0.858 . . . . 39.89 110.956 174.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.1 p -128.73 121.87 55.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 108.2 -1.037 . . . . 41.05 108.2 169.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 79.3 mtp -85.28 123.74 31.11 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.112 -0.495 . . . . 37.22 110.094 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.2 mt -128.27 130.04 47.27 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 124.078 0.862 . . . . 41.46 111.815 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 43.7 p30 -74.55 165.47 25.15 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 109.33 -0.619 . . . . 39.35 109.33 170.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -62.86 -39.57 94.83 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.028 -0.533 . . . . 40.03 111.519 -173.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.97 -45.75 89.77 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.452 0.644 . . . . 36.4 112.701 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 87.8 m -67.16 -43.25 82.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.096 -0.502 . . . . 37.49 109.745 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -61.59 -39.75 92.3 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 112.834 0.679 . . . . 50.15 112.834 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -64.63 -45.53 86.43 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 111.506 0.187 . . . . 45.64 111.506 176.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.42 ' HD3' HD13 ' B' ' 41' ' ' LEU . 16.5 mtt180 -52.14 -49.64 63.32 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 123.132 0.573 . . . . 47.05 111.094 173.596 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 91.3 mt -60.14 -53.42 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.192 0 O-C-N 123.776 0.672 . . . . 40.75 110.217 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . . . -58.54 -43.45 89.28 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 119.906 -0.718 . . . . 41.14 111.68 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.9 m -65.36 -47.95 74.65 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 118.126 0.421 . . . . 41.7 112.072 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.09 -44.46 91.93 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.348 0.594 . . . . 39.59 111.745 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.81 -41.35 83.25 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.586 -0.733 . . . . 39.33 110.978 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.9 m -60.56 -41.73 95.16 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 111.989 0.366 . . . . 41.66 111.989 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.491 ' CZ ' ' HB3' ' A' ' 24' ' ' ARG . 0.6 OUTLIER -51.36 -32.75 26.81 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 113.322 0.86 . . . . 54.34 113.322 176.019 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 37.9 pt -113.2 21.78 5.96 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.619 0 N-CA-C 112.986 0.736 . . . . 41.18 112.986 -175.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 38.2 t0 53.33 45.03 29.27 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 113.804 1.038 . . . . 38.32 113.804 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 90.2 mmt-85 -130.39 176.91 7.75 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.85 -0.796 . . . . 39.33 108.85 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -106.59 159.13 30.92 Favored Pre-proline 0 N--CA 1.447 -0.583 0 CA-C-N 115.863 -0.608 . . . . 38.65 111.386 -178.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -46.11 -47.93 13.78 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.843 2.362 . . . . 39.14 114.434 169.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 56.8 m-70 -57.93 -42.43 84.82 Favored 'General case' 0 C--O 1.245 0.84 0 N-CA-C 112.972 0.73 . . . . 38.46 112.972 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 72.3 t90 -58.93 -50.57 73.54 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 108.044 -1.095 . . . . 39.25 108.044 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -57.85 -46.63 84.52 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.582 0.753 . . . . 49.19 112.772 -176.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.94 -43.57 97.69 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 CA-C-N 115.471 -0.786 . . . . 41.6 111.398 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -64.29 -41.65 96.78 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 119.745 -0.782 . . . . 39.89 110.268 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -57.03 -44.18 82.66 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 112.538 0.57 . . . . 45.82 112.538 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.19 -44.2 97.67 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 120.942 0.401 . . . . 38.02 111.976 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.2 mt -62.92 -47.81 91.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.512 0.673 . . . . 39.42 110.368 -178.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -67.88 -42.94 80.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 114.278 1.214 . . . . 47.28 114.278 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.2 t -53.31 -45.07 68.84 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 121.32 0.581 . . . . 42.81 111.554 170.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -65.2 -44.44 88.34 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.202 0.445 . . . . 43.61 112.202 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 79.7 mt -62.5 -39.78 94.59 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.027 0.204 . . . . 42.74 110.548 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -66.29 -38.78 88.56 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.12 -0.491 . . . . 46.62 112.163 -179.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . . . -67.09 -37.86 84.68 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.226 0.824 . . . . 49.07 113.226 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.456 ' O ' ' CB ' ' A' ' 45' ' ' GLU . 98.2 mt -67.6 75.48 0.18 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 110.527 -0.175 . . . . 52.41 110.527 172.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.456 ' CB ' ' O ' ' A' ' 44' ' ' LEU . 6.0 pt-20 . . . . . 0 N--CA 1.477 0.9 0 C-N-CA 125.788 1.635 . . . . 56.13 108.659 -172.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 112.104 0.409 . . . . 49.26 112.104 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 42.8 p -144.49 166.52 24.91 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 108.632 -0.877 . . . . 47.21 108.632 174.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 61.9 m -119.91 121.8 39.82 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.495 -0.558 . . . . 44.15 109.495 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 56.7 mtp -101.13 151.56 21.68 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 124.077 0.861 . . . . 42.89 109.905 172.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.51 142.01 18.43 Favored Glycine 0 C--N 1.331 0.291 0 N-CA-C 111.044 -0.822 . . . . 40.06 111.044 175.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 15.3 t -119.18 119.28 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 123.894 0.878 . . . . 39.56 108.908 170.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' MET . . . . . . . . . . . . . 97.3 mtp -85.24 126.33 33.6 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.249 -0.649 . . . . 38.11 109.249 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 80.2 mt -126.88 126.14 42.78 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.65 0.78 . . . . 41.01 110.992 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.26 155.53 39.41 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.275 -1.38 . . . . 45.68 107.275 171.569 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -63.37 -33.27 75.16 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.73 1.011 . . . . 43.28 113.73 -167.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.03 -43.09 95.54 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.645 0.609 . . . . 38.36 112.645 175.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 25.6 m -68.15 -41.66 81.25 Favored 'General case' 0 C--O 1.217 -0.643 0 CA-C-O 121.348 0.594 . . . . 39.06 110.492 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 35.0 ttt180 -63.01 -41.17 99.5 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.832 -0.622 . . . . 52.63 111.774 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -63.27 -41.2 98.99 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.272 0.558 . . . . 48.74 111.413 175.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 29.2 ttm-85 -59.8 -50.05 75.34 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.42 -0.809 . . . . 48.03 111.423 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 54.4 mt -57.83 -46.7 87.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.39 0.614 . . . . 41.69 110.804 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.521 ' O ' HG23 ' B' ' 23' ' ' THR . . . -62.99 -40.25 97.2 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.674 -0.694 . . . . 44.5 110.734 -179.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 22.5 t -69.15 -43.04 75.13 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 112.244 0.461 . . . . 39.35 112.244 179.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.01 -38.74 86.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.723 0.773 . . . . 38.62 110.694 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.59 -50.22 39.5 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 121.603 -0.686 . . . . 40.78 110.599 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' THR . . . . . 0.521 HG23 ' O ' ' B' ' 19' ' ' LYS . 37.5 p -58.67 -39.9 81.99 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.676 0.621 . . . . 42.12 112.676 -174.291 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . . . -64.05 -17.4 63.33 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 114.71 1.374 . . . . 42.22 114.71 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 29.9 pt -116.94 23.01 5.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 123.755 0.659 . . . . 39.3 111.271 176.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 61.92 33.41 17.48 Favored 'General case' 0 C--O 1.254 1.331 0 N-CA-C 113.971 1.1 . . . . 39.86 113.971 173.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 84.9 mmt-85 -124.05 179.83 4.7 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 115.44 -0.8 . . . . 40.36 111.158 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.7 p -116.06 159.14 40.59 Favored Pre-proline 0 N--CA 1.473 0.713 0 CA-C-N 116.117 -0.492 . . . . 41.1 110.919 -175.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -49.01 -46.61 24.61 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 120.768 0.979 . . . . 40.53 114.628 169.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' HIS . . . . . 0.535 ' HD2' ' O ' ' A' ' 63' ' ' HOH . 23.3 m170 -60.56 -39.21 87.17 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 119.541 1.064 . . . . 39.17 113.106 178.683 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -59.32 -47.58 84.87 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.754 -0.657 . . . . 38.81 109.891 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.79 -41.13 99.13 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.795 0.807 . . . . 45.41 111.989 -175.784 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 69.7 mt -68.87 -41.3 82.04 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-N 114.904 -1.044 . . . . 42.23 109.082 -175.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -64.41 -42.96 95.79 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 119.076 -1.05 . . . . 44.75 110.013 175.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -54.45 -48.97 71.11 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.812 0.671 . . . . 42.46 112.812 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.23 -52.49 58.75 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 124.135 0.897 . . . . 39.0 112.255 177.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 78.1 mt -60.43 -46.51 95.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 113.15 0.796 . . . . 39.93 113.15 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.558 ' CD1' ' CD2' ' C' ' 38' ' ' PHE . 19.3 m-85 -69.1 -44.32 72.69 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 119.713 -0.795 . . . . 47.73 111.813 -178.448 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 12.7 t -51.78 -48.14 63.9 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 124.257 0.973 . . . . 44.36 110.53 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -61.96 -50.68 71.12 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.078 -0.51 . . . . 45.43 111.637 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.42 HD13 ' HD3' ' A' ' 17' ' ' ARG . 94.5 mt -64.48 -35.46 81.0 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 111.792 0.293 . . . . 42.64 111.792 -178.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.42 -54.03 51.39 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.902 0.705 . . . . 48.35 112.902 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . . . -53.52 -30.8 43.37 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.441 0.696 . . . . 45.01 112.414 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 C--O 1.22 -0.454 0 N-CA-C 109.354 -0.61 . . . . 44.91 109.354 169.943 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 111.967 -0.453 . . . . 47.02 111.967 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' THR . . . . . . . . . . . . . 85.0 m -145.48 140.08 27.28 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.966 0.412 . . . . 47.5 111.717 178.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 55.8 p -124.68 159.17 31.43 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.391 -0.966 . . . . 45.21 108.391 172.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 70.4 m -117.38 119.35 34.85 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.695 0.283 . . . . 42.94 110.835 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' MET . . . . . 0.432 ' HE2' HD12 ' D' ' 33' ' ' ILE . 29.4 mtp -100.96 142.78 31.94 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.841 0.856 . . . . 42.82 109.875 173.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.48 140.78 17.66 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 111.837 -0.505 . . . . 42.08 111.837 176.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' VAL . . . . . . . . . . . . . 18.8 t -123.21 121.73 63.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.598 0 N-CA-C 108.408 -0.96 . . . . 42.72 108.408 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' MET . . . . . . . . . . . . . 30.1 mtm -84.37 122.81 29.46 Favored 'General case' 0 C--O 1.245 0.849 0 O-C-N 123.966 0.791 . . . . 40.42 109.502 177.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' LEU . . . . . . . . . . . . . 26.0 mt -127.53 129.45 47.39 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 124.163 0.915 . . . . 47.19 111.725 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 17.4 p30 -73.74 170.8 14.54 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 120.881 -0.328 . . . . 44.07 110.986 169.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ASP . . . . . 0.422 ' OD1' ' NH1' ' C' ' 15' ' ' ARG . 67.2 m-20 -58.72 -44.67 90.49 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.536 0.734 . . . . 42.51 112.899 -177.122 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.5 -44.5 96.97 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 112.529 0.566 . . . . 39.55 112.529 -179.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' THR . . . . . . . . . . . . . 34.1 m -63.84 -43.26 96.69 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-N 116.387 -0.37 . . . . 40.04 110.097 177.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.422 ' NH1' ' OD1' ' C' ' 12' ' ' ASP . 18.3 mtm180 -60.22 -41.38 92.94 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.411 0.893 . . . . 51.7 113.411 177.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -65.87 -40.84 92.03 Favored 'General case' 0 C--O 1.223 -0.323 0 O-C-N 123.176 0.298 . . . . 46.08 111.042 176.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ARG . . . . . . . . . . . . . 60.6 mtp180 -60.58 -42.27 96.33 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.986 0.422 . . . . 50.26 112.117 176.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.09 -44.92 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-N 115.516 -0.765 . . . . 40.05 112.291 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -62.89 -44.65 95.53 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 109.302 -0.629 . . . . 38.11 109.302 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' SER . . . . . . . . . . . . . 16.8 m -60.37 -49.2 78.53 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.373 0.509 . . . . 39.22 112.373 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.12 -38.14 87.46 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 116.228 -0.442 . . . . 42.42 111.213 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' ALA . . . . . 0.453 ' HB1' ' O ' ' C' ' 27' ' ' ARG . . . -65.82 -40.99 92.37 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.695 0.759 . . . . 41.76 112.725 176.88 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' THR . . . . . . . . . . . . . 97.5 m -56.78 -46.78 81.29 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.64 -0.709 . . . . 41.43 110.754 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . . . -71.62 -27.52 63.17 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.834 1.05 . . . . 43.65 113.834 -175.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' ILE . . . . . . . . . . . . . 45.8 pt -95.39 3.34 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 114.009 1.114 . . . . 43.29 114.009 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 54.37 44.62 28.65 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.832 0.853 . . . . 45.99 112.239 -176.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' ARG . . . . . 0.453 ' O ' ' HB1' ' C' ' 22' ' ' ALA . 90.0 mmt-85 -131.45 165.81 22.7 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.875 -0.787 . . . . 38.38 108.875 174.573 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' THR . . . . . . . . . . . . . 78.5 p -80.42 157.74 72.36 Favored Pre-proline 0 C--O 1.25 1.124 0 C-N-CA 120.574 -0.45 . . . . 39.56 112.195 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_exo -50.33 -42.24 48.4 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 121.428 1.419 . . . . 38.86 115.767 166.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' HIS . . . . . . . . . . . . . 58.5 m-70 -56.22 -45.54 79.88 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 118.658 0.663 . . . . 39.86 110.671 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -59.93 -45.48 92.48 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.858 -0.61 . . . . 40.13 110.654 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' LEU . . . . . 0.426 ' HG ' ' HE2' ' D' ' 40' ' ' TYR . 8.1 tt -62.6 -43.61 98.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.935 0.894 . . . . 48.88 112.169 -178.594 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.81 -42.67 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 CA-C-N 115.561 -0.745 . . . . 39.63 111.938 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -64.88 -44.23 90.34 Favored 'General case' 0 C--O 1.205 -1.262 0 C-N-CA 119.981 -0.688 . . . . 38.38 109.996 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -56.07 -45.7 79.22 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-O 121.116 0.484 . . . . 44.93 112.073 176.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.78 -45.03 78.27 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.648 -0.705 . . . . 37.04 111.686 175.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' ILE . . . . . . . . . . . . . 96.5 mt -64.25 -52.96 49.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 121.015 -0.274 . . . . 38.49 110.768 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' PHE . . . . . 0.558 ' CD2' ' CD1' ' B' ' 38' ' ' PHE . 20.8 m-85 -57.07 -46.83 82.18 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.104 0.478 . . . . 44.65 111.397 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' SER . . . . . . . . . . . . . 40.9 t -55.97 -46.13 78.71 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.008 0.744 . . . . 42.07 113.008 177.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -63.34 -43.46 97.67 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.157 -0.474 . . . . 40.64 110.84 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.76 -38.84 92.61 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 112.953 0.723 . . . . 40.19 112.953 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -63.08 -43.96 97.06 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 123.262 0.352 . . . . 47.97 110.842 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -60.17 -37.93 81.65 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.548 0.573 . . . . 51.68 112.548 176.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' LEU . . . . . . . . . . . . . 97.1 mt -68.93 -29.19 67.39 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.841 0.312 . . . . 48.81 111.841 174.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.995 0.426 . . . . 48.16 110.188 171.804 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' THR . . . . . . . . . . . . . 15.1 t . . . . . 0 N--CA 1.495 1.823 0 N-CA-C 112.02 0.378 . . . . 49.49 112.02 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' THR . . . . . 0.42 HG23 ' CZ ' ' C' ' 15' ' ' ARG . 54.2 p -117.74 168.18 10.69 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.508 -0.553 . . . . 48.49 109.508 171.512 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' THR . . . . . . . . . . . . . 54.1 m -118.22 117.82 30.16 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.515 -0.55 . . . . 46.53 109.515 173.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' MET . . . . . . . . . . . . . 2.8 ptm -103.88 163.87 12.07 Favored 'General case' 0 CA--C 1.506 -0.717 0 C-N-CA 119.138 -1.025 . . . . 45.49 110.819 172.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' GLY . . . . . . . . . . . . . . . -98.14 137.99 13.61 Favored Glycine 0 N--CA 1.437 -1.234 0 N-CA-C 107.894 -2.082 . . . . 41.22 107.894 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' VAL . . . . . . . . . . . . . 51.8 t -117.3 117.74 56.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.165 -1.421 . . . . 41.36 107.165 172.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' MET . . . . . . . . . . . . . 89.3 mtp -80.81 130.3 34.99 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.131 -1.062 . . . . 36.87 108.131 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' LEU . . . . . . . . . . . . . 95.1 mt -130.51 125.52 34.51 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 109.374 -0.602 . . . . 39.02 109.374 -176.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.1 157.55 37.06 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 107.816 -1.179 . . . . 45.97 107.816 172.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -62.08 -38.0 87.16 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.577 0.954 . . . . 42.05 113.577 -170.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.03 -49.66 73.1 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.195 0.31 . . . . 39.53 110.981 173.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' THR . . . . . . . . . . . . . 26.2 m -67.51 -41.21 84.83 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 111.634 0.235 . . . . 40.01 111.634 -176.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -59.99 -41.71 92.65 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.392 0.886 . . . . 52.8 113.392 175.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.53 -32.6 74.29 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.059 0.392 . . . . 46.55 112.059 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -75.69 -37.73 59.28 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.34 0.591 . . . . 55.33 110.732 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 67.0 mt -60.62 -50.09 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.447 -0.797 . . . . 41.71 110.143 172.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' LYS . . . . . . . . . . . . . . . -61.92 -40.03 94.07 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.392 0.615 . . . . 41.55 111.845 -176.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' SER . . . . . . . . . . . . . 2.2 t -69.38 -46.84 65.96 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 115.03 -0.986 . . . . 41.35 112.154 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.36 -43.06 99.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.338 -0.392 . . . . 39.38 110.68 177.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.32 99.29 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.583 -0.28 . . . . 39.49 111.682 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' THR . . . . . . . . . . . . . 85.7 m -64.6 -36.48 84.38 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 122.819 0.447 . . . . 40.95 110.651 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . . . -60.74 -38.23 84.43 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.714 0.635 . . . . 41.36 112.714 177.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' ILE . . . . . . . . . . . . . 9.7 pt -99.53 13.81 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 113.61 0.967 . . . . 42.44 113.61 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' ASP . . . . . . . . . . . . . 37.1 t0 57.96 42.43 22.85 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.68 0.792 . . . . 45.55 112.952 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -131.16 -173.88 3.23 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.539 -0.755 . . . . 37.82 109.223 176.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' THR . . . . . . . . . . . . . 73.1 p -115.39 162.09 26.54 Favored Pre-proline 0 C--N 1.327 -0.393 0 N-CA-C 110.087 -0.338 . . . . 37.66 110.087 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.32 -46.02 31.04 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 121.922 1.748 . . . . 38.27 115.415 172.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' HIS . . . . . 0.606 ' HD2' ' O ' ' C' ' 65' ' ' HOH . 18.8 m170 -60.26 -41.54 93.45 Favored 'General case' 0 C--O 1.214 -0.799 0 N-CA-C 110.001 -0.37 . . . . 39.71 110.001 178.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -56.92 -49.78 74.56 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 108.965 -0.754 . . . . 37.41 108.965 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.33 -41.15 96.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.487 -0.779 . . . . 41.78 111.29 -173.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' ILE . . . . . 0.432 HD12 ' HE2' ' C' ' 6' ' ' MET . 65.9 mt -64.39 -42.86 96.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 120.069 -0.652 . . . . 45.26 111.739 179.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -64.64 -43.4 93.79 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 119.51 -0.876 . . . . 40.56 110.683 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -56.67 -46.3 81.18 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.967 -0.56 . . . . 48.92 110.742 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' ALA . . . . . . . . . . . . . . . -56.32 -48.06 77.47 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 121.522 0.677 . . . . 36.54 112.05 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' ILE . . . . . . . . . . . . . 74.2 mt -63.39 -48.57 86.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 CA-C-N 115.566 -0.743 . . . . 36.12 110.427 -176.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' PHE . . . . . 0.463 ' CD1' ' CD1' ' E' ' 38' ' ' PHE . 17.1 m-85 -64.53 -45.69 86.11 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 115.681 -0.691 . . . . 46.1 112.733 -177.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' SER . . . . . . . . . . . . . 97.2 p -64.44 -40.63 96.1 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.666 -0.697 . . . . 42.12 111.018 -179.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' TYR . . . . . 0.548 ' CE2' HD11 ' D' ' 44' ' ' LEU . 89.4 t80 -63.89 -39.86 95.17 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.191 0.811 . . . . 43.75 113.191 176.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.0 -43.68 91.73 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.953 -0.467 . . . . 38.56 111.499 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' GLU . . . . . . . . . . . . . 76.6 mt-10 -58.43 -52.0 67.45 Favored 'General case' 0 C--O 1.224 -0.264 0 N-CA-C 112.765 0.654 . . . . 43.88 112.765 174.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' GLN . . . . . . . . . . . . . 43.6 tt0 -48.06 -51.17 25.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.929 0.892 . . . . 48.48 111.56 173.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' LEU . . . . . 0.548 HD11 ' CE2' ' D' ' 40' ' ' TYR . 55.0 mt -61.62 -54.23 45.67 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 116.526 -0.306 . . . . 45.6 110.843 -179.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -51.77 -46.97 64.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.123 -0.489 . . . . 50.57 112.007 175.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -59.37 -37.49 78.05 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.641 0.608 . . . . 49.95 112.641 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' SER . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.469 0.491 0 CA-C-O 120.67 0.272 . . . . 49.23 111.218 178.203 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.457 0 N-CA-C 110.622 -0.991 . . . . 45.37 110.622 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -101.41 152.46 20.7 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.365 0.602 . . . . 45.71 111.579 174.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 4' ' ' THR . . . . . . . . . . . . . 32.9 p -127.95 173.06 10.34 Favored 'General case' 0 C--O 1.248 1.014 0 N-CA-C 108.521 -0.918 . . . . 39.63 108.521 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 5' ' ' THR . . . . . . . . . . . . . 87.2 m -115.79 142.04 47.29 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.781 -0.822 . . . . 42.41 108.781 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 6' ' ' MET . . . . . . . . . . . . . 23.9 ttm -123.81 142.6 50.95 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 108.04 -1.096 . . . . 45.95 108.04 175.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.94 138.07 18.16 Favored Glycine 0 CA--C 1.518 0.229 0 N-CA-C 112.209 -0.356 . . . . 41.49 112.209 174.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 8' ' ' VAL . . . . . 0.433 HG21 HG21 ' F' ' 8' ' ' VAL . 52.5 t -125.69 116.47 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 108.088 -1.078 . . . . 41.27 108.088 174.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 9' ' ' MET . . . . . . . . . . . . . 73.4 mtm -78.59 124.2 27.91 Favored 'General case' 0 C--O 1.246 0.873 0 O-C-N 123.903 0.752 . . . . 37.6 110.669 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 10' ' ' LEU . . . . . . . . . . . . . 96.1 mt -126.9 129.34 48.01 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.47 -0.786 . . . . 40.33 111.648 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -77.14 162.22 27.61 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 119.176 -1.01 . . . . 44.21 108.777 171.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 12' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -65.35 -35.68 81.72 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.013 0.375 . . . . 43.49 112.013 -167.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.55 99.09 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 111.9 0.333 . . . . 38.21 111.9 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 14' ' ' THR . . . . . . . . . . . . . 20.5 m -67.58 -45.33 75.86 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 111.541 0.2 . . . . 39.01 111.541 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 15' ' ' ARG . . . . . 0.403 ' NH2' ' O ' ' E' ' 67' ' ' HOH . 2.9 mmt180 -50.23 -49.41 52.95 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 123.389 0.431 . . . . 51.78 112.073 170.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 16' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -59.78 -46.07 90.33 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.948 -0.569 . . . . 45.09 109.655 -179.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 17' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -59.22 -37.26 77.08 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.444 0.535 . . . . 47.95 112.444 177.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 18' ' ' ILE . . . . . . . . . . . . . 57.8 mt -68.64 -45.04 82.1 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 C-N-CA 122.485 0.314 . . . . 40.84 110.264 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 19' ' ' LYS . . . . . . . . . . . . . . . -62.09 -48.72 78.91 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.162 0.43 . . . . 40.94 112.162 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 20' ' ' SER . . . . . . . . . . . . . 84.1 p -64.94 -41.08 95.83 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.622 -0.431 . . . . 41.89 110.753 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.11 -43.55 87.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.925 0.393 . . . . 39.53 111.551 174.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.77 -42.6 73.6 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.242 0.544 . . . . 39.23 111.618 -177.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 23' ' ' THR . . . . . . . . . . . . . 87.8 m -59.94 -40.43 88.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.996 -0.547 . . . . 40.09 110.571 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 24' ' ' ARG . . . . . . . . . . . . . . . -57.55 -45.84 84.64 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.504 -0.771 . . . . 41.86 112.501 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 25' ' ' ILE . . . . . . . . . . . . . 20.6 pt -94.42 9.33 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 N-CA-C 113.171 0.804 . . . . 41.78 113.171 -179.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 26' ' ' ASP . . . . . . . . . . . . . 29.8 t0 60.86 44.78 10.41 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.918 0.71 . . . . 44.82 112.918 175.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 27' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -136.37 175.56 9.5 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 108.701 -0.851 . . . . 38.78 108.701 176.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 28' ' ' THR . . . . . . . . . . . . . 53.8 p -93.67 161.5 30.14 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.659 0.244 . . . . 37.83 111.659 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 29' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.69 -45.49 35.04 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 121.436 1.424 . . . . 38.46 113.768 169.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 30' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -62.73 -38.21 89.61 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.328 0.492 . . . . 42.57 112.328 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 31' ' ' TRP . . . . . . . . . . . . . 55.2 t90 -60.85 -47.62 85.55 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 115.735 -0.666 . . . . 37.1 109.378 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 32' ' ' LEU . . . . . . . . . . . . . 9.7 tt -63.3 -41.09 98.92 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.334 0.494 . . . . 40.32 112.334 -176.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 33' ' ' ILE . . . . . . . . . . . . . 67.0 mt -66.39 -42.24 90.17 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 C-N-CA 120.96 -0.296 . . . . 41.65 111.334 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 34' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -62.78 -43.37 98.99 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 119.905 -0.718 . . . . 39.9 112.014 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 35' ' ' GLN . . . . . . . . . . . . . 46.9 tp60 -57.2 -40.85 78.27 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 120.911 -0.316 . . . . 49.53 111.691 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.35 93.0 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.312 0.577 . . . . 36.37 111.061 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 37' ' ' ILE . . . . . . . . . . . . . 65.9 mt -61.71 -50.36 80.53 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 116.018 -0.537 . . . . 37.54 110.517 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 38' ' ' PHE . . . . . 0.463 ' CD1' ' CD1' ' D' ' 38' ' ' PHE . 23.7 m-85 -60.49 -47.18 87.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.227 -0.442 . . . . 46.71 111.463 179.509 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.3 t -60.09 -42.51 94.78 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.051 0.389 . . . . 42.34 112.051 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 40' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -69.16 -39.64 78.65 Favored 'General case' 0 C--O 1.243 0.748 0 O-C-N 122.339 -0.226 . . . . 45.3 111.278 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 41' ' ' LEU . . . . . . . . . . . . . 29.0 mt -58.42 -46.12 87.1 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.356 -0.384 . . . . 43.07 110.825 175.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 42' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -60.87 -45.5 94.29 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.03 0.752 . . . . 46.72 113.03 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 43' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -55.98 -45.37 79.0 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.751 0.649 . . . . 51.44 112.751 170.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 32.0 mt -64.18 -48.18 76.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 121.118 -0.233 . . . . 49.52 111.353 175.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 . . . . . 0 N--CA 1.469 0.518 0 N-CA-C 109.05 -0.722 . . . . 52.24 109.05 171.62 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 3' ' ' THR . . . . . . . . . . . . . 9.5 m . . . . . 0 N--CA 1.498 1.969 0 N-CA-C 113.035 0.754 . . . . 41.59 113.035 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 4' ' ' THR . . . . . . . . . . . . . 81.9 p -137.86 166.02 25.06 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 107.047 -1.464 . . . . 40.7 107.047 172.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 5' ' ' THR . . . . . . . . . . . . . 92.5 m -118.61 124.54 47.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.098 0.475 . . . . 39.38 110.966 176.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 6' ' ' MET . . . . . . . . . . . . . 63.4 mtp -101.44 145.49 28.89 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 115.765 -0.652 . . . . 43.79 110.755 171.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.66 138.32 15.15 Favored Glycine 0 C--O 1.222 -0.596 0 N-CA-C 109.575 -1.41 . . . . 41.89 109.575 173.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 8' ' ' VAL . . . . . 0.433 HG21 HG21 ' E' ' 8' ' ' VAL . 44.1 t -121.11 120.26 61.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 107.51 -1.292 . . . . 42.18 107.51 174.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 9' ' ' MET . . . . . . . . . . . . . 44.1 mtm -81.01 130.82 35.19 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 110.211 -0.292 . . . . 38.49 110.211 174.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 10' ' ' LEU . . . . . . . . . . . . . 91.2 mt -129.49 124.77 34.81 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 122.963 0.505 . . . . 41.59 110.838 -177.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.67 150.36 41.17 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 108.172 -1.047 . . . . 46.8 108.172 169.703 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 12' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -61.75 -37.41 84.15 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 112.357 0.503 . . . . 50.09 112.357 -173.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.71 -41.7 95.77 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.075 0.768 . . . . 40.67 113.075 175.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 14' ' ' THR . . . . . . . . . . . . . 92.0 m -67.11 -41.8 85.61 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 121.22 0.533 . . . . 40.97 110.155 179.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 15' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -63.71 -39.0 93.21 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 115.632 -0.713 . . . . 42.79 112.082 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -65.31 -37.92 88.59 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 120.153 -0.619 . . . . 51.34 110.784 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -47.2 86.92 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.723 -0.671 . . . . 54.37 112.198 174.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 18' ' ' ILE . . . . . . . . . . . . . 80.0 mt -58.33 -46.28 89.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 115.753 -0.658 . . . . 39.67 109.949 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 19' ' ' LYS . . . . . . . . . . . . . . . -65.24 -45.85 82.95 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 124.235 0.959 . . . . 41.1 109.669 -175.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 20' ' ' SER . . . . . . . . . . . . . 41.4 t -62.11 -44.17 97.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.202 -0.454 . . . . 39.1 111.718 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.47 -42.62 82.72 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 116.602 -0.272 . . . . 36.51 111.708 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.54 -46.99 83.47 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.025 0.53 . . . . 36.29 112.43 178.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 23' ' ' THR . . . . . . . . . . . . . 50.8 m -57.62 -42.21 82.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.867 -0.606 . . . . 37.97 112.026 175.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 24' ' ' ARG . . . . . . . . . . . . . 65.6 mtm-85 -56.11 -36.51 68.26 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 113.486 0.921 . . . . 45.24 113.486 176.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 25' ' ' ILE . . . . . . . . . . . . . 39.1 pt -101.74 13.35 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 N-CA-C 112.562 0.579 . . . . 41.14 112.562 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 26' ' ' ASP . . . . . . . . . . . . . 30.3 t0 65.73 39.18 4.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.374 0.607 . . . . 43.59 112.15 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 27' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 -132.6 -178.74 5.07 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.918 -0.771 . . . . 40.48 108.918 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 28' ' ' THR . . . . . . . . . . . . . 74.1 p -110.02 160.01 29.76 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 109.81 -0.441 . . . . 40.63 109.81 -176.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 29' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.89 -44.7 35.71 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 121.349 1.366 . . . . 38.5 114.706 173.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 30' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -61.12 -43.48 98.81 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.908 1.077 . . . . 42.67 113.908 177.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 31' ' ' TRP . . . . . . . . . . . . . 65.9 t90 -55.36 -48.59 74.03 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 123.379 0.424 . . . . 39.1 110.569 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 32' ' ' LEU . . . . . . . . . . . . . 10.1 tt -60.23 -43.41 96.08 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.634 0.605 . . . . 40.64 112.634 -177.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 33' ' ' ILE . . . . . . . . . . . . . 63.2 mt -66.05 -43.18 92.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 C-N-CA 120.6 -0.44 . . . . 45.13 111.773 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 34' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -64.21 -42.58 96.54 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 118.933 -1.107 . . . . 41.71 110.152 177.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 35' ' ' GLN . . . . . 0.416 ' NE2' ' O ' ' F' ' 60' ' ' HOH . 20.8 tp60 -58.84 -42.83 90.23 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.255 0.55 . . . . 50.47 110.613 178.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.13 -48.19 82.51 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.041 1.126 . . . . 38.42 114.041 174.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 37' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.37 -49.93 81.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 112.481 0.548 . . . . 38.8 112.481 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 38' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -56.46 -51.3 68.93 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.012 -0.54 . . . . 46.69 110.87 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 30.8 t -56.53 -50.34 72.13 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 125.78 1.632 . . . . 42.66 112.976 178.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 40' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -58.19 -45.67 87.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.117 -0.492 . . . . 45.62 111.808 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 41' ' ' LEU . . . . . . . . . . . . . 78.5 mt -61.79 -39.3 91.22 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 112.423 0.527 . . . . 40.61 112.423 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 42' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -65.91 -38.51 88.89 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.049 0.389 . . . . 45.75 112.049 177.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 43' ' ' GLN . . . . . . . . . . . . . . . -67.29 -38.19 84.62 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.052 -0.522 . . . . 44.49 111.868 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 46.8 mt -62.78 -46.43 88.06 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 109.488 -0.56 . . . . 46.98 109.488 172.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 45' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 . . . . . 0 N--CA 1.466 0.329 0 N-CA-C 109.722 -0.473 . . . . 51.47 109.722 165.655 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 59' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' HOH . . . . . 0.535 ' O ' ' HD2' ' B' ' 30' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' HOH . . . . . 0.44 ' O ' ' HE1' ' B' ' 30' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' HOH . . . . . 0.606 ' O ' ' HD2' ' D' ' 30' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 67' ' ' HOH . . . . . 0.403 ' O ' ' NH2' ' E' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 60' ' ' HOH . . . . . 0.416 ' O ' ' NE2' ' F' ' 35' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_