data_1erf_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 1erf _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 core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 96.2 t . . . . . 0 N--CA 1.5 2.072 0 CA-C-O 121.548 0.689 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 001 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -65.12 -55.34 22.16 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 118.268 2.067 . . . . 0.0 118.268 -174.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 38.4 pt -62.02 -34.51 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 173.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -64.15 -55.16 25.53 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 116.234 1.254 . . . . 0.0 116.234 167.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -52.57 -42.14 64.2 Favored 'General case' 0 CA--C 1.575 1.941 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 167.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.9 tp -64.93 -57.21 9.37 Favored 'General case' 0 CA--C 1.57 1.733 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 172.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -68.81 -41.66 78.34 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.75 -39.41 73.29 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.374 1.443 . . . . 0.0 114.598 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.26 -48.0 86.1 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 117.669 1.827 . . . . 0.0 117.669 162.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -47.96 -52.48 19.48 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 116.569 2.063 . . . . 0.0 116.569 161.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.6 -45.13 94.32 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.76 -43.7 98.88 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 118.486 2.154 . . . . 0.0 118.486 168.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.84 91.25 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 170.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.63 -39.18 58.19 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 174.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.32 43.08 55.72 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 118.234 2.054 . . . . 0.0 118.234 -176.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 m -165.33 153.73 11.67 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.494 1.117 . . . . 0.0 110.487 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.3 p . . . . . 0 N--CA 1.501 2.116 0 O-C-N 120.515 -1.366 . . . . 0.0 113.314 -177.518 . . . . . . . . 0 0 . 1 . 002 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.7 p . . . . . 0 CA--C 1.573 1.849 0 CA-C-O 121.641 0.734 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 002 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -57.38 -38.39 86.57 Favored Glycine 0 N--CA 1.498 2.826 0 N-CA-C 119.849 2.7 . . . . 0.0 119.849 -179.831 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.83 -39.15 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 CA-C-N 118.606 1.203 . . . . 0.0 113.876 172.921 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.36 -48.71 83.71 Favored Glycine 0 N--CA 1.498 2.78 0 N-CA-C 117.544 1.778 . . . . 0.0 117.544 166.527 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.79 -43.04 80.49 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 117.385 2.365 . . . . 0.0 117.385 167.245 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -57.98 -46.47 85.14 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 167.009 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 170.946 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.8 mt -54.8 -40.59 69.64 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 163.382 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.55 -47.45 69.91 Favored Glycine 0 N--CA 1.496 2.646 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 162.979 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -55.6 -54.0 49.49 Favored 'General case' 0 CA--C 1.578 2.029 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 163.792 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.2 mt -52.82 -44.03 66.38 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 176.911 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.3 -52.8 11.82 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 168.513 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.21 75.89 Favored 'General case' 0 CA--C 1.571 1.759 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.664 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.75 -33.32 64.26 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 116.625 2.083 . . . . 0.0 116.625 165.47 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.26 64.35 1.85 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 116.138 1.215 . . . . 0.0 116.138 176.308 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 m -160.01 123.89 3.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.74 -0.859 . . . . 0.0 110.607 -176.174 . . . . . . . . 1 1 . 1 . 002 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.018 -1.051 . . . . 0.0 110.861 178.296 . . . . . . . . 0 0 . 1 . 003 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.496 1.875 0 CA-C-O 121.542 0.687 . . . . 0.0 112.071 . . . . . . . . . 0 0 . 1 . 003 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.48 -42.62 84.27 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 174.526 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.255 9.9 tp -63.22 -38.79 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 168.009 . . . . . . . . 2 2 . 1 . 003 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.42 -43.05 98.83 Favored Glycine 0 N--CA 1.498 2.785 0 N-CA-C 117.796 1.878 . . . . 0.0 117.796 170.839 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.23 -47.74 80.57 Favored 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 165.326 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.1 tp -64.19 -47.82 78.3 Favored 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 115.632 1.715 . . . . 0.0 115.632 171.142 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -59.36 -37.07 76.94 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 172.957 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.7 tt -61.3 -45.48 94.3 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 170.229 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.84 -48.63 85.1 Favored Glycine 0 N--CA 1.501 2.994 0 N-CA-C 117.843 1.897 . . . . 0.0 117.843 167.01 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -48.68 -45.64 39.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 163.804 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 tt -73.2 -54.16 9.14 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 174.191 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.93 -52.35 7.04 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 118.447 2.139 . . . . 0.0 118.447 -177.712 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.13 -47.47 18.12 Favored 'General case' 0 CA--C 1.57 1.725 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 176.978 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.79 -11.29 53.87 Favored 'General case' 0 CA--C 1.576 1.979 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 173.778 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.6 26.52 56.5 Favored Glycine 0 N--CA 1.497 2.739 0 N-CA-C 120.102 2.801 . . . . 0.0 120.102 178.768 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.0 t -117.27 98.97 6.71 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 119.448 1.624 . . . . 0.0 112.547 -172.192 . . . . . . . . 1 1 . 1 . 003 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.501 2.111 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 174.661 . . . . . . . . 0 0 . 1 . 004 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 64.4 t . . . . . 0 N--CA 1.499 2.017 0 CA-C-O 121.224 0.535 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 004 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.05 -50.31 67.26 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 119.238 2.455 . . . . 0.0 119.238 -175.446 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.0 pt -64.19 -31.5 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 N-CA-C 116.182 1.919 . . . . 0.0 116.182 170.382 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.18 -46.65 87.01 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 117.248 1.659 . . . . 0.0 117.248 165.895 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.46 91.22 Favored 'General case' 0 CA--C 1.574 1.894 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 167.656 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.62 -52.58 50.82 Favored 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 170.065 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -72.65 -73.95 0.18 Allowed 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 119.714 1.143 . . . . 0.0 112.46 -178.698 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -66.97 -35.88 80.95 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 -177.026 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -55.86 -54.49 34.76 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 168.699 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.19 -47.69 73.11 Favored 'General case' 0 CA--C 1.575 1.938 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 170.321 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.46 -44.48 68.94 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 173.507 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.01 -54.43 5.29 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 118.051 1.98 . . . . 0.0 118.051 171.07 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.82 -44.38 41.37 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 117.343 2.349 . . . . 0.0 117.343 -177.21 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.02 -35.57 28.71 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 170.176 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.13 76.08 1.32 Allowed Glycine 0 N--CA 1.493 2.453 0 CA-C-N 119.895 1.225 . . . . 0.0 114.381 178.985 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.1 m -162.79 152.93 16.23 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.913 . . . . 0.0 111.883 -173.271 . . . . . . . . 1 1 . 1 . 004 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t . . . . . 0 N--CA 1.504 2.24 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 177.812 . . . . . . . . 0 0 . 1 . 005 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.497 1.892 0 CA-C-O 121.27 0.557 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 005 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.01 -42.56 81.36 Favored Glycine 0 N--CA 1.499 2.885 0 N-CA-C 119.277 2.471 . . . . 0.0 119.277 177.606 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.254 10.3 tp -62.8 -38.54 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 169.268 . . . . . . . . 2 2 . 1 . 005 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -66.39 -46.95 74.11 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 117.398 1.719 . . . . 0.0 117.398 167.623 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.75 -42.4 71.6 Favored 'General case' 0 CA--C 1.575 1.91 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 165.948 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.49 -44.7 95.68 Favored 'General case' 0 CA--C 1.572 1.8 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 167.102 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -55.32 -51.49 66.57 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 168.426 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.8 mt -52.26 -46.6 65.87 Favored 'General case' 0 N--CA 1.499 1.98 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 171.426 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.53 -44.86 95.98 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 118.411 2.124 . . . . 0.0 118.411 168.434 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -51.52 -43.91 62.42 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 175.189 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.3 mt -56.63 -46.14 81.14 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -178.26 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -85.66 -51.41 3.66 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 117.734 1.854 . . . . 0.0 117.734 170.688 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.73 -40.03 69.7 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.635 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.31 -47.38 11.55 Favored 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 165.228 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 115.39 86.0 1.3 Allowed Glycine 0 N--CA 1.49 2.285 0 CA-C-N 119.25 0.932 . . . . 0.0 113.81 174.134 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.3 m -159.88 123.72 3.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.821 -0.811 . . . . 0.0 111.309 -179.45 . . . . . . . . 1 1 . 1 . 005 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.502 2.166 0 O-C-N 120.737 -1.227 . . . . 0.0 114.059 171.823 . . . . . . . . 0 0 . 1 . 006 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 84.9 t . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 121.511 0.672 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 006 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.26 -55.06 17.25 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 118.219 2.047 . . . . 0.0 118.219 -177.092 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.6 mm -64.58 -39.35 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 178.577 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.42 -45.03 97.24 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 167.221 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.16 84.56 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 166.755 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -61.86 -52.33 64.55 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 165.691 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -51.28 -54.39 26.47 Favored 'General case' 0 CA--C 1.573 1.839 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 171.994 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.98 -27.62 64.86 Favored 'General case' 0 CA--C 1.573 1.852 0 N-CA-C 116.573 2.064 . . . . 0.0 116.573 172.96 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.16 -49.95 70.84 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 117.468 1.747 . . . . 0.0 117.468 161.93 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -65.57 -53.72 38.03 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 168.693 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.35 -59.2 3.6 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -177.809 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.69 -50.83 4.05 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 118.307 2.083 . . . . 0.0 118.307 -176.184 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.61 -49.66 25.05 Favored 'General case' 0 CA--C 1.57 1.726 0 N-CA-C 116.613 2.079 . . . . 0.0 116.613 179.963 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.79 -45.05 19.51 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 172.793 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.59 89.71 2.11 Favored Glycine 0 N--CA 1.489 2.2 0 CA-C-N 119.276 0.943 . . . . 0.0 113.112 -176.299 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.2 m -155.87 138.7 15.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.497 -1.002 . . . . 0.0 111.66 -177.574 . . . . . . . . 1 1 . 1 . 006 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.1 p . . . . . 0 N--CA 1.499 2.018 0 O-C-N 120.503 -1.373 . . . . 0.0 112.319 178.359 . . . . . . . . 0 0 . 1 . 007 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.8 t . . . . . 0 N--CA 1.499 2.021 0 CA-C-O 121.641 0.734 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 007 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.69 26.76 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -175.92 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.283 6.8 tp -66.57 -33.62 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 174.565 . . . . . . . . 2 2 . 1 . 007 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.13 -48.19 87.2 Favored Glycine 0 N--CA 1.497 2.752 0 N-CA-C 117.019 1.567 . . . . 0.0 117.019 165.707 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.15 -45.09 75.64 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 166.507 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.22 -56.09 19.56 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 169.748 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.64 -38.83 92.59 Favored 'General case' 0 CA--C 1.569 1.7 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -178.08 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.97 -42.36 99.81 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 120.882 1.674 . . . . 0.0 115.507 170.498 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -60.12 -50.34 68.71 Favored Glycine 0 N--CA 1.498 2.784 0 N-CA-C 117.683 1.833 . . . . 0.0 117.683 165.377 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -50.6 -53.95 26.57 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 165.839 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.59 -40.06 94.85 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 179.534 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.34 -45.86 94.11 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 118.131 2.012 . . . . 0.0 118.131 166.117 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.21 97.11 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 171.44 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.06 -39.97 71.92 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 169.814 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 75.73 1.31 Allowed Glycine 0 N--CA 1.49 2.254 0 CA-C-N 119.563 1.074 . . . . 0.0 114.962 178.322 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.7 m -154.61 138.49 16.28 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.651 -0.911 . . . . 0.0 112.381 -177.87 . . . . . . . . 1 1 . 1 . 007 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t . . . . . 0 N--CA 1.495 1.821 0 O-C-N 121.186 -0.946 . . . . 0.0 112.113 171.439 . . . . . . . . 0 0 . 1 . 008 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.1 t . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 121.395 0.617 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 008 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.68 -59.11 4.57 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 116.919 1.527 . . . . 0.0 116.919 179.907 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.256 13.7 tt -57.96 -41.65 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 172.393 . . . . . . . . 2 2 . 1 . 008 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.03 -44.73 97.37 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 117.964 1.946 . . . . 0.0 117.964 169.125 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.91 -40.94 97.19 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 117.344 2.35 . . . . 0.0 117.344 169.466 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 45.0 tp -62.58 -47.37 84.12 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 167.812 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -57.88 -56.3 23.7 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 169.98 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 41.5 tp -66.13 -40.52 90.71 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 116.435 2.013 . . . . 0.0 116.435 178.114 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.23 -48.02 85.92 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 117.797 1.879 . . . . 0.0 117.797 166.873 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -66.08 -38.68 88.9 Favored 'General case' 0 CA--C 1.578 2.03 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 170.129 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.01 -57.1 12.93 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 170.747 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.1 -53.4 3.32 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -176.99 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.39 -41.23 48.62 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 -179.605 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.3 -49.8 11.89 Favored 'General case' 0 CA--C 1.573 1.836 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 168.029 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 112.18 82.52 1.21 Allowed Glycine 0 N--CA 1.49 2.278 0 CA-C-N 119.229 0.922 . . . . 0.0 113.897 177.251 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.0 m -158.6 105.7 1.85 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.733 -0.863 . . . . 0.0 111.514 -177.408 . . . . . . . . 1 1 . 1 . 008 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.1 t . . . . . 0 N--CA 1.495 1.825 0 O-C-N 120.929 -1.107 . . . . 0.0 112.721 176.994 . . . . . . . . 0 0 . 1 . 009 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 62.2 t . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 009 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.23 -69.71 2.97 Favored Glycine 0 N--CA 1.494 2.538 0 O-C-N 121.339 -0.851 . . . . 0.0 114.936 -172.772 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 28.9 pt -63.03 -36.46 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 176.998 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.79 -46.27 92.24 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 117.535 1.774 . . . . 0.0 117.535 167.343 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.29 -43.34 96.36 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.039 2.237 . . . . 0.0 117.039 167.577 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.6 tp -61.92 -45.47 93.58 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.526 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.57 -41.79 95.31 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 167.919 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.8 tp -60.86 -42.96 98.87 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 116.196 1.924 . . . . 0.0 116.196 169.432 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.89 -47.91 85.74 Favored Glycine 0 N--CA 1.498 2.768 0 N-CA-C 117.837 1.895 . . . . 0.0 117.837 165.972 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -53.76 -59.15 4.98 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 164.833 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.2 tp -68.96 -40.42 78.91 Favored 'General case' 0 CA--C 1.572 1.807 0 N-CA-C 116.309 1.966 . . . . 0.0 116.309 -176.893 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.91 -40.74 97.24 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 118.478 2.151 . . . . 0.0 118.478 167.692 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.4 87.04 Favored 'General case' 0 CA--C 1.573 1.859 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 167.095 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.69 -45.35 59.25 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 117.279 2.326 . . . . 0.0 117.279 174.588 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.99 75.38 1.3 Allowed Glycine 0 N--CA 1.491 2.331 0 CA-C-N 119.483 1.038 . . . . 0.0 115.405 179.981 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.5 m -157.87 148.33 20.67 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.478 -1.013 . . . . 0.0 112.447 -179.363 . . . . . . . . 1 1 . 1 . 009 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 65.2 p . . . . . 0 N--CA 1.501 2.125 0 O-C-N 120.58 -1.325 . . . . 0.0 111.915 175.929 . . . . . . . . 0 0 . 1 . 010 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 N--CA 1.501 2.083 0 CA-C-O 121.776 0.798 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 010 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.3 -56.64 6.71 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 117.385 1.714 . . . . 0.0 117.385 -178.428 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.27 10.3 tp -60.46 -37.16 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 175.545 . . . . . . . . 2 2 . 1 . 010 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.18 -49.67 69.4 Favored Glycine 0 N--CA 1.498 2.788 0 N-CA-C 117.624 1.81 . . . . 0.0 117.624 167.977 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.88 85.22 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 167.839 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.0 tp -61.1 -45.78 93.32 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 168.752 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -61.13 -39.15 88.96 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 116.485 2.032 . . . . 0.0 116.485 170.364 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.2 mt -58.48 -41.51 85.45 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 164.623 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.8 -47.83 69.56 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.301 2.08 . . . . 0.0 118.301 161.3 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -56.9 -49.34 75.86 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 115.924 1.824 . . . . 0.0 115.924 170.1 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 19.7 tp -63.33 -46.1 88.23 Favored 'General case' 0 CA--C 1.573 1.854 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 173.045 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.13 -43.87 95.05 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.719 2.248 . . . . 0.0 118.719 170.026 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.71 -36.94 85.92 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 117.585 2.439 . . . . 0.0 117.585 167.413 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.51 -42.47 67.95 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 172.877 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.52 -57.06 4.18 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.295 1.678 . . . . 0.0 117.295 178.798 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.3 p -72.66 102.51 3.33 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -179.287 . . . . . . . . 1 1 . 1 . 010 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 p . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.591 -0.693 . . . . 0.0 112.598 -173.108 . . . . . . . . 0 0 . 1 . 011 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 121.075 0.464 . . . . 0.0 112.095 . . . . . . . . . 0 0 . 1 . 011 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.41 93.2 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 118.828 2.291 . . . . 0.0 118.828 176.446 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.59 -40.79 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.374 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 172.568 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.12 -44.36 97.32 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 118.204 2.042 . . . . 0.0 118.204 168.753 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.14 -44.22 83.18 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 116.938 2.199 . . . . 0.0 116.938 165.456 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 mt -56.77 -48.42 77.9 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 165.676 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.28 -38.22 90.27 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 174.908 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.58 -45.41 85.27 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 162.814 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.9 -45.6 61.32 Favored Glycine 0 N--CA 1.496 2.648 0 N-CA-C 118.758 2.263 . . . . 0.0 118.758 163.884 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -61.11 -52.2 65.88 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 170.607 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 60.7 tp -46.53 -52.81 12.58 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 117.087 2.254 . . . . 0.0 117.087 167.059 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.85 -56.48 4.88 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 117.832 1.893 . . . . 0.0 117.832 177.109 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.13 92.29 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 117.403 2.372 . . . . 0.0 117.403 -179.429 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.24 20.74 2.64 Favored 'General case' 0 CA--C 1.58 2.123 0 N-CA-C 117.111 2.263 . . . . 0.0 117.111 164.683 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 41.46 49.6 4.74 Favored Glycine 0 N--CA 1.499 2.866 0 N-CA-C 121.799 3.479 . . . . 0.0 121.799 169.581 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p -159.1 134.88 8.72 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 117.821 0.811 . . . . 0.0 112.281 -164.713 . . . . . . . . 1 1 . 1 . 011 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.5 m . . . . . 0 N--CA 1.496 1.863 0 O-C-N 121.165 -0.959 . . . . 0.0 111.323 -179.073 . . . . . . . . 0 0 . 1 . 012 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 012 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -54.17 -43.25 74.07 Favored Glycine 0 N--CA 1.502 3.094 0 N-CA-C 119.358 2.503 . . . . 0.0 119.358 173.903 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 58.2 mt -61.91 -40.03 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 167.422 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.57 -48.32 85.34 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 117.822 1.889 . . . . 0.0 117.822 168.618 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.93 -41.47 78.27 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 117.246 2.313 . . . . 0.0 117.246 166.497 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.17 -46.83 82.46 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 165.036 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -60.36 -51.86 67.72 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 172.842 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.77 -32.1 73.49 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 171.314 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.27 -49.01 83.15 Favored Glycine 0 N--CA 1.495 2.575 0 N-CA-C 117.823 1.889 . . . . 0.0 117.823 161.663 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.89 -53.56 30.97 Favored 'General case' 0 CA--C 1.578 2.05 0 N-CA-C 115.781 1.771 . . . . 0.0 115.781 174.634 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.8 -49.52 20.44 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 176.831 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -83.57 -61.19 1.9 Allowed Glycine 0 N--CA 1.492 2.415 0 N-CA-C 117.252 1.661 . . . . 0.0 117.252 -175.765 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.47 -47.45 67.06 Favored 'General case' 0 CA--C 1.571 1.778 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 179.3 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.45 -22.68 43.82 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 118.058 2.614 . . . . 0.0 118.058 171.554 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.86 -6.77 77.27 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 120.056 2.783 . . . . 0.0 120.056 -175.788 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.2 p -77.9 99.81 6.14 Favored 'General case' 0 CA--C 1.565 1.549 0 CA-C-N 119.669 1.734 . . . . 0.0 112.352 175.609 . . . . . . . . 1 1 . 1 . 012 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 59.6 p . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -164.87 . . . . . . . . 0 0 . 1 . 013 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 90.7 t . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 121.497 0.665 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 013 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -58.59 4.66 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 116.848 1.499 . . . . 0.0 116.848 178.094 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -62.4 -36.52 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 177.267 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.95 -51.36 54.0 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 117.068 1.587 . . . . 0.0 117.068 168.797 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.13 -40.73 86.38 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 169.325 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 tp -61.86 -48.97 78.13 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 170.215 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -66.22 -40.98 90.69 Favored 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 173.081 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 tp -49.47 -49.93 43.36 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 116.459 2.022 . . . . 0.0 116.459 162.037 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.86 -45.04 96.5 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 118.402 2.121 . . . . 0.0 118.402 167.906 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -58.16 -46.14 86.23 Favored 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.542 2.053 . . . . 0.0 116.542 168.909 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.0 mt -54.04 -46.4 71.9 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 168.255 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.09 -49.6 45.93 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 118.345 2.098 . . . . 0.0 118.345 170.813 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.28 80.38 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 178.639 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.86 -37.02 56.36 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 168.61 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.06 66.52 1.65 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 116.107 1.203 . . . . 0.0 116.107 177.577 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.8 m -159.78 147.07 16.65 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.605 -0.938 . . . . 0.0 112.158 -176.204 . . . . . . . . 1 1 . 1 . 013 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.5 p . . . . . 0 N--CA 1.498 1.968 0 O-C-N 120.938 -1.101 . . . . 0.0 110.899 173.196 . . . . . . . . 0 0 . 1 . 014 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 121.57 0.7 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 014 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.88 -57.38 4.95 Favored Glycine 0 N--CA 1.496 2.688 0 O-C-N 120.632 -1.292 . . . . 0.0 116.117 -170.047 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.4 mt -57.76 -47.68 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 124.521 1.128 . . . . 0.0 113.917 177.454 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.67 -42.04 99.17 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 118.464 2.146 . . . . 0.0 118.464 169.221 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.54 -42.02 95.66 Favored 'General case' 0 CA--C 1.575 1.914 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 166.581 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.0 -51.42 66.3 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 163.998 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -57.71 -42.68 84.25 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 171.459 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.0 mt -60.92 -44.69 96.84 Favored 'General case' 0 CA--C 1.574 1.879 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 169.349 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.21 -47.39 91.07 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 117.981 1.953 . . . . 0.0 117.981 166.848 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -47.16 -54.16 11.29 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 160.844 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.34 -43.56 90.53 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 179.238 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.14 -42.86 99.92 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 118.323 2.089 . . . . 0.0 118.323 168.513 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.94 94.55 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 169.098 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.78 -37.74 64.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 172.62 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 62.85 1.57 Allowed Glycine 0 N--CA 1.493 2.455 0 CA-C-N 119.724 1.147 . . . . 0.0 115.796 -176.297 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.1 t -145.79 -179.73 6.89 Favored 'General case' 0 CA--C 1.573 1.847 0 CA-C-O 122.711 1.243 . . . . 0.0 113.233 -172.628 . . . . . . . . 1 1 . 1 . 014 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.6 m . . . . . 0 N--CA 1.497 1.922 0 O-C-N 119.96 -1.713 . . . . 0.0 108.082 170.353 . . . . . . . . 0 0 . 1 . 015 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 m . . . . . 0 N--CA 1.504 2.248 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 . . . . . . . . . 0 0 . 1 . 015 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.52 -56.64 4.54 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 116.674 1.43 . . . . 0.0 116.674 176.45 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.257 36.9 pt -63.75 -40.05 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 172.99 . . . . . . . . 2 2 . 1 . 015 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.68 -48.63 70.16 Favored Glycine 0 N--CA 1.496 2.671 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 167.829 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 166.349 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -62.07 -46.09 90.63 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 167.02 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -59.38 -48.55 81.22 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 171.494 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.9 mt -59.96 -43.38 95.07 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 169.932 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.61 -50.87 62.72 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 117.786 1.874 . . . . 0.0 117.786 167.82 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -61.91 -47.61 84.18 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 171.428 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.69 -36.35 80.63 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 174.558 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.76 -53.35 7.33 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 117.821 1.888 . . . . 0.0 117.821 167.899 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.64 -46.55 18.95 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -177.867 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.59 -37.54 24.89 Favored 'General case' 0 CA--C 1.571 1.762 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 171.129 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.04 47.93 5.35 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 118.275 2.07 . . . . 0.0 118.275 173.808 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.8 p -84.23 69.78 10.48 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.02 . . . . . . . . 1 1 . 1 . 015 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.8 m . . . . . 0 N--CA 1.499 1.979 0 C-N-CA 123.394 0.678 . . . . 0.0 112.746 -177.483 . . . . . . . . 0 0 . 1 . 016 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.5 t . . . . . 0 N--CA 1.5 2.045 0 CA-C-O 121.589 0.709 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 016 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -57.97 4.97 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 117.278 1.671 . . . . 0.0 117.278 -179.039 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 31.2 mt -63.01 -41.55 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 177.214 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.32 -44.99 96.13 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 168.553 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.31 91.76 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.005 2.224 . . . . 0.0 117.005 166.501 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.87 -47.69 84.02 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 167.631 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -62.53 -41.73 99.06 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 169.345 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.9 -47.98 81.21 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 169.351 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.35 -48.82 77.64 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 166.971 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -49.16 -50.73 36.38 Favored 'General case' 0 CA--C 1.579 2.073 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 164.465 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.63 -49.02 79.21 Favored 'General case' 0 CA--C 1.574 1.871 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 174.322 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.22 -50.73 63.88 Favored Glycine 0 N--CA 1.494 2.54 0 N-CA-C 118.246 2.058 . . . . 0.0 118.246 170.914 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.55 74.9 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 172.273 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.2 -2.37 21.42 Favored 'General case' 0 CA--C 1.577 1.982 0 N-CA-C 118.746 2.869 . . . . 0.0 118.746 167.34 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 54.49 36.16 57.83 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 119.712 2.645 . . . . 0.0 119.712 -177.506 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.0 p -165.02 135.06 3.73 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.547 0.674 . . . . 0.0 110.226 -161.158 . . . . . . . . 1 1 . 1 . 016 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 69.3 p . . . . . 0 N--CA 1.5 2.05 0 O-C-N 120.985 -1.072 . . . . 0.0 113.874 -172.907 . . . . . . . . 0 0 . 1 . 017 ecloud orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.3 m . . . . . 0 N--CA 1.497 1.923 0 CA-C-O 121.299 0.571 . . . . 0.0 112.024 . . . . . . . . . 0 0 . 1 . 017 ecloud orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.88 -37.86 71.8 Favored Glycine 0 N--CA 1.499 2.897 0 N-CA-C 119.608 2.603 . . . . 0.0 119.608 177.436 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.11 -48.69 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.267 0 CA-C-N 118.333 1.067 . . . . 0.0 113.154 171.497 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.34 -51.76 55.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.339 1.696 . . . . 0.0 117.339 169.84 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.9 71.35 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 117.715 2.487 . . . . 0.0 117.715 171.293 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.2 -55.74 12.82 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 169.868 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.32 -41.37 94.07 Favored 'General case' 0 CA--C 1.572 1.82 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 -176.126 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.36 -42.8 99.29 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.332 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -61.45 -49.0 81.74 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 117.814 1.886 . . . . 0.0 117.814 164.358 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -52.9 -57.42 10.31 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.169 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.4 tp -68.52 -37.63 80.19 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 178.905 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.34 -47.11 91.58 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 165.181 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.28 78.01 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 167.558 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.91 -36.86 85.32 Favored 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.827 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.45 -60.32 0.45 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 116.342 1.297 . . . . 0.0 116.342 173.346 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 85.3 p -77.12 89.71 3.63 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.03 . . . . . . . . 1 1 . 1 . 017 ecloud orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.5 p . . . . . 0 N--CA 1.497 1.902 0 O-C-N 121.493 -0.754 . . . . 0.0 112.877 -173.382 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.565 0 CA-C-O 121.783 0.801 . . . . 0.0 112.685 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 96.2 t -86.68 83.23 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.012 -1.055 . . . . 0.0 110.114 -177.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -65.12 -55.34 22.16 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 118.268 2.067 . . . . 0.0 118.268 -174.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 38.4 pt -62.02 -34.51 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 173.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -64.15 -55.16 25.53 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 116.234 1.254 . . . . 0.0 116.234 167.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -52.57 -42.14 64.2 Favored 'General case' 0 CA--C 1.575 1.941 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 167.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.9 tp -64.93 -57.21 9.37 Favored 'General case' 0 CA--C 1.57 1.733 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 172.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -68.81 -41.66 78.34 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.75 -39.41 73.29 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.374 1.443 . . . . 0.0 114.598 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.26 -48.0 86.1 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 117.669 1.827 . . . . 0.0 117.669 162.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -47.96 -52.48 19.48 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 116.569 2.063 . . . . 0.0 116.569 161.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.6 -45.13 94.32 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.76 -43.7 98.88 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 118.486 2.154 . . . . 0.0 118.486 168.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.84 91.25 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 170.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.63 -39.18 58.19 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 174.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.32 43.08 55.72 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 118.234 2.054 . . . . 0.0 118.234 -176.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 m -165.33 153.73 11.67 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.494 1.117 . . . . 0.0 110.487 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.3 p -77.42 78.75 3.94 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 120.515 -1.366 . . . . 0.0 113.314 -177.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 59.4 mtt -93.56 73.18 4.38 Favored 'General case' 0 CA--C 1.57 1.736 0 CA-C-O 121.838 0.828 . . . . 0.0 112.925 -171.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -162.13 81.69 0.13 Allowed Glycine 0 N--CA 1.492 2.372 0 O-C-N 121.169 -0.957 . . . . 0.0 113.575 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -83.16 81.61 8.61 Favored 'General case' 0 CA--C 1.57 1.721 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -88.27 79.9 7.68 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-O 121.998 0.904 . . . . 0.0 112.716 -169.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.1 t -84.64 73.27 10.6 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.138 1.447 . . . . 0.0 114.403 -175.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.813 0 O-C-N 117.371 -3.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.547 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 . . . . . . . . . 0 0 . 1 . 002 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.7 p -85.11 104.1 12.85 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.849 0 O-C-N 120.917 -1.114 . . . . 0.0 111.607 178.743 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -57.38 -38.39 86.57 Favored Glycine 0 N--CA 1.498 2.826 0 N-CA-C 119.849 2.7 . . . . 0.0 119.849 -179.831 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.83 -39.15 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 CA-C-N 118.606 1.203 . . . . 0.0 113.876 172.921 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.36 -48.71 83.71 Favored Glycine 0 N--CA 1.498 2.78 0 N-CA-C 117.544 1.778 . . . . 0.0 117.544 166.527 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.79 -43.04 80.49 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 117.385 2.365 . . . . 0.0 117.385 167.245 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -57.98 -46.47 85.14 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 167.009 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 170.946 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.8 mt -54.8 -40.59 69.64 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 163.382 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.55 -47.45 69.91 Favored Glycine 0 N--CA 1.496 2.646 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 162.979 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -55.6 -54.0 49.49 Favored 'General case' 0 CA--C 1.578 2.029 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 163.792 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.2 mt -52.82 -44.03 66.38 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 176.911 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.3 -52.8 11.82 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 168.513 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.21 75.89 Favored 'General case' 0 CA--C 1.571 1.759 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.664 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.75 -33.32 64.26 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 116.625 2.083 . . . . 0.0 116.625 165.47 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.26 64.35 1.85 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 116.138 1.215 . . . . 0.0 116.138 176.308 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 m -160.01 123.89 3.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.74 -0.859 . . . . 0.0 110.607 -176.174 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m -82.35 101.78 10.81 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.018 -1.051 . . . . 0.0 110.861 178.296 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 24.1 mmt -83.43 83.54 7.84 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 113.483 0.919 . . . . 0.0 113.483 -173.281 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -86.03 66.79 3.64 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 115.94 1.136 . . . . 0.0 115.94 173.899 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.05 -51.92 28.18 Favored 'General case' 0 CA--C 1.567 1.624 0 N-CA-C 116.511 2.041 . . . . 0.0 116.511 -175.042 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.79 60.36 6.18 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 174.598 . . . . . . . . 2 2 . 1 . 002 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.0 m -89.19 86.75 6.94 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 123.486 1.612 . . . . 0.0 112.546 -176.009 . . . . . . . . 1 1 . 1 . 002 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.781 0 O-C-N 117.416 -3.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.577 0 CA-C-O 121.764 0.792 . . . . 0.0 112.661 . . . . . . . . . 0 0 . 1 . 003 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.0 m -83.71 104.12 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.014 -1.054 . . . . 0.0 112.071 -178.932 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.48 -42.62 84.27 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 174.526 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.255 9.9 tp -63.22 -38.79 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 168.009 . . . . . . . . 2 2 . 1 . 003 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.42 -43.05 98.83 Favored Glycine 0 N--CA 1.498 2.785 0 N-CA-C 117.796 1.878 . . . . 0.0 117.796 170.839 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.23 -47.74 80.57 Favored 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 165.326 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.1 tp -64.19 -47.82 78.3 Favored 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 115.632 1.715 . . . . 0.0 115.632 171.142 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -59.36 -37.07 76.94 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 172.957 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.7 tt -61.3 -45.48 94.3 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 170.229 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.84 -48.63 85.1 Favored Glycine 0 N--CA 1.501 2.994 0 N-CA-C 117.843 1.897 . . . . 0.0 117.843 167.01 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -48.68 -45.64 39.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 163.804 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 tt -73.2 -54.16 9.14 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 174.191 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.93 -52.35 7.04 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 118.447 2.139 . . . . 0.0 118.447 -177.712 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.13 -47.47 18.12 Favored 'General case' 0 CA--C 1.57 1.725 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 176.978 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.79 -11.29 53.87 Favored 'General case' 0 CA--C 1.576 1.979 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 173.778 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.6 26.52 56.5 Favored Glycine 0 N--CA 1.497 2.739 0 N-CA-C 120.102 2.801 . . . . 0.0 120.102 178.768 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.0 t -117.27 98.97 6.71 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 119.448 1.624 . . . . 0.0 112.547 -172.192 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t -87.67 57.4 4.36 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 174.661 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 43.3 ttp -89.17 73.61 8.1 Favored 'General case' 0 CA--C 1.573 1.847 0 O-C-N 120.34 -1.475 . . . . 0.0 113.572 -172.98 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.13 88.7 1.2 Allowed Glycine 0 N--CA 1.492 2.381 0 O-C-N 120.904 -1.122 . . . . 0.0 114.18 177.124 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.73 83.71 6.43 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -178.92 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -92.74 86.01 5.4 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.868 0.842 . . . . 0.0 111.946 -169.754 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.2 m -157.34 134.02 9.97 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 123.0 1.381 . . . . 0.0 111.023 179.817 . . . . . . . . 1 1 . 1 . 003 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.76 0 O-C-N 117.079 -3.513 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.555 0 CA-C-O 121.784 0.802 . . . . 0.0 112.668 . . . . . . . . . 0 0 . 1 . 004 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 64.4 t -86.69 90.06 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 120.966 -1.084 . . . . 0.0 109.736 -177.092 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.05 -50.31 67.26 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 119.238 2.455 . . . . 0.0 119.238 -175.446 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.0 pt -64.19 -31.5 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 N-CA-C 116.182 1.919 . . . . 0.0 116.182 170.382 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.18 -46.65 87.01 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 117.248 1.659 . . . . 0.0 117.248 165.895 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.46 91.22 Favored 'General case' 0 CA--C 1.574 1.894 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 167.656 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.62 -52.58 50.82 Favored 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 170.065 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -72.65 -73.95 0.18 Allowed 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 119.714 1.143 . . . . 0.0 112.46 -178.698 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -66.97 -35.88 80.95 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 -177.026 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -55.86 -54.49 34.76 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 168.699 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.19 -47.69 73.11 Favored 'General case' 0 CA--C 1.575 1.938 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 170.321 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.46 -44.48 68.94 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 173.507 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.01 -54.43 5.29 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 118.051 1.98 . . . . 0.0 118.051 171.07 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.82 -44.38 41.37 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 117.343 2.349 . . . . 0.0 117.343 -177.21 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.02 -35.57 28.71 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 170.176 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.13 76.08 1.32 Allowed Glycine 0 N--CA 1.493 2.453 0 CA-C-N 119.895 1.225 . . . . 0.0 114.381 178.985 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.1 m -162.79 152.93 16.23 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.913 . . . . 0.0 111.883 -173.271 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -76.09 54.44 0.86 Allowed 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 177.812 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 36.4 ttm -86.74 95.35 9.79 Favored 'General case' 0 CA--C 1.568 1.658 0 O-C-N 120.488 -1.383 . . . . 0.0 110.712 175.86 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -166.37 91.95 0.1 Allowed Glycine 0 N--CA 1.487 2.046 0 O-C-N 121.629 -0.669 . . . . 0.0 113.195 -174.322 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -108.32 61.29 0.61 Allowed 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 172.132 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.92 -44.2 3.49 Favored 'General case' 0 CA--C 1.57 1.735 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 177.181 . . . . . . . . 2 2 . 1 . 004 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.9 m -156.33 99.7 1.93 Allowed 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 123.221 1.486 . . . . 0.0 110.122 178.528 . . . . . . . . 1 1 . 1 . 004 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.781 0 O-C-N 117.085 -3.509 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.543 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 . . . . . . . . . 0 0 . 1 . 005 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.2 m -84.09 104.92 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 120.959 -1.088 . . . . 0.0 111.77 -179.434 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.01 -42.56 81.36 Favored Glycine 0 N--CA 1.499 2.885 0 N-CA-C 119.277 2.471 . . . . 0.0 119.277 177.606 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.254 10.3 tp -62.8 -38.54 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 169.268 . . . . . . . . 2 2 . 1 . 005 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -66.39 -46.95 74.11 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 117.398 1.719 . . . . 0.0 117.398 167.623 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.75 -42.4 71.6 Favored 'General case' 0 CA--C 1.575 1.91 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 165.948 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.49 -44.7 95.68 Favored 'General case' 0 CA--C 1.572 1.8 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 167.102 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -55.32 -51.49 66.57 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 168.426 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.8 mt -52.26 -46.6 65.87 Favored 'General case' 0 N--CA 1.499 1.98 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 171.426 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.53 -44.86 95.98 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 118.411 2.124 . . . . 0.0 118.411 168.434 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -51.52 -43.91 62.42 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 175.189 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.3 mt -56.63 -46.14 81.14 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -178.26 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -85.66 -51.41 3.66 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 117.734 1.854 . . . . 0.0 117.734 170.688 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.73 -40.03 69.7 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.635 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.31 -47.38 11.55 Favored 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 165.228 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 115.39 86.0 1.3 Allowed Glycine 0 N--CA 1.49 2.285 0 CA-C-N 119.25 0.932 . . . . 0.0 113.81 174.134 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.3 m -159.88 123.72 3.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.821 -0.811 . . . . 0.0 111.309 -179.45 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -83.59 63.08 7.19 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.737 -1.227 . . . . 0.0 114.059 171.823 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 25.0 ttt -104.25 129.09 52.07 Favored 'General case' 0 CA--C 1.568 1.646 0 O-C-N 121.155 -0.965 . . . . 0.0 112.004 -175.996 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -103.02 122.33 7.46 Favored Glycine 0 N--CA 1.489 2.175 0 O-C-N 121.424 -0.797 . . . . 0.0 114.301 176.074 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.22 78.51 8.0 Favored 'General case' 0 CA--C 1.573 1.845 0 O-C-N 121.631 -0.923 . . . . 0.0 112.945 170.488 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -158.68 122.58 3.96 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.333 -0.854 . . . . 0.0 111.414 -165.962 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -83.2 74.93 9.97 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 123.015 1.388 . . . . 0.0 114.165 -179.272 . . . . . . . . 1 1 . 1 . 005 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.8 0 O-C-N 117.449 -3.282 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.539 0 CA-C-O 121.799 0.809 . . . . 0.0 112.727 . . . . . . . . . 0 0 . 1 . 006 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 84.9 t -86.67 84.71 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 120.998 -1.063 . . . . 0.0 110.216 -176.839 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.26 -55.06 17.25 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 118.219 2.047 . . . . 0.0 118.219 -177.092 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.6 mm -64.58 -39.35 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 178.577 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.42 -45.03 97.24 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 167.221 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.16 84.56 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 166.755 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -61.86 -52.33 64.55 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 165.691 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -51.28 -54.39 26.47 Favored 'General case' 0 CA--C 1.573 1.839 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 171.994 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.98 -27.62 64.86 Favored 'General case' 0 CA--C 1.573 1.852 0 N-CA-C 116.573 2.064 . . . . 0.0 116.573 172.96 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.16 -49.95 70.84 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 117.468 1.747 . . . . 0.0 117.468 161.93 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -65.57 -53.72 38.03 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 168.693 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.35 -59.2 3.6 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -177.809 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.69 -50.83 4.05 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 118.307 2.083 . . . . 0.0 118.307 -176.184 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.61 -49.66 25.05 Favored 'General case' 0 CA--C 1.57 1.726 0 N-CA-C 116.613 2.079 . . . . 0.0 116.613 179.963 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.79 -45.05 19.51 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 172.793 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.59 89.71 2.11 Favored Glycine 0 N--CA 1.489 2.2 0 CA-C-N 119.276 0.943 . . . . 0.0 113.112 -176.299 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.2 m -155.87 138.7 15.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.497 -1.002 . . . . 0.0 111.66 -177.574 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.1 p -80.75 79.24 7.44 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.503 -1.373 . . . . 0.0 112.319 178.359 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 24.0 mmt -90.94 93.11 9.06 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-O 121.814 0.816 . . . . 0.0 110.666 -177.001 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -88.08 77.68 1.84 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 116.358 1.303 . . . . 0.0 116.358 -176.101 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.23 81.94 7.94 Favored 'General case' 0 CA--C 1.57 1.743 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 177.548 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -144.33 -67.62 0.33 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.647 -0.658 . . . . 0.0 112.099 -178.422 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.7 m -158.63 127.6 5.51 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 122.829 1.3 . . . . 0.0 110.446 179.819 . . . . . . . . 1 1 . 1 . 006 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.755 0 O-C-N 117.26 -3.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.552 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 . . . . . . . . . 0 0 . 1 . 007 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.8 t -87.35 85.05 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 120.846 -1.159 . . . . 0.0 110.131 -177.832 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.69 26.76 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -175.92 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.283 6.8 tp -66.57 -33.62 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 174.565 . . . . . . . . 2 2 . 1 . 007 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.13 -48.19 87.2 Favored Glycine 0 N--CA 1.497 2.752 0 N-CA-C 117.019 1.567 . . . . 0.0 117.019 165.707 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.15 -45.09 75.64 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 166.507 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.22 -56.09 19.56 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 169.748 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.64 -38.83 92.59 Favored 'General case' 0 CA--C 1.569 1.7 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -178.08 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.97 -42.36 99.81 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 120.882 1.674 . . . . 0.0 115.507 170.498 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -60.12 -50.34 68.71 Favored Glycine 0 N--CA 1.498 2.784 0 N-CA-C 117.683 1.833 . . . . 0.0 117.683 165.377 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -50.6 -53.95 26.57 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 165.839 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.59 -40.06 94.85 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 179.534 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.34 -45.86 94.11 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 118.131 2.012 . . . . 0.0 118.131 166.117 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.21 97.11 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 171.44 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.06 -39.97 71.92 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 169.814 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 75.73 1.31 Allowed Glycine 0 N--CA 1.49 2.254 0 CA-C-N 119.563 1.074 . . . . 0.0 114.962 178.322 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.7 m -154.61 138.49 16.28 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.651 -0.911 . . . . 0.0 112.381 -177.87 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t -86.08 129.89 34.7 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.186 -0.946 . . . . 0.0 112.113 171.439 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 26.1 ttt -81.42 123.8 28.88 Favored 'General case' 0 CA--C 1.571 1.764 0 O-C-N 121.098 -1.001 . . . . 0.0 112.683 -179.509 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -163.52 -82.19 0.04 OUTLIER Glycine 0 N--CA 1.489 2.195 0 O-C-N 121.686 -0.634 . . . . 0.0 113.037 176.746 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.79 73.08 9.85 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 175.46 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -91.87 86.24 5.84 Favored 'General case' 0 CA--C 1.568 1.664 0 O-C-N 121.1 -1.0 . . . . 0.0 111.78 -176.452 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -84.04 70.77 10.54 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 123.127 1.442 . . . . 0.0 114.376 -178.638 . . . . . . . . 1 1 . 1 . 007 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.734 0 O-C-N 117.301 -3.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.531 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 . . . . . . . . . 0 0 . 1 . 008 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.1 t -86.2 82.15 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 120.901 -1.124 . . . . 0.0 110.443 -176.474 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.68 -59.11 4.57 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 116.919 1.527 . . . . 0.0 116.919 179.907 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.256 13.7 tt -57.96 -41.65 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 172.393 . . . . . . . . 2 2 . 1 . 008 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.03 -44.73 97.37 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 117.964 1.946 . . . . 0.0 117.964 169.125 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.91 -40.94 97.19 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 117.344 2.35 . . . . 0.0 117.344 169.466 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 45.0 tp -62.58 -47.37 84.12 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 167.812 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -57.88 -56.3 23.7 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 169.98 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 41.5 tp -66.13 -40.52 90.71 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 116.435 2.013 . . . . 0.0 116.435 178.114 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.23 -48.02 85.92 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 117.797 1.879 . . . . 0.0 117.797 166.873 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -66.08 -38.68 88.9 Favored 'General case' 0 CA--C 1.578 2.03 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 170.129 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.01 -57.1 12.93 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 170.747 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.1 -53.4 3.32 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -176.99 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.39 -41.23 48.62 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 -179.605 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.3 -49.8 11.89 Favored 'General case' 0 CA--C 1.573 1.836 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 168.029 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 112.18 82.52 1.21 Allowed Glycine 0 N--CA 1.49 2.278 0 CA-C-N 119.229 0.922 . . . . 0.0 113.897 177.251 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.0 m -158.6 105.7 1.85 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.733 -0.863 . . . . 0.0 111.514 -177.408 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.1 t -81.57 110.83 17.32 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.929 -1.107 . . . . 0.0 112.721 176.994 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -79.96 88.71 5.32 Favored 'General case' 0 CA--C 1.571 1.787 0 O-C-N 121.026 -1.046 . . . . 0.0 112.847 -175.837 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -83.18 78.7 1.99 Allowed Glycine 0 N--CA 1.493 2.477 0 N-CA-C 116.14 1.216 . . . . 0.0 116.14 -179.545 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.57 86.14 5.25 Favored 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -177.58 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -86.68 80.62 8.5 Favored 'General case' 0 CA--C 1.57 1.717 0 O-C-N 121.292 -0.88 . . . . 0.0 112.614 -172.732 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.1 t -84.98 73.59 10.66 Favored 'General case' 0 CA--C 1.569 1.673 0 CA-C-O 123.175 1.464 . . . . 0.0 114.434 -175.534 . . . . . . . . 1 1 . 1 . 008 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.773 0 O-C-N 117.346 -3.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.567 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 . . . . . . . . . 0 0 . 1 . 009 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 62.2 t -85.16 106.61 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.294 -0.879 . . . . 0.0 109.355 -175.125 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.23 -69.71 2.97 Favored Glycine 0 N--CA 1.494 2.538 0 O-C-N 121.339 -0.851 . . . . 0.0 114.936 -172.772 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 28.9 pt -63.03 -36.46 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 176.998 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.79 -46.27 92.24 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 117.535 1.774 . . . . 0.0 117.535 167.343 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.29 -43.34 96.36 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.039 2.237 . . . . 0.0 117.039 167.577 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.6 tp -61.92 -45.47 93.58 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.526 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.57 -41.79 95.31 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 167.919 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.8 tp -60.86 -42.96 98.87 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 116.196 1.924 . . . . 0.0 116.196 169.432 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.89 -47.91 85.74 Favored Glycine 0 N--CA 1.498 2.768 0 N-CA-C 117.837 1.895 . . . . 0.0 117.837 165.972 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -53.76 -59.15 4.98 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 164.833 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.2 tp -68.96 -40.42 78.91 Favored 'General case' 0 CA--C 1.572 1.807 0 N-CA-C 116.309 1.966 . . . . 0.0 116.309 -176.893 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.91 -40.74 97.24 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 118.478 2.151 . . . . 0.0 118.478 167.692 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.4 87.04 Favored 'General case' 0 CA--C 1.573 1.859 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 167.095 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.69 -45.35 59.25 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 117.279 2.326 . . . . 0.0 117.279 174.588 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.99 75.38 1.3 Allowed Glycine 0 N--CA 1.491 2.331 0 CA-C-N 119.483 1.038 . . . . 0.0 115.405 179.981 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.5 m -157.87 148.33 20.67 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.478 -1.013 . . . . 0.0 112.447 -179.363 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 65.2 p -90.58 74.57 6.75 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.58 -1.325 . . . . 0.0 111.915 175.929 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 12.8 tpt -101.55 88.16 3.36 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.132 -0.98 . . . . 0.0 111.316 -174.959 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -153.47 -51.22 0.01 OUTLIER Glycine 0 N--CA 1.497 2.729 0 N-CA-C 117.635 1.814 . . . . 0.0 117.635 -178.321 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.36 89.11 2.6 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -173.502 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.7 ptt-85 -145.19 -56.1 0.32 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -179.523 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.6 t -85.06 74.72 10.46 Favored 'General case' 0 CA--C 1.569 1.685 0 CA-C-O 122.972 1.368 . . . . 0.0 114.062 -176.631 . . . . . . . . 1 1 . 1 . 009 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.791 0 O-C-N 117.538 -3.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.523 0 CA-C-O 121.912 0.863 . . . . 0.0 112.714 . . . . . . . . . 0 0 . 1 . 010 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.3 t -86.38 82.35 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 120.806 -1.184 . . . . 0.0 110.174 -177.753 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.3 -56.64 6.71 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 117.385 1.714 . . . . 0.0 117.385 -178.428 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.27 10.3 tp -60.46 -37.16 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 175.545 . . . . . . . . 2 2 . 1 . 010 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.18 -49.67 69.4 Favored Glycine 0 N--CA 1.498 2.788 0 N-CA-C 117.624 1.81 . . . . 0.0 117.624 167.977 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.88 85.22 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 167.839 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.0 tp -61.1 -45.78 93.32 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 168.752 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -61.13 -39.15 88.96 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 116.485 2.032 . . . . 0.0 116.485 170.364 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.2 mt -58.48 -41.51 85.45 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 164.623 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.8 -47.83 69.56 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.301 2.08 . . . . 0.0 118.301 161.3 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -56.9 -49.34 75.86 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 115.924 1.824 . . . . 0.0 115.924 170.1 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 19.7 tp -63.33 -46.1 88.23 Favored 'General case' 0 CA--C 1.573 1.854 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 173.045 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.13 -43.87 95.05 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.719 2.248 . . . . 0.0 118.719 170.026 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.71 -36.94 85.92 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 117.585 2.439 . . . . 0.0 117.585 167.413 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.51 -42.47 67.95 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 172.877 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.52 -57.06 4.18 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.295 1.678 . . . . 0.0 117.295 178.798 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.3 p -72.66 102.51 3.33 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -179.287 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 p -81.07 91.43 6.1 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.591 -0.693 . . . . 0.0 112.598 -173.108 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -89.44 90.11 8.16 Favored 'General case' 0 CA--C 1.57 1.717 0 CA-C-O 121.656 0.741 . . . . 0.0 111.849 -176.132 . . . . . . . . 2 2 . 1 . 010 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.77 61.83 1.65 Allowed Glycine 0 N--CA 1.497 2.707 0 N-CA-C 116.462 1.345 . . . . 0.0 116.462 177.796 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -140.91 96.21 2.97 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 117.603 0.702 . . . . 0.0 110.897 -178.077 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -89.32 83.57 6.44 Favored 'General case' 0 CA--C 1.57 1.734 0 O-C-N 121.091 -1.006 . . . . 0.0 111.854 -171.783 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.0 p -84.47 86.01 7.33 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.94 1.353 . . . . 0.0 113.657 -177.106 . . . . . . . . 1 1 . 1 . 010 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.804 0 O-C-N 117.679 -3.138 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.55 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 . . . . . . . . . 0 0 . 1 . 011 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.8 m -85.46 110.54 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 120.932 -1.105 . . . . 0.0 112.095 179.485 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.41 93.2 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 118.828 2.291 . . . . 0.0 118.828 176.446 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.59 -40.79 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.374 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 172.568 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.12 -44.36 97.32 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 118.204 2.042 . . . . 0.0 118.204 168.753 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.14 -44.22 83.18 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 116.938 2.199 . . . . 0.0 116.938 165.456 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 mt -56.77 -48.42 77.9 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 165.676 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.28 -38.22 90.27 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 174.908 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.58 -45.41 85.27 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 162.814 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.9 -45.6 61.32 Favored Glycine 0 N--CA 1.496 2.648 0 N-CA-C 118.758 2.263 . . . . 0.0 118.758 163.884 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -61.11 -52.2 65.88 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 170.607 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 60.7 tp -46.53 -52.81 12.58 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 117.087 2.254 . . . . 0.0 117.087 167.059 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.85 -56.48 4.88 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 117.832 1.893 . . . . 0.0 117.832 177.109 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.13 92.29 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 117.403 2.372 . . . . 0.0 117.403 -179.429 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.24 20.74 2.64 Favored 'General case' 0 CA--C 1.58 2.123 0 N-CA-C 117.111 2.263 . . . . 0.0 117.111 164.683 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 41.46 49.6 4.74 Favored Glycine 0 N--CA 1.499 2.866 0 N-CA-C 121.799 3.479 . . . . 0.0 121.799 169.581 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p -159.1 134.88 8.72 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 117.821 0.811 . . . . 0.0 112.281 -164.713 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.5 m -78.05 94.48 4.67 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.165 -0.959 . . . . 0.0 111.323 -179.073 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 68.2 mtt -84.94 96.19 9.28 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 121.883 0.849 . . . . 0.0 112.669 -169.879 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.69 74.2 2.53 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 115.864 1.106 . . . . 0.0 115.864 177.128 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.56 -52.07 9.01 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -179.301 . . . . . . . . 1 1 . 1 . 011 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . 0.447 ' NE ' ' H ' ' A' ' 23' ' ' SER . 0.0 OUTLIER -86.55 -57.79 2.86 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 167.554 . . . . . . . . 3 3 . 1 . 011 ecloud orig full ' A' A ' 23' ' ' SER . . . . . 0.447 ' H ' ' NE ' ' A' ' 22' ' ' ARG . 40.5 t -85.27 77.33 10.01 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 123.042 1.401 . . . . 0.0 111.906 164.616 . . . . . . . . 2 2 . 1 . 011 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.771 0 O-C-N 117.711 -3.118 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.559 0 CA-C-O 121.754 0.787 . . . . 0.0 112.82 . . . . . . . . . 0 0 . 1 . 012 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 t -90.85 133.01 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.2 -0.937 . . . . 0.0 109.999 -179.729 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -54.17 -43.25 74.07 Favored Glycine 0 N--CA 1.502 3.094 0 N-CA-C 119.358 2.503 . . . . 0.0 119.358 173.903 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 58.2 mt -61.91 -40.03 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 167.422 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.57 -48.32 85.34 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 117.822 1.889 . . . . 0.0 117.822 168.618 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.93 -41.47 78.27 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 117.246 2.313 . . . . 0.0 117.246 166.497 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.17 -46.83 82.46 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 165.036 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -60.36 -51.86 67.72 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 172.842 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.77 -32.1 73.49 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 171.314 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.27 -49.01 83.15 Favored Glycine 0 N--CA 1.495 2.575 0 N-CA-C 117.823 1.889 . . . . 0.0 117.823 161.663 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.89 -53.56 30.97 Favored 'General case' 0 CA--C 1.578 2.05 0 N-CA-C 115.781 1.771 . . . . 0.0 115.781 174.634 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.8 -49.52 20.44 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 176.831 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -83.57 -61.19 1.9 Allowed Glycine 0 N--CA 1.492 2.415 0 N-CA-C 117.252 1.661 . . . . 0.0 117.252 -175.765 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.47 -47.45 67.06 Favored 'General case' 0 CA--C 1.571 1.778 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 179.3 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.45 -22.68 43.82 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 118.058 2.614 . . . . 0.0 118.058 171.554 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.86 -6.77 77.27 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 120.056 2.783 . . . . 0.0 120.056 -175.788 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.2 p -77.9 99.81 6.14 Favored 'General case' 0 CA--C 1.565 1.549 0 CA-C-N 119.669 1.734 . . . . 0.0 112.352 175.609 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 59.6 p -80.2 98.21 7.25 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -164.87 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 28.1 ttt -78.3 108.88 11.96 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 121.508 -0.745 . . . . 0.0 112.045 171.926 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.92 73.65 2.59 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 116.303 1.281 . . . . 0.0 116.303 178.864 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.72 88.31 5.2 Favored 'General case' 0 CA--C 1.569 1.71 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -177.344 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -85.03 81.9 8.68 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.244 -0.91 . . . . 0.0 112.952 -174.8 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.9 t -87.57 69.42 9.74 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.064 1.412 . . . . 0.0 114.512 -175.135 . . . . . . . . 1 1 . 1 . 012 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.807 0 O-C-N 117.354 -3.341 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.563 0 CA-C-O 121.802 0.81 . . . . 0.0 112.682 . . . . . . . . . 0 0 . 1 . 013 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 90.7 t -86.3 85.49 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.021 -1.05 . . . . 0.0 110.471 -176.992 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -58.59 4.66 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 116.848 1.499 . . . . 0.0 116.848 178.094 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -62.4 -36.52 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 177.267 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.95 -51.36 54.0 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 117.068 1.587 . . . . 0.0 117.068 168.797 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.13 -40.73 86.38 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 169.325 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 tp -61.86 -48.97 78.13 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 170.215 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -66.22 -40.98 90.69 Favored 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 173.081 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 tp -49.47 -49.93 43.36 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 116.459 2.022 . . . . 0.0 116.459 162.037 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.86 -45.04 96.5 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 118.402 2.121 . . . . 0.0 118.402 167.906 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -58.16 -46.14 86.23 Favored 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.542 2.053 . . . . 0.0 116.542 168.909 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.0 mt -54.04 -46.4 71.9 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 168.255 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.09 -49.6 45.93 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 118.345 2.098 . . . . 0.0 118.345 170.813 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.28 80.38 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 178.639 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.86 -37.02 56.36 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 168.61 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.06 66.52 1.65 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 116.107 1.203 . . . . 0.0 116.107 177.577 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.8 m -159.78 147.07 16.65 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.605 -0.938 . . . . 0.0 112.158 -176.204 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.5 p -82.42 93.59 7.24 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.938 -1.101 . . . . 0.0 110.899 173.196 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 48.8 mtt -92.07 91.91 8.02 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.565 0.698 . . . . 0.0 112.033 -168.448 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -158.41 75.96 0.2 Allowed Glycine 0 N--CA 1.49 2.233 0 N-CA-C 116.1 1.2 . . . . 0.0 116.1 -178.584 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -83.28 75.34 9.96 Favored 'General case' 0 CA--C 1.571 1.778 0 CA-C-O 121.821 0.819 . . . . 0.0 112.671 169.757 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.8 mtm-85 -129.62 -62.99 0.95 Allowed 'General case' 0 N--CA 1.496 1.868 0 C-N-CA 123.267 0.627 . . . . 0.0 112.397 -170.133 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.1 p -83.8 85.17 7.34 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-O 122.834 1.302 . . . . 0.0 113.623 -178.742 . . . . . . . . 1 1 . 1 . 013 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.785 0 O-C-N 117.716 -3.115 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.505 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 . . . . . . . . . 0 0 . 1 . 014 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 m -79.15 93.44 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.036 -1.04 . . . . 0.0 112.294 -175.657 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.88 -57.38 4.95 Favored Glycine 0 N--CA 1.496 2.688 0 O-C-N 120.632 -1.292 . . . . 0.0 116.117 -170.047 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.4 mt -57.76 -47.68 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 124.521 1.128 . . . . 0.0 113.917 177.454 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.67 -42.04 99.17 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 118.464 2.146 . . . . 0.0 118.464 169.221 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.54 -42.02 95.66 Favored 'General case' 0 CA--C 1.575 1.914 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 166.581 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.0 -51.42 66.3 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 163.998 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -57.71 -42.68 84.25 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 171.459 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.0 mt -60.92 -44.69 96.84 Favored 'General case' 0 CA--C 1.574 1.879 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 169.349 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.21 -47.39 91.07 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 117.981 1.953 . . . . 0.0 117.981 166.848 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -47.16 -54.16 11.29 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 160.844 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.34 -43.56 90.53 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 179.238 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.14 -42.86 99.92 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 118.323 2.089 . . . . 0.0 118.323 168.513 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.94 94.55 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 169.098 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.78 -37.74 64.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 172.62 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 62.85 1.57 Allowed Glycine 0 N--CA 1.493 2.455 0 CA-C-N 119.724 1.147 . . . . 0.0 115.796 -176.297 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.1 t -145.79 -179.73 6.89 Favored 'General case' 0 CA--C 1.573 1.847 0 CA-C-O 122.711 1.243 . . . . 0.0 113.233 -172.628 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.6 m -138.07 99.94 4.02 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 119.96 -1.713 . . . . 0.0 108.082 170.353 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 25.7 ttt -120.66 116.33 25.09 Favored 'General case' 0 CA--C 1.567 1.621 0 C-N-CA 123.529 0.732 . . . . 0.0 110.85 -171.189 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.52 83.49 1.63 Allowed Glycine 0 N--CA 1.491 2.336 0 N-CA-C 115.9 1.12 . . . . 0.0 115.9 179.89 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.94 -42.75 94.37 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 179.2 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -84.23 81.79 8.66 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.064 -1.022 . . . . 0.0 111.052 167.738 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 82.2 p -85.25 85.18 7.48 Favored 'General case' 0 CA--C 1.566 1.589 0 CA-C-O 122.973 1.368 . . . . 0.0 113.761 -172.215 . . . . . . . . 1 1 . 1 . 014 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.78 0 O-C-N 117.665 -3.147 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.526 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 . . . . . . . . . 0 0 . 1 . 015 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 m -83.51 59.78 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.248 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -176.192 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.52 -56.64 4.54 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 116.674 1.43 . . . . 0.0 116.674 176.45 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.257 36.9 pt -63.75 -40.05 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 172.99 . . . . . . . . 2 2 . 1 . 015 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.68 -48.63 70.16 Favored Glycine 0 N--CA 1.496 2.671 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 167.829 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 166.349 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -62.07 -46.09 90.63 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 167.02 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -59.38 -48.55 81.22 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 171.494 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.9 mt -59.96 -43.38 95.07 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 169.932 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.61 -50.87 62.72 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 117.786 1.874 . . . . 0.0 117.786 167.82 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -61.91 -47.61 84.18 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 171.428 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.69 -36.35 80.63 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 174.558 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.76 -53.35 7.33 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 117.821 1.888 . . . . 0.0 117.821 167.899 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.64 -46.55 18.95 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -177.867 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.59 -37.54 24.89 Favored 'General case' 0 CA--C 1.571 1.762 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 171.129 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.04 47.93 5.35 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 118.275 2.07 . . . . 0.0 118.275 173.808 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.8 p -84.23 69.78 10.48 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.02 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.8 m -78.94 -59.68 2.68 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 123.394 0.678 . . . . 0.0 112.746 -177.483 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 67.1 mtt -83.44 81.11 8.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.975 -1.078 . . . . 0.0 110.565 168.703 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 169.86 -70.02 0.14 Allowed Glycine 0 N--CA 1.489 2.21 0 O-C-N 121.397 -0.814 . . . . 0.0 114.643 -171.745 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -83.12 78.73 9.55 Favored 'General case' 0 CA--C 1.57 1.721 0 CA-C-N 117.979 0.89 . . . . 0.0 113.308 177.61 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.6 tpm_? -90.76 89.95 7.72 Favored 'General case' 0 CA--C 1.568 1.646 0 CA-C-O 121.801 0.81 . . . . 0.0 112.874 -173.459 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.3 t -85.93 76.15 9.89 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-O 123.124 1.44 . . . . 0.0 112.796 172.117 . . . . . . . . 1 1 . 1 . 015 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.789 0 O-C-N 117.495 -3.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.549 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 . . . . . . . . . 0 0 . 1 . 016 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.5 t -86.72 83.73 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 120.969 -1.082 . . . . 0.0 110.292 -176.745 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -57.97 4.97 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 117.278 1.671 . . . . 0.0 117.278 -179.039 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 31.2 mt -63.01 -41.55 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 177.214 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.32 -44.99 96.13 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 168.553 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.31 91.76 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.005 2.224 . . . . 0.0 117.005 166.501 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.87 -47.69 84.02 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 167.631 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -62.53 -41.73 99.06 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 169.345 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.9 -47.98 81.21 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 169.351 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.35 -48.82 77.64 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 166.971 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -49.16 -50.73 36.38 Favored 'General case' 0 CA--C 1.579 2.073 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 164.465 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.63 -49.02 79.21 Favored 'General case' 0 CA--C 1.574 1.871 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 174.322 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.22 -50.73 63.88 Favored Glycine 0 N--CA 1.494 2.54 0 N-CA-C 118.246 2.058 . . . . 0.0 118.246 170.914 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.55 74.9 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 172.273 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.2 -2.37 21.42 Favored 'General case' 0 CA--C 1.577 1.982 0 N-CA-C 118.746 2.869 . . . . 0.0 118.746 167.34 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 54.49 36.16 57.83 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 119.712 2.645 . . . . 0.0 119.712 -177.506 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.0 p -165.02 135.06 3.73 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.547 0.674 . . . . 0.0 110.226 -161.158 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 69.3 p -79.79 73.81 6.52 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 120.985 -1.072 . . . . 0.0 113.874 -172.907 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.17 120.88 12.94 Favored 'General case' 0 CA--C 1.57 1.733 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -169.59 . . . . . . . . 2 2 . 1 . 016 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 106.98 -77.3 0.23 Allowed Glycine 0 N--CA 1.49 2.249 0 O-C-N 121.859 -0.526 . . . . 0.0 112.707 -161.941 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.82 75.99 5.64 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 175.143 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -96.24 83.9 3.67 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.868 -1.145 . . . . 0.0 111.201 178.192 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.1 m -158.11 114.78 2.85 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.818 1.294 . . . . 0.0 110.191 179.585 . . . . . . . . 1 1 . 1 . 016 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.756 0 O-C-N 117.126 -3.484 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.491 0 CA-C-O 121.855 0.836 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 017 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.3 m -82.69 99.11 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 120.944 -1.097 . . . . 0.0 112.024 -178.602 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.88 -37.86 71.8 Favored Glycine 0 N--CA 1.499 2.897 0 N-CA-C 119.608 2.603 . . . . 0.0 119.608 177.436 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.11 -48.69 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.267 0 CA-C-N 118.333 1.067 . . . . 0.0 113.154 171.497 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.34 -51.76 55.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.339 1.696 . . . . 0.0 117.339 169.84 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.9 71.35 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 117.715 2.487 . . . . 0.0 117.715 171.293 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.2 -55.74 12.82 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 169.868 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.32 -41.37 94.07 Favored 'General case' 0 CA--C 1.572 1.82 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 -176.126 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.36 -42.8 99.29 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.332 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -61.45 -49.0 81.74 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 117.814 1.886 . . . . 0.0 117.814 164.358 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -52.9 -57.42 10.31 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.169 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.4 tp -68.52 -37.63 80.19 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 178.905 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.34 -47.11 91.58 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 165.181 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.28 78.01 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 167.558 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.91 -36.86 85.32 Favored 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.827 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.45 -60.32 0.45 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 116.342 1.297 . . . . 0.0 116.342 173.346 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 85.3 p -77.12 89.71 3.63 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.03 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.5 p -85.14 82.22 8.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.493 -0.754 . . . . 0.0 112.877 -173.382 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 13.6 tpt -140.71 123.02 15.87 Favored 'General case' 0 CA--C 1.566 1.581 0 C-N-CA 123.731 0.813 . . . . 0.0 110.457 178.481 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.75 82.39 1.69 Allowed Glycine 0 N--CA 1.494 2.515 0 O-C-N 121.043 -1.036 . . . . 0.0 114.274 169.531 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.76 95.25 5.93 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -174.78 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.6 mmt-85 -119.19 -60.86 1.7 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -178.736 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.0 p -82.44 85.39 6.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.526 -1.359 . . . . 0.0 113.64 -179.385 . . . . . . . . 1 1 . 1 . 017 ecloud orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.794 0 O-C-N 117.725 -3.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 96.2 t . . . . . 0 N--CA 1.5 2.072 0 CA-C-O 121.548 0.689 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 001 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -65.12 -55.34 22.16 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 118.268 2.067 . . . . 0.0 118.268 -174.075 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 38.4 pt -62.02 -34.51 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 173.994 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -64.15 -55.16 25.53 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 116.234 1.254 . . . . 0.0 116.234 167.34 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -52.57 -42.14 64.2 Favored 'General case' 0 CA--C 1.575 1.941 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 167.566 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.9 tp -64.93 -57.21 9.37 Favored 'General case' 0 CA--C 1.57 1.733 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 172.856 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -68.81 -41.66 78.34 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.75 -39.41 73.29 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.374 1.443 . . . . 0.0 114.598 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.26 -48.0 86.1 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 117.669 1.827 . . . . 0.0 117.669 162.834 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -47.96 -52.48 19.48 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 116.569 2.063 . . . . 0.0 116.569 161.857 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.6 -45.13 94.32 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.76 -43.7 98.88 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 118.486 2.154 . . . . 0.0 118.486 168.462 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.84 91.25 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 170.457 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.63 -39.18 58.19 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 174.53 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.32 43.08 55.72 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 118.234 2.054 . . . . 0.0 118.234 -176.466 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 m -165.33 153.73 11.67 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.494 1.117 . . . . 0.0 110.487 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.3 p . . . . . 0 N--CA 1.501 2.116 0 O-C-N 120.515 -1.366 . . . . 0.0 113.314 -177.518 . . . . . . . . 0 0 . 1 . 002 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.7 p . . . . . 0 CA--C 1.573 1.849 0 CA-C-O 121.641 0.734 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 002 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -57.38 -38.39 86.57 Favored Glycine 0 N--CA 1.498 2.826 0 N-CA-C 119.849 2.7 . . . . 0.0 119.849 -179.831 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.83 -39.15 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 CA-C-N 118.606 1.203 . . . . 0.0 113.876 172.921 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.36 -48.71 83.71 Favored Glycine 0 N--CA 1.498 2.78 0 N-CA-C 117.544 1.778 . . . . 0.0 117.544 166.527 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.79 -43.04 80.49 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 117.385 2.365 . . . . 0.0 117.385 167.245 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -57.98 -46.47 85.14 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 167.009 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 170.946 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.8 mt -54.8 -40.59 69.64 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 163.382 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.55 -47.45 69.91 Favored Glycine 0 N--CA 1.496 2.646 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 162.979 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -55.6 -54.0 49.49 Favored 'General case' 0 CA--C 1.578 2.029 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 163.792 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.2 mt -52.82 -44.03 66.38 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 176.911 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.3 -52.8 11.82 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 168.513 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.21 75.89 Favored 'General case' 0 CA--C 1.571 1.759 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.664 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.75 -33.32 64.26 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 116.625 2.083 . . . . 0.0 116.625 165.47 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.26 64.35 1.85 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 116.138 1.215 . . . . 0.0 116.138 176.308 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 m -160.01 123.89 3.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.74 -0.859 . . . . 0.0 110.607 -176.174 . . . . . . . . 1 1 . 1 . 002 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.018 -1.051 . . . . 0.0 110.861 178.296 . . . . . . . . 0 0 . 1 . 003 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.496 1.875 0 CA-C-O 121.542 0.687 . . . . 0.0 112.071 . . . . . . . . . 0 0 . 1 . 003 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.48 -42.62 84.27 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 174.526 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.255 9.9 tp -63.22 -38.79 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 168.009 . . . . . . . . 2 2 . 1 . 003 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.42 -43.05 98.83 Favored Glycine 0 N--CA 1.498 2.785 0 N-CA-C 117.796 1.878 . . . . 0.0 117.796 170.839 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.23 -47.74 80.57 Favored 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 165.326 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.1 tp -64.19 -47.82 78.3 Favored 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 115.632 1.715 . . . . 0.0 115.632 171.142 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -59.36 -37.07 76.94 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 172.957 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.7 tt -61.3 -45.48 94.3 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 170.229 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.84 -48.63 85.1 Favored Glycine 0 N--CA 1.501 2.994 0 N-CA-C 117.843 1.897 . . . . 0.0 117.843 167.01 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -48.68 -45.64 39.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 163.804 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 tt -73.2 -54.16 9.14 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 174.191 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.93 -52.35 7.04 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 118.447 2.139 . . . . 0.0 118.447 -177.712 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.13 -47.47 18.12 Favored 'General case' 0 CA--C 1.57 1.725 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 176.978 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.79 -11.29 53.87 Favored 'General case' 0 CA--C 1.576 1.979 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 173.778 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.6 26.52 56.5 Favored Glycine 0 N--CA 1.497 2.739 0 N-CA-C 120.102 2.801 . . . . 0.0 120.102 178.768 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.0 t -117.27 98.97 6.71 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 119.448 1.624 . . . . 0.0 112.547 -172.192 . . . . . . . . 1 1 . 1 . 003 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.501 2.111 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 174.661 . . . . . . . . 0 0 . 1 . 004 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 64.4 t . . . . . 0 N--CA 1.499 2.017 0 CA-C-O 121.224 0.535 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 004 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.05 -50.31 67.26 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 119.238 2.455 . . . . 0.0 119.238 -175.446 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.0 pt -64.19 -31.5 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 N-CA-C 116.182 1.919 . . . . 0.0 116.182 170.382 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.18 -46.65 87.01 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 117.248 1.659 . . . . 0.0 117.248 165.895 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.46 91.22 Favored 'General case' 0 CA--C 1.574 1.894 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 167.656 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.62 -52.58 50.82 Favored 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 170.065 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -72.65 -73.95 0.18 Allowed 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 119.714 1.143 . . . . 0.0 112.46 -178.698 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -66.97 -35.88 80.95 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 -177.026 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -55.86 -54.49 34.76 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 168.699 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.19 -47.69 73.11 Favored 'General case' 0 CA--C 1.575 1.938 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 170.321 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.46 -44.48 68.94 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 173.507 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.01 -54.43 5.29 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 118.051 1.98 . . . . 0.0 118.051 171.07 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.82 -44.38 41.37 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 117.343 2.349 . . . . 0.0 117.343 -177.21 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.02 -35.57 28.71 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 170.176 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.13 76.08 1.32 Allowed Glycine 0 N--CA 1.493 2.453 0 CA-C-N 119.895 1.225 . . . . 0.0 114.381 178.985 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.1 m -162.79 152.93 16.23 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.913 . . . . 0.0 111.883 -173.271 . . . . . . . . 1 1 . 1 . 004 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t . . . . . 0 N--CA 1.504 2.24 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 177.812 . . . . . . . . 0 0 . 1 . 005 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.497 1.892 0 CA-C-O 121.27 0.557 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 005 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.01 -42.56 81.36 Favored Glycine 0 N--CA 1.499 2.885 0 N-CA-C 119.277 2.471 . . . . 0.0 119.277 177.606 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.254 10.3 tp -62.8 -38.54 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 169.268 . . . . . . . . 2 2 . 1 . 005 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -66.39 -46.95 74.11 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 117.398 1.719 . . . . 0.0 117.398 167.623 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.75 -42.4 71.6 Favored 'General case' 0 CA--C 1.575 1.91 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 165.948 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.49 -44.7 95.68 Favored 'General case' 0 CA--C 1.572 1.8 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 167.102 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -55.32 -51.49 66.57 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 168.426 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.8 mt -52.26 -46.6 65.87 Favored 'General case' 0 N--CA 1.499 1.98 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 171.426 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.53 -44.86 95.98 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 118.411 2.124 . . . . 0.0 118.411 168.434 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -51.52 -43.91 62.42 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 175.189 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.3 mt -56.63 -46.14 81.14 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -178.26 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -85.66 -51.41 3.66 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 117.734 1.854 . . . . 0.0 117.734 170.688 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.73 -40.03 69.7 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.635 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.31 -47.38 11.55 Favored 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 165.228 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 115.39 86.0 1.3 Allowed Glycine 0 N--CA 1.49 2.285 0 CA-C-N 119.25 0.932 . . . . 0.0 113.81 174.134 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.3 m -159.88 123.72 3.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.821 -0.811 . . . . 0.0 111.309 -179.45 . . . . . . . . 1 1 . 1 . 005 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.502 2.166 0 O-C-N 120.737 -1.227 . . . . 0.0 114.059 171.823 . . . . . . . . 0 0 . 1 . 006 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 84.9 t . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 121.511 0.672 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 006 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.26 -55.06 17.25 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 118.219 2.047 . . . . 0.0 118.219 -177.092 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.6 mm -64.58 -39.35 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 178.577 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.42 -45.03 97.24 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 167.221 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.16 84.56 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 166.755 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -61.86 -52.33 64.55 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 165.691 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -51.28 -54.39 26.47 Favored 'General case' 0 CA--C 1.573 1.839 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 171.994 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.98 -27.62 64.86 Favored 'General case' 0 CA--C 1.573 1.852 0 N-CA-C 116.573 2.064 . . . . 0.0 116.573 172.96 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.16 -49.95 70.84 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 117.468 1.747 . . . . 0.0 117.468 161.93 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -65.57 -53.72 38.03 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 168.693 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.35 -59.2 3.6 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -177.809 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.69 -50.83 4.05 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 118.307 2.083 . . . . 0.0 118.307 -176.184 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.61 -49.66 25.05 Favored 'General case' 0 CA--C 1.57 1.726 0 N-CA-C 116.613 2.079 . . . . 0.0 116.613 179.963 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.79 -45.05 19.51 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 172.793 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.59 89.71 2.11 Favored Glycine 0 N--CA 1.489 2.2 0 CA-C-N 119.276 0.943 . . . . 0.0 113.112 -176.299 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.2 m -155.87 138.7 15.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.497 -1.002 . . . . 0.0 111.66 -177.574 . . . . . . . . 1 1 . 1 . 006 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.1 p . . . . . 0 N--CA 1.499 2.018 0 O-C-N 120.503 -1.373 . . . . 0.0 112.319 178.359 . . . . . . . . 0 0 . 1 . 007 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.8 t . . . . . 0 N--CA 1.499 2.021 0 CA-C-O 121.641 0.734 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 007 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.69 26.76 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -175.92 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.283 6.8 tp -66.57 -33.62 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 174.565 . . . . . . . . 2 2 . 1 . 007 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.13 -48.19 87.2 Favored Glycine 0 N--CA 1.497 2.752 0 N-CA-C 117.019 1.567 . . . . 0.0 117.019 165.707 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.15 -45.09 75.64 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 166.507 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.22 -56.09 19.56 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 169.748 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.64 -38.83 92.59 Favored 'General case' 0 CA--C 1.569 1.7 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -178.08 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.97 -42.36 99.81 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 120.882 1.674 . . . . 0.0 115.507 170.498 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -60.12 -50.34 68.71 Favored Glycine 0 N--CA 1.498 2.784 0 N-CA-C 117.683 1.833 . . . . 0.0 117.683 165.377 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -50.6 -53.95 26.57 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 165.839 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.59 -40.06 94.85 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 179.534 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.34 -45.86 94.11 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 118.131 2.012 . . . . 0.0 118.131 166.117 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.21 97.11 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 171.44 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.06 -39.97 71.92 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 169.814 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 75.73 1.31 Allowed Glycine 0 N--CA 1.49 2.254 0 CA-C-N 119.563 1.074 . . . . 0.0 114.962 178.322 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.7 m -154.61 138.49 16.28 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.651 -0.911 . . . . 0.0 112.381 -177.87 . . . . . . . . 1 1 . 1 . 007 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t . . . . . 0 N--CA 1.495 1.821 0 O-C-N 121.186 -0.946 . . . . 0.0 112.113 171.439 . . . . . . . . 0 0 . 1 . 008 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.1 t . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 121.395 0.617 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 008 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.68 -59.11 4.57 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 116.919 1.527 . . . . 0.0 116.919 179.907 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.256 13.7 tt -57.96 -41.65 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 172.393 . . . . . . . . 2 2 . 1 . 008 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.03 -44.73 97.37 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 117.964 1.946 . . . . 0.0 117.964 169.125 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.91 -40.94 97.19 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 117.344 2.35 . . . . 0.0 117.344 169.466 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 45.0 tp -62.58 -47.37 84.12 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 167.812 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -57.88 -56.3 23.7 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 169.98 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 41.5 tp -66.13 -40.52 90.71 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 116.435 2.013 . . . . 0.0 116.435 178.114 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.23 -48.02 85.92 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 117.797 1.879 . . . . 0.0 117.797 166.873 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -66.08 -38.68 88.9 Favored 'General case' 0 CA--C 1.578 2.03 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 170.129 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.01 -57.1 12.93 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 170.747 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.1 -53.4 3.32 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -176.99 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.39 -41.23 48.62 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 -179.605 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.3 -49.8 11.89 Favored 'General case' 0 CA--C 1.573 1.836 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 168.029 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 112.18 82.52 1.21 Allowed Glycine 0 N--CA 1.49 2.278 0 CA-C-N 119.229 0.922 . . . . 0.0 113.897 177.251 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.0 m -158.6 105.7 1.85 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.733 -0.863 . . . . 0.0 111.514 -177.408 . . . . . . . . 1 1 . 1 . 008 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.1 t . . . . . 0 N--CA 1.495 1.825 0 O-C-N 120.929 -1.107 . . . . 0.0 112.721 176.994 . . . . . . . . 0 0 . 1 . 009 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 62.2 t . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 009 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.23 -69.71 2.97 Favored Glycine 0 N--CA 1.494 2.538 0 O-C-N 121.339 -0.851 . . . . 0.0 114.936 -172.772 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 28.9 pt -63.03 -36.46 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 176.998 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.79 -46.27 92.24 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 117.535 1.774 . . . . 0.0 117.535 167.343 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.29 -43.34 96.36 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.039 2.237 . . . . 0.0 117.039 167.577 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.6 tp -61.92 -45.47 93.58 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.526 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.57 -41.79 95.31 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 167.919 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.8 tp -60.86 -42.96 98.87 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 116.196 1.924 . . . . 0.0 116.196 169.432 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.89 -47.91 85.74 Favored Glycine 0 N--CA 1.498 2.768 0 N-CA-C 117.837 1.895 . . . . 0.0 117.837 165.972 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -53.76 -59.15 4.98 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 164.833 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.2 tp -68.96 -40.42 78.91 Favored 'General case' 0 CA--C 1.572 1.807 0 N-CA-C 116.309 1.966 . . . . 0.0 116.309 -176.893 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.91 -40.74 97.24 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 118.478 2.151 . . . . 0.0 118.478 167.692 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.4 87.04 Favored 'General case' 0 CA--C 1.573 1.859 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 167.095 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.69 -45.35 59.25 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 117.279 2.326 . . . . 0.0 117.279 174.588 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.99 75.38 1.3 Allowed Glycine 0 N--CA 1.491 2.331 0 CA-C-N 119.483 1.038 . . . . 0.0 115.405 179.981 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.5 m -157.87 148.33 20.67 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.478 -1.013 . . . . 0.0 112.447 -179.363 . . . . . . . . 1 1 . 1 . 009 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 65.2 p . . . . . 0 N--CA 1.501 2.125 0 O-C-N 120.58 -1.325 . . . . 0.0 111.915 175.929 . . . . . . . . 0 0 . 1 . 010 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 N--CA 1.501 2.083 0 CA-C-O 121.776 0.798 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 010 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.3 -56.64 6.71 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 117.385 1.714 . . . . 0.0 117.385 -178.428 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.27 10.3 tp -60.46 -37.16 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 175.545 . . . . . . . . 2 2 . 1 . 010 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.18 -49.67 69.4 Favored Glycine 0 N--CA 1.498 2.788 0 N-CA-C 117.624 1.81 . . . . 0.0 117.624 167.977 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.88 85.22 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 167.839 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.0 tp -61.1 -45.78 93.32 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 168.752 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -61.13 -39.15 88.96 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 116.485 2.032 . . . . 0.0 116.485 170.364 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.2 mt -58.48 -41.51 85.45 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 164.623 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.8 -47.83 69.56 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.301 2.08 . . . . 0.0 118.301 161.3 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -56.9 -49.34 75.86 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 115.924 1.824 . . . . 0.0 115.924 170.1 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 19.7 tp -63.33 -46.1 88.23 Favored 'General case' 0 CA--C 1.573 1.854 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 173.045 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.13 -43.87 95.05 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.719 2.248 . . . . 0.0 118.719 170.026 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.71 -36.94 85.92 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 117.585 2.439 . . . . 0.0 117.585 167.413 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.51 -42.47 67.95 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 172.877 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.52 -57.06 4.18 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.295 1.678 . . . . 0.0 117.295 178.798 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.3 p -72.66 102.51 3.33 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -179.287 . . . . . . . . 1 1 . 1 . 010 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 p . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.591 -0.693 . . . . 0.0 112.598 -173.108 . . . . . . . . 0 0 . 1 . 011 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 121.075 0.464 . . . . 0.0 112.095 . . . . . . . . . 0 0 . 1 . 011 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.41 93.2 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 118.828 2.291 . . . . 0.0 118.828 176.446 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.59 -40.79 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.374 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 172.568 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.12 -44.36 97.32 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 118.204 2.042 . . . . 0.0 118.204 168.753 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.14 -44.22 83.18 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 116.938 2.199 . . . . 0.0 116.938 165.456 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 mt -56.77 -48.42 77.9 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 165.676 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.28 -38.22 90.27 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 174.908 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.58 -45.41 85.27 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 162.814 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.9 -45.6 61.32 Favored Glycine 0 N--CA 1.496 2.648 0 N-CA-C 118.758 2.263 . . . . 0.0 118.758 163.884 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -61.11 -52.2 65.88 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 170.607 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 60.7 tp -46.53 -52.81 12.58 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 117.087 2.254 . . . . 0.0 117.087 167.059 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.85 -56.48 4.88 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 117.832 1.893 . . . . 0.0 117.832 177.109 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.13 92.29 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 117.403 2.372 . . . . 0.0 117.403 -179.429 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.24 20.74 2.64 Favored 'General case' 0 CA--C 1.58 2.123 0 N-CA-C 117.111 2.263 . . . . 0.0 117.111 164.683 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 41.46 49.6 4.74 Favored Glycine 0 N--CA 1.499 2.866 0 N-CA-C 121.799 3.479 . . . . 0.0 121.799 169.581 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p -159.1 134.88 8.72 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 117.821 0.811 . . . . 0.0 112.281 -164.713 . . . . . . . . 1 1 . 1 . 011 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.5 m . . . . . 0 N--CA 1.496 1.863 0 O-C-N 121.165 -0.959 . . . . 0.0 111.323 -179.073 . . . . . . . . 0 0 . 1 . 012 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 012 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -54.17 -43.25 74.07 Favored Glycine 0 N--CA 1.502 3.094 0 N-CA-C 119.358 2.503 . . . . 0.0 119.358 173.903 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 58.2 mt -61.91 -40.03 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 167.422 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.57 -48.32 85.34 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 117.822 1.889 . . . . 0.0 117.822 168.618 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.93 -41.47 78.27 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 117.246 2.313 . . . . 0.0 117.246 166.497 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.17 -46.83 82.46 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 165.036 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -60.36 -51.86 67.72 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 172.842 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.77 -32.1 73.49 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 171.314 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.27 -49.01 83.15 Favored Glycine 0 N--CA 1.495 2.575 0 N-CA-C 117.823 1.889 . . . . 0.0 117.823 161.663 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.89 -53.56 30.97 Favored 'General case' 0 CA--C 1.578 2.05 0 N-CA-C 115.781 1.771 . . . . 0.0 115.781 174.634 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.8 -49.52 20.44 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 176.831 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -83.57 -61.19 1.9 Allowed Glycine 0 N--CA 1.492 2.415 0 N-CA-C 117.252 1.661 . . . . 0.0 117.252 -175.765 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.47 -47.45 67.06 Favored 'General case' 0 CA--C 1.571 1.778 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 179.3 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.45 -22.68 43.82 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 118.058 2.614 . . . . 0.0 118.058 171.554 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.86 -6.77 77.27 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 120.056 2.783 . . . . 0.0 120.056 -175.788 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.2 p -77.9 99.81 6.14 Favored 'General case' 0 CA--C 1.565 1.549 0 CA-C-N 119.669 1.734 . . . . 0.0 112.352 175.609 . . . . . . . . 1 1 . 1 . 012 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 59.6 p . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -164.87 . . . . . . . . 0 0 . 1 . 013 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 90.7 t . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 121.497 0.665 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 013 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -58.59 4.66 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 116.848 1.499 . . . . 0.0 116.848 178.094 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -62.4 -36.52 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 177.267 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.95 -51.36 54.0 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 117.068 1.587 . . . . 0.0 117.068 168.797 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.13 -40.73 86.38 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 169.325 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 tp -61.86 -48.97 78.13 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 170.215 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -66.22 -40.98 90.69 Favored 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 173.081 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 tp -49.47 -49.93 43.36 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 116.459 2.022 . . . . 0.0 116.459 162.037 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.86 -45.04 96.5 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 118.402 2.121 . . . . 0.0 118.402 167.906 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -58.16 -46.14 86.23 Favored 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.542 2.053 . . . . 0.0 116.542 168.909 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.0 mt -54.04 -46.4 71.9 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 168.255 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.09 -49.6 45.93 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 118.345 2.098 . . . . 0.0 118.345 170.813 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.28 80.38 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 178.639 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.86 -37.02 56.36 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 168.61 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.06 66.52 1.65 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 116.107 1.203 . . . . 0.0 116.107 177.577 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.8 m -159.78 147.07 16.65 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.605 -0.938 . . . . 0.0 112.158 -176.204 . . . . . . . . 1 1 . 1 . 013 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.5 p . . . . . 0 N--CA 1.498 1.968 0 O-C-N 120.938 -1.101 . . . . 0.0 110.899 173.196 . . . . . . . . 0 0 . 1 . 014 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 121.57 0.7 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 014 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.88 -57.38 4.95 Favored Glycine 0 N--CA 1.496 2.688 0 O-C-N 120.632 -1.292 . . . . 0.0 116.117 -170.047 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.4 mt -57.76 -47.68 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 124.521 1.128 . . . . 0.0 113.917 177.454 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.67 -42.04 99.17 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 118.464 2.146 . . . . 0.0 118.464 169.221 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.54 -42.02 95.66 Favored 'General case' 0 CA--C 1.575 1.914 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 166.581 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.0 -51.42 66.3 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 163.998 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -57.71 -42.68 84.25 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 171.459 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.0 mt -60.92 -44.69 96.84 Favored 'General case' 0 CA--C 1.574 1.879 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 169.349 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.21 -47.39 91.07 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 117.981 1.953 . . . . 0.0 117.981 166.848 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -47.16 -54.16 11.29 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 160.844 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.34 -43.56 90.53 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 179.238 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.14 -42.86 99.92 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 118.323 2.089 . . . . 0.0 118.323 168.513 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.94 94.55 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 169.098 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.78 -37.74 64.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 172.62 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 62.85 1.57 Allowed Glycine 0 N--CA 1.493 2.455 0 CA-C-N 119.724 1.147 . . . . 0.0 115.796 -176.297 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.1 t -145.79 -179.73 6.89 Favored 'General case' 0 CA--C 1.573 1.847 0 CA-C-O 122.711 1.243 . . . . 0.0 113.233 -172.628 . . . . . . . . 1 1 . 1 . 014 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.6 m . . . . . 0 N--CA 1.497 1.922 0 O-C-N 119.96 -1.713 . . . . 0.0 108.082 170.353 . . . . . . . . 0 0 . 1 . 015 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 m . . . . . 0 N--CA 1.504 2.248 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 . . . . . . . . . 0 0 . 1 . 015 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.52 -56.64 4.54 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 116.674 1.43 . . . . 0.0 116.674 176.45 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.257 36.9 pt -63.75 -40.05 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 172.99 . . . . . . . . 2 2 . 1 . 015 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.68 -48.63 70.16 Favored Glycine 0 N--CA 1.496 2.671 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 167.829 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 166.349 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -62.07 -46.09 90.63 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 167.02 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -59.38 -48.55 81.22 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 171.494 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.9 mt -59.96 -43.38 95.07 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 169.932 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.61 -50.87 62.72 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 117.786 1.874 . . . . 0.0 117.786 167.82 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -61.91 -47.61 84.18 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 171.428 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.69 -36.35 80.63 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 174.558 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.76 -53.35 7.33 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 117.821 1.888 . . . . 0.0 117.821 167.899 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.64 -46.55 18.95 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -177.867 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.59 -37.54 24.89 Favored 'General case' 0 CA--C 1.571 1.762 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 171.129 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.04 47.93 5.35 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 118.275 2.07 . . . . 0.0 118.275 173.808 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.8 p -84.23 69.78 10.48 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.02 . . . . . . . . 1 1 . 1 . 015 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.8 m . . . . . 0 N--CA 1.499 1.979 0 C-N-CA 123.394 0.678 . . . . 0.0 112.746 -177.483 . . . . . . . . 0 0 . 1 . 016 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.5 t . . . . . 0 N--CA 1.5 2.045 0 CA-C-O 121.589 0.709 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 016 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -57.97 4.97 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 117.278 1.671 . . . . 0.0 117.278 -179.039 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 31.2 mt -63.01 -41.55 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 177.214 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.32 -44.99 96.13 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 168.553 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.31 91.76 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.005 2.224 . . . . 0.0 117.005 166.501 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.87 -47.69 84.02 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 167.631 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -62.53 -41.73 99.06 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 169.345 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.9 -47.98 81.21 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 169.351 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.35 -48.82 77.64 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 166.971 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -49.16 -50.73 36.38 Favored 'General case' 0 CA--C 1.579 2.073 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 164.465 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.63 -49.02 79.21 Favored 'General case' 0 CA--C 1.574 1.871 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 174.322 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.22 -50.73 63.88 Favored Glycine 0 N--CA 1.494 2.54 0 N-CA-C 118.246 2.058 . . . . 0.0 118.246 170.914 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.55 74.9 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 172.273 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.2 -2.37 21.42 Favored 'General case' 0 CA--C 1.577 1.982 0 N-CA-C 118.746 2.869 . . . . 0.0 118.746 167.34 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 54.49 36.16 57.83 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 119.712 2.645 . . . . 0.0 119.712 -177.506 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.0 p -165.02 135.06 3.73 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.547 0.674 . . . . 0.0 110.226 -161.158 . . . . . . . . 1 1 . 1 . 016 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 69.3 p . . . . . 0 N--CA 1.5 2.05 0 O-C-N 120.985 -1.072 . . . . 0.0 113.874 -172.907 . . . . . . . . 0 0 . 1 . 017 ecloud build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.3 m . . . . . 0 N--CA 1.497 1.923 0 CA-C-O 121.299 0.571 . . . . 0.0 112.024 . . . . . . . . . 0 0 . 1 . 017 ecloud build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.88 -37.86 71.8 Favored Glycine 0 N--CA 1.499 2.897 0 N-CA-C 119.608 2.603 . . . . 0.0 119.608 177.436 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.11 -48.69 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.267 0 CA-C-N 118.333 1.067 . . . . 0.0 113.154 171.497 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.34 -51.76 55.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.339 1.696 . . . . 0.0 117.339 169.84 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.9 71.35 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 117.715 2.487 . . . . 0.0 117.715 171.293 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.2 -55.74 12.82 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 169.868 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.32 -41.37 94.07 Favored 'General case' 0 CA--C 1.572 1.82 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 -176.126 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.36 -42.8 99.29 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.332 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -61.45 -49.0 81.74 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 117.814 1.886 . . . . 0.0 117.814 164.358 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -52.9 -57.42 10.31 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.169 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.4 tp -68.52 -37.63 80.19 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 178.905 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.34 -47.11 91.58 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 165.181 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.28 78.01 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 167.558 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.91 -36.86 85.32 Favored 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.827 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.45 -60.32 0.45 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 116.342 1.297 . . . . 0.0 116.342 173.346 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 85.3 p -77.12 89.71 3.63 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.03 . . . . . . . . 1 1 . 1 . 017 ecloud build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.5 p . . . . . 0 N--CA 1.497 1.902 0 O-C-N 121.493 -0.754 . . . . 0.0 112.877 -173.382 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.565 0 CA-C-O 121.783 0.801 . . . . 0.0 112.685 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 96.2 t -86.68 83.23 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.012 -1.055 . . . . 0.0 110.114 -177.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -65.12 -55.34 22.16 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 118.268 2.067 . . . . 0.0 118.268 -174.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 38.4 pt -62.02 -34.51 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 173.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -64.15 -55.16 25.53 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 116.234 1.254 . . . . 0.0 116.234 167.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -52.57 -42.14 64.2 Favored 'General case' 0 CA--C 1.575 1.941 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 167.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.9 tp -64.93 -57.21 9.37 Favored 'General case' 0 CA--C 1.57 1.733 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 172.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -68.81 -41.66 78.34 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.75 -39.41 73.29 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.374 1.443 . . . . 0.0 114.598 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.26 -48.0 86.1 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 117.669 1.827 . . . . 0.0 117.669 162.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -47.96 -52.48 19.48 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 116.569 2.063 . . . . 0.0 116.569 161.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.6 -45.13 94.32 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.76 -43.7 98.88 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 118.486 2.154 . . . . 0.0 118.486 168.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.84 91.25 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 170.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.63 -39.18 58.19 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 174.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.32 43.08 55.72 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 118.234 2.054 . . . . 0.0 118.234 -176.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 m -165.33 153.73 11.67 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.494 1.117 . . . . 0.0 110.487 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.3 p -77.42 78.75 3.94 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 120.515 -1.366 . . . . 0.0 113.314 -177.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 59.4 mtt -93.56 73.18 4.38 Favored 'General case' 0 CA--C 1.57 1.736 0 CA-C-O 121.838 0.828 . . . . 0.0 112.925 -171.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -162.13 81.69 0.13 Allowed Glycine 0 N--CA 1.492 2.372 0 O-C-N 121.169 -0.957 . . . . 0.0 113.575 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -83.16 81.61 8.61 Favored 'General case' 0 CA--C 1.57 1.721 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -88.27 79.9 7.68 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-O 121.998 0.904 . . . . 0.0 112.716 -169.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.1 t -84.64 73.27 10.6 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.138 1.447 . . . . 0.0 114.403 -175.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.813 0 O-C-N 117.371 -3.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.547 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 . . . . . . . . . 0 0 . 1 . 002 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.7 p -85.11 104.1 12.85 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.849 0 O-C-N 120.917 -1.114 . . . . 0.0 111.607 178.743 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -57.38 -38.39 86.57 Favored Glycine 0 N--CA 1.498 2.826 0 N-CA-C 119.849 2.7 . . . . 0.0 119.849 -179.831 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.83 -39.15 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 CA-C-N 118.606 1.203 . . . . 0.0 113.876 172.921 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.36 -48.71 83.71 Favored Glycine 0 N--CA 1.498 2.78 0 N-CA-C 117.544 1.778 . . . . 0.0 117.544 166.527 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.79 -43.04 80.49 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 117.385 2.365 . . . . 0.0 117.385 167.245 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -57.98 -46.47 85.14 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 167.009 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 170.946 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.8 mt -54.8 -40.59 69.64 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 163.382 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.55 -47.45 69.91 Favored Glycine 0 N--CA 1.496 2.646 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 162.979 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -55.6 -54.0 49.49 Favored 'General case' 0 CA--C 1.578 2.029 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 163.792 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.2 mt -52.82 -44.03 66.38 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 176.911 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.3 -52.8 11.82 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 168.513 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.21 75.89 Favored 'General case' 0 CA--C 1.571 1.759 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.664 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.75 -33.32 64.26 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 116.625 2.083 . . . . 0.0 116.625 165.47 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.26 64.35 1.85 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 116.138 1.215 . . . . 0.0 116.138 176.308 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 m -160.01 123.89 3.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.74 -0.859 . . . . 0.0 110.607 -176.174 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m -82.35 101.78 10.81 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.018 -1.051 . . . . 0.0 110.861 178.296 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 24.1 mmt -83.43 83.54 7.84 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 113.483 0.919 . . . . 0.0 113.483 -173.281 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -86.03 66.79 3.64 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 115.94 1.136 . . . . 0.0 115.94 173.899 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.05 -51.92 28.18 Favored 'General case' 0 CA--C 1.567 1.624 0 N-CA-C 116.511 2.041 . . . . 0.0 116.511 -175.042 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.79 60.36 6.18 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 174.598 . . . . . . . . 2 2 . 1 . 002 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.0 m -89.19 86.75 6.94 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 123.486 1.612 . . . . 0.0 112.546 -176.009 . . . . . . . . 1 1 . 1 . 002 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.781 0 O-C-N 117.416 -3.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.577 0 CA-C-O 121.764 0.792 . . . . 0.0 112.661 . . . . . . . . . 0 0 . 1 . 003 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.0 m -83.71 104.12 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.014 -1.054 . . . . 0.0 112.071 -178.932 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.48 -42.62 84.27 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 174.526 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.255 9.9 tp -63.22 -38.79 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 168.009 . . . . . . . . 2 2 . 1 . 003 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.42 -43.05 98.83 Favored Glycine 0 N--CA 1.498 2.785 0 N-CA-C 117.796 1.878 . . . . 0.0 117.796 170.839 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.23 -47.74 80.57 Favored 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 165.326 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.1 tp -64.19 -47.82 78.3 Favored 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 115.632 1.715 . . . . 0.0 115.632 171.142 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -59.36 -37.07 76.94 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 172.957 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.7 tt -61.3 -45.48 94.3 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 170.229 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.84 -48.63 85.1 Favored Glycine 0 N--CA 1.501 2.994 0 N-CA-C 117.843 1.897 . . . . 0.0 117.843 167.01 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -48.68 -45.64 39.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 163.804 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 tt -73.2 -54.16 9.14 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 174.191 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.93 -52.35 7.04 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 118.447 2.139 . . . . 0.0 118.447 -177.712 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.13 -47.47 18.12 Favored 'General case' 0 CA--C 1.57 1.725 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 176.978 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.79 -11.29 53.87 Favored 'General case' 0 CA--C 1.576 1.979 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 173.778 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.6 26.52 56.5 Favored Glycine 0 N--CA 1.497 2.739 0 N-CA-C 120.102 2.801 . . . . 0.0 120.102 178.768 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.0 t -117.27 98.97 6.71 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 119.448 1.624 . . . . 0.0 112.547 -172.192 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t -87.67 57.4 4.36 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 174.661 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 43.3 ttp -89.17 73.61 8.1 Favored 'General case' 0 CA--C 1.573 1.847 0 O-C-N 120.34 -1.475 . . . . 0.0 113.572 -172.98 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.13 88.7 1.2 Allowed Glycine 0 N--CA 1.492 2.381 0 O-C-N 120.904 -1.122 . . . . 0.0 114.18 177.124 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.73 83.71 6.43 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -178.92 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -92.74 86.01 5.4 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.868 0.842 . . . . 0.0 111.946 -169.754 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.2 m -157.34 134.02 9.97 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 123.0 1.381 . . . . 0.0 111.023 179.817 . . . . . . . . 1 1 . 1 . 003 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.76 0 O-C-N 117.079 -3.513 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.555 0 CA-C-O 121.784 0.802 . . . . 0.0 112.668 . . . . . . . . . 0 0 . 1 . 004 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 64.4 t -86.69 90.06 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 120.966 -1.084 . . . . 0.0 109.736 -177.092 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.05 -50.31 67.26 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 119.238 2.455 . . . . 0.0 119.238 -175.446 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.0 pt -64.19 -31.5 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 N-CA-C 116.182 1.919 . . . . 0.0 116.182 170.382 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.18 -46.65 87.01 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 117.248 1.659 . . . . 0.0 117.248 165.895 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.46 91.22 Favored 'General case' 0 CA--C 1.574 1.894 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 167.656 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.62 -52.58 50.82 Favored 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 170.065 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -72.65 -73.95 0.18 Allowed 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 119.714 1.143 . . . . 0.0 112.46 -178.698 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -66.97 -35.88 80.95 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 -177.026 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -55.86 -54.49 34.76 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 168.699 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.19 -47.69 73.11 Favored 'General case' 0 CA--C 1.575 1.938 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 170.321 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.46 -44.48 68.94 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 173.507 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.01 -54.43 5.29 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 118.051 1.98 . . . . 0.0 118.051 171.07 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.82 -44.38 41.37 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 117.343 2.349 . . . . 0.0 117.343 -177.21 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.02 -35.57 28.71 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 170.176 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.13 76.08 1.32 Allowed Glycine 0 N--CA 1.493 2.453 0 CA-C-N 119.895 1.225 . . . . 0.0 114.381 178.985 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.1 m -162.79 152.93 16.23 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.913 . . . . 0.0 111.883 -173.271 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -76.09 54.44 0.86 Allowed 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 177.812 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 36.4 ttm -86.74 95.35 9.79 Favored 'General case' 0 CA--C 1.568 1.658 0 O-C-N 120.488 -1.383 . . . . 0.0 110.712 175.86 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -166.37 91.95 0.1 Allowed Glycine 0 N--CA 1.487 2.046 0 O-C-N 121.629 -0.669 . . . . 0.0 113.195 -174.322 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -108.32 61.29 0.61 Allowed 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 172.132 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.92 -44.2 3.49 Favored 'General case' 0 CA--C 1.57 1.735 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 177.181 . . . . . . . . 2 2 . 1 . 004 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.9 m -156.33 99.7 1.93 Allowed 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 123.221 1.486 . . . . 0.0 110.122 178.528 . . . . . . . . 1 1 . 1 . 004 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.781 0 O-C-N 117.085 -3.509 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.543 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 . . . . . . . . . 0 0 . 1 . 005 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.2 m -84.09 104.92 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 120.959 -1.088 . . . . 0.0 111.77 -179.434 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.01 -42.56 81.36 Favored Glycine 0 N--CA 1.499 2.885 0 N-CA-C 119.277 2.471 . . . . 0.0 119.277 177.606 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.254 10.3 tp -62.8 -38.54 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 169.268 . . . . . . . . 2 2 . 1 . 005 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -66.39 -46.95 74.11 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 117.398 1.719 . . . . 0.0 117.398 167.623 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.75 -42.4 71.6 Favored 'General case' 0 CA--C 1.575 1.91 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 165.948 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.49 -44.7 95.68 Favored 'General case' 0 CA--C 1.572 1.8 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 167.102 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -55.32 -51.49 66.57 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 168.426 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.8 mt -52.26 -46.6 65.87 Favored 'General case' 0 N--CA 1.499 1.98 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 171.426 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.53 -44.86 95.98 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 118.411 2.124 . . . . 0.0 118.411 168.434 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -51.52 -43.91 62.42 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 175.189 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.3 mt -56.63 -46.14 81.14 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -178.26 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -85.66 -51.41 3.66 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 117.734 1.854 . . . . 0.0 117.734 170.688 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.73 -40.03 69.7 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.635 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.31 -47.38 11.55 Favored 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 165.228 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 115.39 86.0 1.3 Allowed Glycine 0 N--CA 1.49 2.285 0 CA-C-N 119.25 0.932 . . . . 0.0 113.81 174.134 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.3 m -159.88 123.72 3.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.821 -0.811 . . . . 0.0 111.309 -179.45 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -83.59 63.08 7.19 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.737 -1.227 . . . . 0.0 114.059 171.823 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 25.0 ttt -104.25 129.09 52.07 Favored 'General case' 0 CA--C 1.568 1.646 0 O-C-N 121.155 -0.965 . . . . 0.0 112.004 -175.996 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -103.02 122.33 7.46 Favored Glycine 0 N--CA 1.489 2.175 0 O-C-N 121.424 -0.797 . . . . 0.0 114.301 176.074 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.22 78.51 8.0 Favored 'General case' 0 CA--C 1.573 1.845 0 O-C-N 121.631 -0.923 . . . . 0.0 112.945 170.488 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -158.68 122.58 3.96 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.333 -0.854 . . . . 0.0 111.414 -165.962 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -83.2 74.93 9.97 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 123.015 1.388 . . . . 0.0 114.165 -179.272 . . . . . . . . 1 1 . 1 . 005 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.8 0 O-C-N 117.449 -3.282 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.539 0 CA-C-O 121.799 0.809 . . . . 0.0 112.727 . . . . . . . . . 0 0 . 1 . 006 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 84.9 t -86.67 84.71 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 120.998 -1.063 . . . . 0.0 110.216 -176.839 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.26 -55.06 17.25 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 118.219 2.047 . . . . 0.0 118.219 -177.092 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.6 mm -64.58 -39.35 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 178.577 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.42 -45.03 97.24 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 167.221 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.16 84.56 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 166.755 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -61.86 -52.33 64.55 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 165.691 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -51.28 -54.39 26.47 Favored 'General case' 0 CA--C 1.573 1.839 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 171.994 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.98 -27.62 64.86 Favored 'General case' 0 CA--C 1.573 1.852 0 N-CA-C 116.573 2.064 . . . . 0.0 116.573 172.96 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.16 -49.95 70.84 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 117.468 1.747 . . . . 0.0 117.468 161.93 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -65.57 -53.72 38.03 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 168.693 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.35 -59.2 3.6 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -177.809 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.69 -50.83 4.05 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 118.307 2.083 . . . . 0.0 118.307 -176.184 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.61 -49.66 25.05 Favored 'General case' 0 CA--C 1.57 1.726 0 N-CA-C 116.613 2.079 . . . . 0.0 116.613 179.963 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.79 -45.05 19.51 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 172.793 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.59 89.71 2.11 Favored Glycine 0 N--CA 1.489 2.2 0 CA-C-N 119.276 0.943 . . . . 0.0 113.112 -176.299 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.2 m -155.87 138.7 15.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.497 -1.002 . . . . 0.0 111.66 -177.574 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.1 p -80.75 79.24 7.44 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.503 -1.373 . . . . 0.0 112.319 178.359 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 24.0 mmt -90.94 93.11 9.06 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-O 121.814 0.816 . . . . 0.0 110.666 -177.001 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -88.08 77.68 1.84 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 116.358 1.303 . . . . 0.0 116.358 -176.101 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.23 81.94 7.94 Favored 'General case' 0 CA--C 1.57 1.743 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 177.548 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -144.33 -67.62 0.33 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.647 -0.658 . . . . 0.0 112.099 -178.422 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.7 m -158.63 127.6 5.51 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 122.829 1.3 . . . . 0.0 110.446 179.819 . . . . . . . . 1 1 . 1 . 006 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.755 0 O-C-N 117.26 -3.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.552 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 . . . . . . . . . 0 0 . 1 . 007 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.8 t -87.35 85.05 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 120.846 -1.159 . . . . 0.0 110.131 -177.832 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.69 26.76 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -175.92 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.283 6.8 tp -66.57 -33.62 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 174.565 . . . . . . . . 2 2 . 1 . 007 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.13 -48.19 87.2 Favored Glycine 0 N--CA 1.497 2.752 0 N-CA-C 117.019 1.567 . . . . 0.0 117.019 165.707 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.15 -45.09 75.64 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 166.507 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.22 -56.09 19.56 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 169.748 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.64 -38.83 92.59 Favored 'General case' 0 CA--C 1.569 1.7 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -178.08 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.97 -42.36 99.81 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 120.882 1.674 . . . . 0.0 115.507 170.498 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -60.12 -50.34 68.71 Favored Glycine 0 N--CA 1.498 2.784 0 N-CA-C 117.683 1.833 . . . . 0.0 117.683 165.377 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -50.6 -53.95 26.57 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 165.839 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.59 -40.06 94.85 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 179.534 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.34 -45.86 94.11 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 118.131 2.012 . . . . 0.0 118.131 166.117 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.21 97.11 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 171.44 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.06 -39.97 71.92 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 169.814 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 75.73 1.31 Allowed Glycine 0 N--CA 1.49 2.254 0 CA-C-N 119.563 1.074 . . . . 0.0 114.962 178.322 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.7 m -154.61 138.49 16.28 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.651 -0.911 . . . . 0.0 112.381 -177.87 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t -86.08 129.89 34.7 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.186 -0.946 . . . . 0.0 112.113 171.439 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 26.1 ttt -81.42 123.8 28.88 Favored 'General case' 0 CA--C 1.571 1.764 0 O-C-N 121.098 -1.001 . . . . 0.0 112.683 -179.509 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -163.52 -82.19 0.04 OUTLIER Glycine 0 N--CA 1.489 2.195 0 O-C-N 121.686 -0.634 . . . . 0.0 113.037 176.746 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.79 73.08 9.85 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 175.46 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -91.87 86.24 5.84 Favored 'General case' 0 CA--C 1.568 1.664 0 O-C-N 121.1 -1.0 . . . . 0.0 111.78 -176.452 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -84.04 70.77 10.54 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 123.127 1.442 . . . . 0.0 114.376 -178.638 . . . . . . . . 1 1 . 1 . 007 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.734 0 O-C-N 117.301 -3.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.531 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 . . . . . . . . . 0 0 . 1 . 008 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.1 t -86.2 82.15 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 120.901 -1.124 . . . . 0.0 110.443 -176.474 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.68 -59.11 4.57 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 116.919 1.527 . . . . 0.0 116.919 179.907 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.256 13.7 tt -57.96 -41.65 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 172.393 . . . . . . . . 2 2 . 1 . 008 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.03 -44.73 97.37 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 117.964 1.946 . . . . 0.0 117.964 169.125 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.91 -40.94 97.19 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 117.344 2.35 . . . . 0.0 117.344 169.466 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 45.0 tp -62.58 -47.37 84.12 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 167.812 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -57.88 -56.3 23.7 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 169.98 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 41.5 tp -66.13 -40.52 90.71 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 116.435 2.013 . . . . 0.0 116.435 178.114 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.23 -48.02 85.92 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 117.797 1.879 . . . . 0.0 117.797 166.873 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -66.08 -38.68 88.9 Favored 'General case' 0 CA--C 1.578 2.03 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 170.129 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.01 -57.1 12.93 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 170.747 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.1 -53.4 3.32 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -176.99 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.39 -41.23 48.62 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 -179.605 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.3 -49.8 11.89 Favored 'General case' 0 CA--C 1.573 1.836 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 168.029 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 112.18 82.52 1.21 Allowed Glycine 0 N--CA 1.49 2.278 0 CA-C-N 119.229 0.922 . . . . 0.0 113.897 177.251 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.0 m -158.6 105.7 1.85 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.733 -0.863 . . . . 0.0 111.514 -177.408 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.1 t -81.57 110.83 17.32 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.929 -1.107 . . . . 0.0 112.721 176.994 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -79.96 88.71 5.32 Favored 'General case' 0 CA--C 1.571 1.787 0 O-C-N 121.026 -1.046 . . . . 0.0 112.847 -175.837 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -83.18 78.7 1.99 Allowed Glycine 0 N--CA 1.493 2.477 0 N-CA-C 116.14 1.216 . . . . 0.0 116.14 -179.545 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.57 86.14 5.25 Favored 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -177.58 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -86.68 80.62 8.5 Favored 'General case' 0 CA--C 1.57 1.717 0 O-C-N 121.292 -0.88 . . . . 0.0 112.614 -172.732 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.1 t -84.98 73.59 10.66 Favored 'General case' 0 CA--C 1.569 1.673 0 CA-C-O 123.175 1.464 . . . . 0.0 114.434 -175.534 . . . . . . . . 1 1 . 1 . 008 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.773 0 O-C-N 117.346 -3.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.567 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 . . . . . . . . . 0 0 . 1 . 009 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 62.2 t -85.16 106.61 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.294 -0.879 . . . . 0.0 109.355 -175.125 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.23 -69.71 2.97 Favored Glycine 0 N--CA 1.494 2.538 0 O-C-N 121.339 -0.851 . . . . 0.0 114.936 -172.772 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 28.9 pt -63.03 -36.46 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 176.998 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.79 -46.27 92.24 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 117.535 1.774 . . . . 0.0 117.535 167.343 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.29 -43.34 96.36 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.039 2.237 . . . . 0.0 117.039 167.577 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.6 tp -61.92 -45.47 93.58 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.526 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.57 -41.79 95.31 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 167.919 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.8 tp -60.86 -42.96 98.87 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 116.196 1.924 . . . . 0.0 116.196 169.432 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.89 -47.91 85.74 Favored Glycine 0 N--CA 1.498 2.768 0 N-CA-C 117.837 1.895 . . . . 0.0 117.837 165.972 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -53.76 -59.15 4.98 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 164.833 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.2 tp -68.96 -40.42 78.91 Favored 'General case' 0 CA--C 1.572 1.807 0 N-CA-C 116.309 1.966 . . . . 0.0 116.309 -176.893 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.91 -40.74 97.24 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 118.478 2.151 . . . . 0.0 118.478 167.692 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.4 87.04 Favored 'General case' 0 CA--C 1.573 1.859 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 167.095 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.69 -45.35 59.25 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 117.279 2.326 . . . . 0.0 117.279 174.588 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.99 75.38 1.3 Allowed Glycine 0 N--CA 1.491 2.331 0 CA-C-N 119.483 1.038 . . . . 0.0 115.405 179.981 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.5 m -157.87 148.33 20.67 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.478 -1.013 . . . . 0.0 112.447 -179.363 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 65.2 p -90.58 74.57 6.75 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.58 -1.325 . . . . 0.0 111.915 175.929 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 12.8 tpt -101.55 88.16 3.36 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.132 -0.98 . . . . 0.0 111.316 -174.959 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -153.47 -51.22 0.01 OUTLIER Glycine 0 N--CA 1.497 2.729 0 N-CA-C 117.635 1.814 . . . . 0.0 117.635 -178.321 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.36 89.11 2.6 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -173.502 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.7 ptt-85 -145.19 -56.1 0.32 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -179.523 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.6 t -85.06 74.72 10.46 Favored 'General case' 0 CA--C 1.569 1.685 0 CA-C-O 122.972 1.368 . . . . 0.0 114.062 -176.631 . . . . . . . . 1 1 . 1 . 009 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.791 0 O-C-N 117.538 -3.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.523 0 CA-C-O 121.912 0.863 . . . . 0.0 112.714 . . . . . . . . . 0 0 . 1 . 010 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.3 t -86.38 82.35 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 120.806 -1.184 . . . . 0.0 110.174 -177.753 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.3 -56.64 6.71 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 117.385 1.714 . . . . 0.0 117.385 -178.428 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.27 10.3 tp -60.46 -37.16 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 175.545 . . . . . . . . 2 2 . 1 . 010 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.18 -49.67 69.4 Favored Glycine 0 N--CA 1.498 2.788 0 N-CA-C 117.624 1.81 . . . . 0.0 117.624 167.977 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.88 85.22 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 167.839 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.0 tp -61.1 -45.78 93.32 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 168.752 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -61.13 -39.15 88.96 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 116.485 2.032 . . . . 0.0 116.485 170.364 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.2 mt -58.48 -41.51 85.45 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 164.623 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.8 -47.83 69.56 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.301 2.08 . . . . 0.0 118.301 161.3 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -56.9 -49.34 75.86 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 115.924 1.824 . . . . 0.0 115.924 170.1 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 19.7 tp -63.33 -46.1 88.23 Favored 'General case' 0 CA--C 1.573 1.854 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 173.045 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.13 -43.87 95.05 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.719 2.248 . . . . 0.0 118.719 170.026 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.71 -36.94 85.92 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 117.585 2.439 . . . . 0.0 117.585 167.413 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.51 -42.47 67.95 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 172.877 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.52 -57.06 4.18 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.295 1.678 . . . . 0.0 117.295 178.798 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.3 p -72.66 102.51 3.33 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -179.287 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 p -81.07 91.43 6.1 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.591 -0.693 . . . . 0.0 112.598 -173.108 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -89.44 90.11 8.16 Favored 'General case' 0 CA--C 1.57 1.717 0 CA-C-O 121.656 0.741 . . . . 0.0 111.849 -176.132 . . . . . . . . 2 2 . 1 . 010 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.77 61.83 1.65 Allowed Glycine 0 N--CA 1.497 2.707 0 N-CA-C 116.462 1.345 . . . . 0.0 116.462 177.796 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -140.91 96.21 2.97 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 117.603 0.702 . . . . 0.0 110.897 -178.077 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -89.32 83.57 6.44 Favored 'General case' 0 CA--C 1.57 1.734 0 O-C-N 121.091 -1.006 . . . . 0.0 111.854 -171.783 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.0 p -84.47 86.01 7.33 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.94 1.353 . . . . 0.0 113.657 -177.106 . . . . . . . . 1 1 . 1 . 010 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.804 0 O-C-N 117.679 -3.138 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.55 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 . . . . . . . . . 0 0 . 1 . 011 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.8 m -85.46 110.54 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 120.932 -1.105 . . . . 0.0 112.095 179.485 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.41 93.2 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 118.828 2.291 . . . . 0.0 118.828 176.446 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.59 -40.79 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.374 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 172.568 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.12 -44.36 97.32 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 118.204 2.042 . . . . 0.0 118.204 168.753 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.14 -44.22 83.18 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 116.938 2.199 . . . . 0.0 116.938 165.456 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 mt -56.77 -48.42 77.9 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 165.676 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.28 -38.22 90.27 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 174.908 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.58 -45.41 85.27 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 162.814 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.9 -45.6 61.32 Favored Glycine 0 N--CA 1.496 2.648 0 N-CA-C 118.758 2.263 . . . . 0.0 118.758 163.884 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -61.11 -52.2 65.88 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 170.607 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 60.7 tp -46.53 -52.81 12.58 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 117.087 2.254 . . . . 0.0 117.087 167.059 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.85 -56.48 4.88 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 117.832 1.893 . . . . 0.0 117.832 177.109 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.13 92.29 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 117.403 2.372 . . . . 0.0 117.403 -179.429 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.24 20.74 2.64 Favored 'General case' 0 CA--C 1.58 2.123 0 N-CA-C 117.111 2.263 . . . . 0.0 117.111 164.683 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 41.46 49.6 4.74 Favored Glycine 0 N--CA 1.499 2.866 0 N-CA-C 121.799 3.479 . . . . 0.0 121.799 169.581 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p -159.1 134.88 8.72 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 117.821 0.811 . . . . 0.0 112.281 -164.713 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.5 m -78.05 94.48 4.67 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.165 -0.959 . . . . 0.0 111.323 -179.073 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 68.2 mtt -84.94 96.19 9.28 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 121.883 0.849 . . . . 0.0 112.669 -169.879 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.69 74.2 2.53 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 115.864 1.106 . . . . 0.0 115.864 177.128 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.56 -52.07 9.01 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -179.301 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.55 -57.79 2.86 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 167.554 . . . . . . . . 2 2 . 1 . 011 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.5 t -85.27 77.33 10.01 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 123.042 1.401 . . . . 0.0 111.906 164.616 . . . . . . . . 1 1 . 1 . 011 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.771 0 O-C-N 117.711 -3.118 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.559 0 CA-C-O 121.754 0.787 . . . . 0.0 112.82 . . . . . . . . . 0 0 . 1 . 012 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 t -90.85 133.01 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.2 -0.937 . . . . 0.0 109.999 -179.729 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -54.17 -43.25 74.07 Favored Glycine 0 N--CA 1.502 3.094 0 N-CA-C 119.358 2.503 . . . . 0.0 119.358 173.903 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 58.2 mt -61.91 -40.03 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 167.422 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.57 -48.32 85.34 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 117.822 1.889 . . . . 0.0 117.822 168.618 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.93 -41.47 78.27 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 117.246 2.313 . . . . 0.0 117.246 166.497 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.17 -46.83 82.46 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 165.036 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -60.36 -51.86 67.72 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 172.842 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.77 -32.1 73.49 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 171.314 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.27 -49.01 83.15 Favored Glycine 0 N--CA 1.495 2.575 0 N-CA-C 117.823 1.889 . . . . 0.0 117.823 161.663 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.89 -53.56 30.97 Favored 'General case' 0 CA--C 1.578 2.05 0 N-CA-C 115.781 1.771 . . . . 0.0 115.781 174.634 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.8 -49.52 20.44 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 176.831 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -83.57 -61.19 1.9 Allowed Glycine 0 N--CA 1.492 2.415 0 N-CA-C 117.252 1.661 . . . . 0.0 117.252 -175.765 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.47 -47.45 67.06 Favored 'General case' 0 CA--C 1.571 1.778 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 179.3 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.45 -22.68 43.82 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 118.058 2.614 . . . . 0.0 118.058 171.554 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.86 -6.77 77.27 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 120.056 2.783 . . . . 0.0 120.056 -175.788 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.2 p -77.9 99.81 6.14 Favored 'General case' 0 CA--C 1.565 1.549 0 CA-C-N 119.669 1.734 . . . . 0.0 112.352 175.609 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 59.6 p -80.2 98.21 7.25 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -164.87 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 28.1 ttt -78.3 108.88 11.96 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 121.508 -0.745 . . . . 0.0 112.045 171.926 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.92 73.65 2.59 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 116.303 1.281 . . . . 0.0 116.303 178.864 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.72 88.31 5.2 Favored 'General case' 0 CA--C 1.569 1.71 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -177.344 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -85.03 81.9 8.68 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.244 -0.91 . . . . 0.0 112.952 -174.8 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.9 t -87.57 69.42 9.74 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.064 1.412 . . . . 0.0 114.512 -175.135 . . . . . . . . 1 1 . 1 . 012 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.807 0 O-C-N 117.354 -3.341 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.563 0 CA-C-O 121.802 0.81 . . . . 0.0 112.682 . . . . . . . . . 0 0 . 1 . 013 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 90.7 t -86.3 85.49 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.021 -1.05 . . . . 0.0 110.471 -176.992 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -58.59 4.66 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 116.848 1.499 . . . . 0.0 116.848 178.094 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -62.4 -36.52 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 177.267 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.95 -51.36 54.0 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 117.068 1.587 . . . . 0.0 117.068 168.797 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.13 -40.73 86.38 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 169.325 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 tp -61.86 -48.97 78.13 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 170.215 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -66.22 -40.98 90.69 Favored 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 173.081 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 tp -49.47 -49.93 43.36 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 116.459 2.022 . . . . 0.0 116.459 162.037 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.86 -45.04 96.5 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 118.402 2.121 . . . . 0.0 118.402 167.906 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -58.16 -46.14 86.23 Favored 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.542 2.053 . . . . 0.0 116.542 168.909 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.0 mt -54.04 -46.4 71.9 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 168.255 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.09 -49.6 45.93 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 118.345 2.098 . . . . 0.0 118.345 170.813 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.28 80.38 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 178.639 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.86 -37.02 56.36 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 168.61 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.06 66.52 1.65 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 116.107 1.203 . . . . 0.0 116.107 177.577 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.8 m -159.78 147.07 16.65 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.605 -0.938 . . . . 0.0 112.158 -176.204 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.5 p -82.42 93.59 7.24 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.938 -1.101 . . . . 0.0 110.899 173.196 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 48.8 mtt -92.07 91.91 8.02 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.565 0.698 . . . . 0.0 112.033 -168.448 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -158.41 75.96 0.2 Allowed Glycine 0 N--CA 1.49 2.233 0 N-CA-C 116.1 1.2 . . . . 0.0 116.1 -178.584 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -83.28 75.34 9.96 Favored 'General case' 0 CA--C 1.571 1.778 0 CA-C-O 121.821 0.819 . . . . 0.0 112.671 169.757 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.8 mtm-85 -129.62 -62.99 0.95 Allowed 'General case' 0 N--CA 1.496 1.868 0 C-N-CA 123.267 0.627 . . . . 0.0 112.397 -170.133 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.1 p -83.8 85.17 7.34 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-O 122.834 1.302 . . . . 0.0 113.623 -178.742 . . . . . . . . 1 1 . 1 . 013 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.785 0 O-C-N 117.716 -3.115 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.505 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 . . . . . . . . . 0 0 . 1 . 014 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 m -79.15 93.44 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.036 -1.04 . . . . 0.0 112.294 -175.657 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.88 -57.38 4.95 Favored Glycine 0 N--CA 1.496 2.688 0 O-C-N 120.632 -1.292 . . . . 0.0 116.117 -170.047 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.4 mt -57.76 -47.68 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 124.521 1.128 . . . . 0.0 113.917 177.454 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.67 -42.04 99.17 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 118.464 2.146 . . . . 0.0 118.464 169.221 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.54 -42.02 95.66 Favored 'General case' 0 CA--C 1.575 1.914 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 166.581 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.0 -51.42 66.3 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 163.998 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -57.71 -42.68 84.25 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 171.459 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.0 mt -60.92 -44.69 96.84 Favored 'General case' 0 CA--C 1.574 1.879 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 169.349 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.21 -47.39 91.07 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 117.981 1.953 . . . . 0.0 117.981 166.848 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -47.16 -54.16 11.29 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 160.844 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.34 -43.56 90.53 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 179.238 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.14 -42.86 99.92 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 118.323 2.089 . . . . 0.0 118.323 168.513 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.94 94.55 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 169.098 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.78 -37.74 64.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 172.62 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 62.85 1.57 Allowed Glycine 0 N--CA 1.493 2.455 0 CA-C-N 119.724 1.147 . . . . 0.0 115.796 -176.297 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.1 t -145.79 -179.73 6.89 Favored 'General case' 0 CA--C 1.573 1.847 0 CA-C-O 122.711 1.243 . . . . 0.0 113.233 -172.628 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.6 m -138.07 99.94 4.02 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 119.96 -1.713 . . . . 0.0 108.082 170.353 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 25.7 ttt -120.66 116.33 25.09 Favored 'General case' 0 CA--C 1.567 1.621 0 C-N-CA 123.529 0.732 . . . . 0.0 110.85 -171.189 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.52 83.49 1.63 Allowed Glycine 0 N--CA 1.491 2.336 0 N-CA-C 115.9 1.12 . . . . 0.0 115.9 179.89 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.94 -42.75 94.37 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 179.2 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -84.23 81.79 8.66 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.064 -1.022 . . . . 0.0 111.052 167.738 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 82.2 p -85.25 85.18 7.48 Favored 'General case' 0 CA--C 1.566 1.589 0 CA-C-O 122.973 1.368 . . . . 0.0 113.761 -172.215 . . . . . . . . 1 1 . 1 . 014 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.78 0 O-C-N 117.665 -3.147 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.526 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 . . . . . . . . . 0 0 . 1 . 015 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 m -83.51 59.78 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.248 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -176.192 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.52 -56.64 4.54 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 116.674 1.43 . . . . 0.0 116.674 176.45 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.257 36.9 pt -63.75 -40.05 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 172.99 . . . . . . . . 2 2 . 1 . 015 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.68 -48.63 70.16 Favored Glycine 0 N--CA 1.496 2.671 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 167.829 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 166.349 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -62.07 -46.09 90.63 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 167.02 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -59.38 -48.55 81.22 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 171.494 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.9 mt -59.96 -43.38 95.07 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 169.932 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.61 -50.87 62.72 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 117.786 1.874 . . . . 0.0 117.786 167.82 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -61.91 -47.61 84.18 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 171.428 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.69 -36.35 80.63 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 174.558 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.76 -53.35 7.33 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 117.821 1.888 . . . . 0.0 117.821 167.899 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.64 -46.55 18.95 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -177.867 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.59 -37.54 24.89 Favored 'General case' 0 CA--C 1.571 1.762 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 171.129 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.04 47.93 5.35 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 118.275 2.07 . . . . 0.0 118.275 173.808 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.8 p -84.23 69.78 10.48 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.02 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.8 m -78.94 -59.68 2.68 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 123.394 0.678 . . . . 0.0 112.746 -177.483 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 67.1 mtt -83.44 81.11 8.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.975 -1.078 . . . . 0.0 110.565 168.703 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 169.86 -70.02 0.14 Allowed Glycine 0 N--CA 1.489 2.21 0 O-C-N 121.397 -0.814 . . . . 0.0 114.643 -171.745 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -83.12 78.73 9.55 Favored 'General case' 0 CA--C 1.57 1.721 0 CA-C-N 117.979 0.89 . . . . 0.0 113.308 177.61 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.6 tpm_? -90.76 89.95 7.72 Favored 'General case' 0 CA--C 1.568 1.646 0 CA-C-O 121.801 0.81 . . . . 0.0 112.874 -173.459 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.3 t -85.93 76.15 9.89 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-O 123.124 1.44 . . . . 0.0 112.796 172.117 . . . . . . . . 1 1 . 1 . 015 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.789 0 O-C-N 117.495 -3.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.549 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 . . . . . . . . . 0 0 . 1 . 016 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.5 t -86.72 83.73 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 120.969 -1.082 . . . . 0.0 110.292 -176.745 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -57.97 4.97 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 117.278 1.671 . . . . 0.0 117.278 -179.039 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 31.2 mt -63.01 -41.55 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 177.214 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.32 -44.99 96.13 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 168.553 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.31 91.76 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.005 2.224 . . . . 0.0 117.005 166.501 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.87 -47.69 84.02 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 167.631 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -62.53 -41.73 99.06 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 169.345 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.9 -47.98 81.21 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 169.351 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.35 -48.82 77.64 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 166.971 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -49.16 -50.73 36.38 Favored 'General case' 0 CA--C 1.579 2.073 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 164.465 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.63 -49.02 79.21 Favored 'General case' 0 CA--C 1.574 1.871 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 174.322 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.22 -50.73 63.88 Favored Glycine 0 N--CA 1.494 2.54 0 N-CA-C 118.246 2.058 . . . . 0.0 118.246 170.914 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.55 74.9 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 172.273 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.2 -2.37 21.42 Favored 'General case' 0 CA--C 1.577 1.982 0 N-CA-C 118.746 2.869 . . . . 0.0 118.746 167.34 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 54.49 36.16 57.83 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 119.712 2.645 . . . . 0.0 119.712 -177.506 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.0 p -165.02 135.06 3.73 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.547 0.674 . . . . 0.0 110.226 -161.158 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 69.3 p -79.79 73.81 6.52 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 120.985 -1.072 . . . . 0.0 113.874 -172.907 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.17 120.88 12.94 Favored 'General case' 0 CA--C 1.57 1.733 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -169.59 . . . . . . . . 2 2 . 1 . 016 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 106.98 -77.3 0.23 Allowed Glycine 0 N--CA 1.49 2.249 0 O-C-N 121.859 -0.526 . . . . 0.0 112.707 -161.941 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.82 75.99 5.64 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 175.143 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -96.24 83.9 3.67 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.868 -1.145 . . . . 0.0 111.201 178.192 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.1 m -158.11 114.78 2.85 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.818 1.294 . . . . 0.0 110.191 179.585 . . . . . . . . 1 1 . 1 . 016 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.756 0 O-C-N 117.126 -3.484 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.491 0 CA-C-O 121.855 0.836 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 017 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.3 m -82.69 99.11 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 120.944 -1.097 . . . . 0.0 112.024 -178.602 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.88 -37.86 71.8 Favored Glycine 0 N--CA 1.499 2.897 0 N-CA-C 119.608 2.603 . . . . 0.0 119.608 177.436 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.11 -48.69 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.267 0 CA-C-N 118.333 1.067 . . . . 0.0 113.154 171.497 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.34 -51.76 55.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.339 1.696 . . . . 0.0 117.339 169.84 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.9 71.35 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 117.715 2.487 . . . . 0.0 117.715 171.293 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.2 -55.74 12.82 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 169.868 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.32 -41.37 94.07 Favored 'General case' 0 CA--C 1.572 1.82 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 -176.126 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.36 -42.8 99.29 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.332 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -61.45 -49.0 81.74 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 117.814 1.886 . . . . 0.0 117.814 164.358 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -52.9 -57.42 10.31 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.169 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.4 tp -68.52 -37.63 80.19 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 178.905 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.34 -47.11 91.58 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 165.181 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.28 78.01 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 167.558 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.91 -36.86 85.32 Favored 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.827 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.45 -60.32 0.45 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 116.342 1.297 . . . . 0.0 116.342 173.346 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 85.3 p -77.12 89.71 3.63 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.03 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.5 p -85.14 82.22 8.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.493 -0.754 . . . . 0.0 112.877 -173.382 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 13.6 tpt -140.71 123.02 15.87 Favored 'General case' 0 CA--C 1.566 1.581 0 C-N-CA 123.731 0.813 . . . . 0.0 110.457 178.481 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.75 82.39 1.69 Allowed Glycine 0 N--CA 1.494 2.515 0 O-C-N 121.043 -1.036 . . . . 0.0 114.274 169.531 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.76 95.25 5.93 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -174.78 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.6 mmt-85 -119.19 -60.86 1.7 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -178.736 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.0 p -82.44 85.39 6.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.526 -1.359 . . . . 0.0 113.64 -179.385 . . . . . . . . 1 1 . 1 . 017 ecloud build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.794 0 O-C-N 117.725 -3.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 96.2 t . . . . . 0 N--CA 1.5 2.072 0 CA-C-O 121.548 0.689 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -65.12 -55.34 22.16 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 118.268 2.067 . . . . 0.0 118.268 -174.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 38.4 pt -62.02 -34.51 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 173.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -64.15 -55.16 25.53 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 116.234 1.254 . . . . 0.0 116.234 167.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -52.57 -42.14 64.2 Favored 'General case' 0 CA--C 1.575 1.941 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 167.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.9 tp -64.93 -57.21 9.37 Favored 'General case' 0 CA--C 1.57 1.733 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 172.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -68.81 -41.66 78.34 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.75 -39.41 73.29 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.374 1.443 . . . . 0.0 114.598 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.26 -48.0 86.1 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 117.669 1.827 . . . . 0.0 117.669 162.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -47.96 -52.48 19.48 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 116.569 2.063 . . . . 0.0 116.569 161.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.6 -45.13 94.32 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.76 -43.7 98.88 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 118.486 2.154 . . . . 0.0 118.486 168.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.84 91.25 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 170.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.63 -39.18 58.19 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 174.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.32 43.08 55.72 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 118.234 2.054 . . . . 0.0 118.234 -176.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 m -165.33 153.73 11.67 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.494 1.117 . . . . 0.0 110.487 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.3 p . . . . . 0 N--CA 1.501 2.116 0 O-C-N 120.515 -1.366 . . . . 0.0 113.314 -177.518 . . . . . . . . 0 0 . 1 . 002 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.7 p . . . . . 0 CA--C 1.573 1.849 0 CA-C-O 121.641 0.734 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 002 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -57.38 -38.39 86.57 Favored Glycine 0 N--CA 1.498 2.826 0 N-CA-C 119.849 2.7 . . . . 0.0 119.849 -179.831 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.83 -39.15 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 CA-C-N 118.606 1.203 . . . . 0.0 113.876 172.921 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.36 -48.71 83.71 Favored Glycine 0 N--CA 1.498 2.78 0 N-CA-C 117.544 1.778 . . . . 0.0 117.544 166.527 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.79 -43.04 80.49 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 117.385 2.365 . . . . 0.0 117.385 167.245 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -57.98 -46.47 85.14 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 167.009 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 170.946 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.8 mt -54.8 -40.59 69.64 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 163.382 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.55 -47.45 69.91 Favored Glycine 0 N--CA 1.496 2.646 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 162.979 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -55.6 -54.0 49.49 Favored 'General case' 0 CA--C 1.578 2.029 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 163.792 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.2 mt -52.82 -44.03 66.38 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 176.911 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.3 -52.8 11.82 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 168.513 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.21 75.89 Favored 'General case' 0 CA--C 1.571 1.759 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.664 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.75 -33.32 64.26 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 116.625 2.083 . . . . 0.0 116.625 165.47 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.26 64.35 1.85 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 116.138 1.215 . . . . 0.0 116.138 176.308 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 m -160.01 123.89 3.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.74 -0.859 . . . . 0.0 110.607 -176.174 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.018 -1.051 . . . . 0.0 110.861 178.296 . . . . . . . . 0 0 . 1 . 003 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.496 1.875 0 CA-C-O 121.542 0.687 . . . . 0.0 112.071 . . . . . . . . . 0 0 . 1 . 003 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.48 -42.62 84.27 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 174.526 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.255 9.9 tp -63.22 -38.79 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 168.009 . . . . . . . . 2 2 . 1 . 003 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.42 -43.05 98.83 Favored Glycine 0 N--CA 1.498 2.785 0 N-CA-C 117.796 1.878 . . . . 0.0 117.796 170.839 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.23 -47.74 80.57 Favored 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 165.326 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.1 tp -64.19 -47.82 78.3 Favored 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 115.632 1.715 . . . . 0.0 115.632 171.142 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -59.36 -37.07 76.94 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 172.957 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.7 tt -61.3 -45.48 94.3 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 170.229 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.84 -48.63 85.1 Favored Glycine 0 N--CA 1.501 2.994 0 N-CA-C 117.843 1.897 . . . . 0.0 117.843 167.01 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -48.68 -45.64 39.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 163.804 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 tt -73.2 -54.16 9.14 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 174.191 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.93 -52.35 7.04 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 118.447 2.139 . . . . 0.0 118.447 -177.712 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.13 -47.47 18.12 Favored 'General case' 0 CA--C 1.57 1.725 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 176.978 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.79 -11.29 53.87 Favored 'General case' 0 CA--C 1.576 1.979 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 173.778 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.6 26.52 56.5 Favored Glycine 0 N--CA 1.497 2.739 0 N-CA-C 120.102 2.801 . . . . 0.0 120.102 178.768 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.0 t -117.27 98.97 6.71 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 119.448 1.624 . . . . 0.0 112.547 -172.192 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.501 2.111 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 174.661 . . . . . . . . 0 0 . 1 . 004 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 64.4 t . . . . . 0 N--CA 1.499 2.017 0 CA-C-O 121.224 0.535 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 004 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.05 -50.31 67.26 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 119.238 2.455 . . . . 0.0 119.238 -175.446 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.0 pt -64.19 -31.5 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 N-CA-C 116.182 1.919 . . . . 0.0 116.182 170.382 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.18 -46.65 87.01 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 117.248 1.659 . . . . 0.0 117.248 165.895 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.46 91.22 Favored 'General case' 0 CA--C 1.574 1.894 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 167.656 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.62 -52.58 50.82 Favored 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 170.065 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -72.65 -73.95 0.18 Allowed 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 119.714 1.143 . . . . 0.0 112.46 -178.698 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -66.97 -35.88 80.95 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 -177.026 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -55.86 -54.49 34.76 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 168.699 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.19 -47.69 73.11 Favored 'General case' 0 CA--C 1.575 1.938 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 170.321 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.46 -44.48 68.94 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 173.507 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.01 -54.43 5.29 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 118.051 1.98 . . . . 0.0 118.051 171.07 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.82 -44.38 41.37 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 117.343 2.349 . . . . 0.0 117.343 -177.21 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.02 -35.57 28.71 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 170.176 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.13 76.08 1.32 Allowed Glycine 0 N--CA 1.493 2.453 0 CA-C-N 119.895 1.225 . . . . 0.0 114.381 178.985 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.1 m -162.79 152.93 16.23 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.913 . . . . 0.0 111.883 -173.271 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t . . . . . 0 N--CA 1.504 2.24 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 177.812 . . . . . . . . 0 0 . 1 . 005 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.497 1.892 0 CA-C-O 121.27 0.557 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 005 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.01 -42.56 81.36 Favored Glycine 0 N--CA 1.499 2.885 0 N-CA-C 119.277 2.471 . . . . 0.0 119.277 177.606 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.254 10.3 tp -62.8 -38.54 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 169.268 . . . . . . . . 2 2 . 1 . 005 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -66.39 -46.95 74.11 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 117.398 1.719 . . . . 0.0 117.398 167.623 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.75 -42.4 71.6 Favored 'General case' 0 CA--C 1.575 1.91 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 165.948 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.49 -44.7 95.68 Favored 'General case' 0 CA--C 1.572 1.8 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 167.102 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -55.32 -51.49 66.57 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 168.426 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.8 mt -52.26 -46.6 65.87 Favored 'General case' 0 N--CA 1.499 1.98 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 171.426 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.53 -44.86 95.98 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 118.411 2.124 . . . . 0.0 118.411 168.434 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -51.52 -43.91 62.42 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 175.189 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.3 mt -56.63 -46.14 81.14 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -178.26 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -85.66 -51.41 3.66 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 117.734 1.854 . . . . 0.0 117.734 170.688 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.73 -40.03 69.7 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.635 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.31 -47.38 11.55 Favored 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 165.228 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 115.39 86.0 1.3 Allowed Glycine 0 N--CA 1.49 2.285 0 CA-C-N 119.25 0.932 . . . . 0.0 113.81 174.134 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.3 m -159.88 123.72 3.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.821 -0.811 . . . . 0.0 111.309 -179.45 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.502 2.166 0 O-C-N 120.737 -1.227 . . . . 0.0 114.059 171.823 . . . . . . . . 0 0 . 1 . 006 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 84.9 t . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 121.511 0.672 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 006 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.26 -55.06 17.25 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 118.219 2.047 . . . . 0.0 118.219 -177.092 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.6 mm -64.58 -39.35 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 178.577 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.42 -45.03 97.24 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 167.221 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.16 84.56 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 166.755 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -61.86 -52.33 64.55 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 165.691 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -51.28 -54.39 26.47 Favored 'General case' 0 CA--C 1.573 1.839 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 171.994 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.98 -27.62 64.86 Favored 'General case' 0 CA--C 1.573 1.852 0 N-CA-C 116.573 2.064 . . . . 0.0 116.573 172.96 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.16 -49.95 70.84 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 117.468 1.747 . . . . 0.0 117.468 161.93 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -65.57 -53.72 38.03 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 168.693 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.35 -59.2 3.6 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -177.809 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.69 -50.83 4.05 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 118.307 2.083 . . . . 0.0 118.307 -176.184 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.61 -49.66 25.05 Favored 'General case' 0 CA--C 1.57 1.726 0 N-CA-C 116.613 2.079 . . . . 0.0 116.613 179.963 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.79 -45.05 19.51 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 172.793 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.59 89.71 2.11 Favored Glycine 0 N--CA 1.489 2.2 0 CA-C-N 119.276 0.943 . . . . 0.0 113.112 -176.299 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.2 m -155.87 138.7 15.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.497 -1.002 . . . . 0.0 111.66 -177.574 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.1 p . . . . . 0 N--CA 1.499 2.018 0 O-C-N 120.503 -1.373 . . . . 0.0 112.319 178.359 . . . . . . . . 0 0 . 1 . 007 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.8 t . . . . . 0 N--CA 1.499 2.021 0 CA-C-O 121.641 0.734 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 007 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.69 26.76 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -175.92 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.283 6.8 tp -66.57 -33.62 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 174.565 . . . . . . . . 2 2 . 1 . 007 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.13 -48.19 87.2 Favored Glycine 0 N--CA 1.497 2.752 0 N-CA-C 117.019 1.567 . . . . 0.0 117.019 165.707 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.15 -45.09 75.64 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 166.507 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.22 -56.09 19.56 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 169.748 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.64 -38.83 92.59 Favored 'General case' 0 CA--C 1.569 1.7 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -178.08 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.97 -42.36 99.81 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 120.882 1.674 . . . . 0.0 115.507 170.498 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -60.12 -50.34 68.71 Favored Glycine 0 N--CA 1.498 2.784 0 N-CA-C 117.683 1.833 . . . . 0.0 117.683 165.377 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -50.6 -53.95 26.57 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 165.839 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.59 -40.06 94.85 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 179.534 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.34 -45.86 94.11 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 118.131 2.012 . . . . 0.0 118.131 166.117 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.21 97.11 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 171.44 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.06 -39.97 71.92 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 169.814 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 75.73 1.31 Allowed Glycine 0 N--CA 1.49 2.254 0 CA-C-N 119.563 1.074 . . . . 0.0 114.962 178.322 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.7 m -154.61 138.49 16.28 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.651 -0.911 . . . . 0.0 112.381 -177.87 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t . . . . . 0 N--CA 1.495 1.821 0 O-C-N 121.186 -0.946 . . . . 0.0 112.113 171.439 . . . . . . . . 0 0 . 1 . 008 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.1 t . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 121.395 0.617 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 008 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.68 -59.11 4.57 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 116.919 1.527 . . . . 0.0 116.919 179.907 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.256 13.7 tt -57.96 -41.65 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 172.393 . . . . . . . . 2 2 . 1 . 008 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.03 -44.73 97.37 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 117.964 1.946 . . . . 0.0 117.964 169.125 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.91 -40.94 97.19 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 117.344 2.35 . . . . 0.0 117.344 169.466 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 45.0 tp -62.58 -47.37 84.12 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 167.812 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -57.88 -56.3 23.7 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 169.98 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 41.5 tp -66.13 -40.52 90.71 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 116.435 2.013 . . . . 0.0 116.435 178.114 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.23 -48.02 85.92 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 117.797 1.879 . . . . 0.0 117.797 166.873 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -66.08 -38.68 88.9 Favored 'General case' 0 CA--C 1.578 2.03 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 170.129 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.01 -57.1 12.93 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 170.747 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.1 -53.4 3.32 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -176.99 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.39 -41.23 48.62 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 -179.605 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.3 -49.8 11.89 Favored 'General case' 0 CA--C 1.573 1.836 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 168.029 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 112.18 82.52 1.21 Allowed Glycine 0 N--CA 1.49 2.278 0 CA-C-N 119.229 0.922 . . . . 0.0 113.897 177.251 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.0 m -158.6 105.7 1.85 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.733 -0.863 . . . . 0.0 111.514 -177.408 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.1 t . . . . . 0 N--CA 1.495 1.825 0 O-C-N 120.929 -1.107 . . . . 0.0 112.721 176.994 . . . . . . . . 0 0 . 1 . 009 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 62.2 t . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 009 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.23 -69.71 2.97 Favored Glycine 0 N--CA 1.494 2.538 0 O-C-N 121.339 -0.851 . . . . 0.0 114.936 -172.772 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 28.9 pt -63.03 -36.46 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 176.998 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.79 -46.27 92.24 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 117.535 1.774 . . . . 0.0 117.535 167.343 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.29 -43.34 96.36 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.039 2.237 . . . . 0.0 117.039 167.577 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.6 tp -61.92 -45.47 93.58 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.526 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.57 -41.79 95.31 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 167.919 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.8 tp -60.86 -42.96 98.87 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 116.196 1.924 . . . . 0.0 116.196 169.432 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.89 -47.91 85.74 Favored Glycine 0 N--CA 1.498 2.768 0 N-CA-C 117.837 1.895 . . . . 0.0 117.837 165.972 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -53.76 -59.15 4.98 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 164.833 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.2 tp -68.96 -40.42 78.91 Favored 'General case' 0 CA--C 1.572 1.807 0 N-CA-C 116.309 1.966 . . . . 0.0 116.309 -176.893 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.91 -40.74 97.24 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 118.478 2.151 . . . . 0.0 118.478 167.692 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.4 87.04 Favored 'General case' 0 CA--C 1.573 1.859 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 167.095 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.69 -45.35 59.25 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 117.279 2.326 . . . . 0.0 117.279 174.588 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.99 75.38 1.3 Allowed Glycine 0 N--CA 1.491 2.331 0 CA-C-N 119.483 1.038 . . . . 0.0 115.405 179.981 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.5 m -157.87 148.33 20.67 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.478 -1.013 . . . . 0.0 112.447 -179.363 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 65.2 p . . . . . 0 N--CA 1.501 2.125 0 O-C-N 120.58 -1.325 . . . . 0.0 111.915 175.929 . . . . . . . . 0 0 . 1 . 010 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 N--CA 1.501 2.083 0 CA-C-O 121.776 0.798 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 010 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.3 -56.64 6.71 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 117.385 1.714 . . . . 0.0 117.385 -178.428 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.27 10.3 tp -60.46 -37.16 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 175.545 . . . . . . . . 2 2 . 1 . 010 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.18 -49.67 69.4 Favored Glycine 0 N--CA 1.498 2.788 0 N-CA-C 117.624 1.81 . . . . 0.0 117.624 167.977 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.88 85.22 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 167.839 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.0 tp -61.1 -45.78 93.32 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 168.752 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -61.13 -39.15 88.96 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 116.485 2.032 . . . . 0.0 116.485 170.364 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.2 mt -58.48 -41.51 85.45 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 164.623 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.8 -47.83 69.56 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.301 2.08 . . . . 0.0 118.301 161.3 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -56.9 -49.34 75.86 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 115.924 1.824 . . . . 0.0 115.924 170.1 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 19.7 tp -63.33 -46.1 88.23 Favored 'General case' 0 CA--C 1.573 1.854 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 173.045 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.13 -43.87 95.05 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.719 2.248 . . . . 0.0 118.719 170.026 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.71 -36.94 85.92 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 117.585 2.439 . . . . 0.0 117.585 167.413 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.51 -42.47 67.95 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 172.877 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.52 -57.06 4.18 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.295 1.678 . . . . 0.0 117.295 178.798 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.3 p -72.66 102.51 3.33 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -179.287 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 p . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.591 -0.693 . . . . 0.0 112.598 -173.108 . . . . . . . . 0 0 . 1 . 011 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 121.075 0.464 . . . . 0.0 112.095 . . . . . . . . . 0 0 . 1 . 011 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.41 93.2 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 118.828 2.291 . . . . 0.0 118.828 176.446 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.59 -40.79 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.374 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 172.568 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.12 -44.36 97.32 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 118.204 2.042 . . . . 0.0 118.204 168.753 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.14 -44.22 83.18 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 116.938 2.199 . . . . 0.0 116.938 165.456 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 mt -56.77 -48.42 77.9 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 165.676 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.28 -38.22 90.27 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 174.908 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.58 -45.41 85.27 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 162.814 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.9 -45.6 61.32 Favored Glycine 0 N--CA 1.496 2.648 0 N-CA-C 118.758 2.263 . . . . 0.0 118.758 163.884 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -61.11 -52.2 65.88 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 170.607 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 60.7 tp -46.53 -52.81 12.58 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 117.087 2.254 . . . . 0.0 117.087 167.059 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.85 -56.48 4.88 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 117.832 1.893 . . . . 0.0 117.832 177.109 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.13 92.29 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 117.403 2.372 . . . . 0.0 117.403 -179.429 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.24 20.74 2.64 Favored 'General case' 0 CA--C 1.58 2.123 0 N-CA-C 117.111 2.263 . . . . 0.0 117.111 164.683 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 41.46 49.6 4.74 Favored Glycine 0 N--CA 1.499 2.866 0 N-CA-C 121.799 3.479 . . . . 0.0 121.799 169.581 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p -159.1 134.88 8.72 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 117.821 0.811 . . . . 0.0 112.281 -164.713 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.5 m . . . . . 0 N--CA 1.496 1.863 0 O-C-N 121.165 -0.959 . . . . 0.0 111.323 -179.073 . . . . . . . . 0 0 . 1 . 012 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 012 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -54.17 -43.25 74.07 Favored Glycine 0 N--CA 1.502 3.094 0 N-CA-C 119.358 2.503 . . . . 0.0 119.358 173.903 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 58.2 mt -61.91 -40.03 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 167.422 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.57 -48.32 85.34 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 117.822 1.889 . . . . 0.0 117.822 168.618 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.93 -41.47 78.27 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 117.246 2.313 . . . . 0.0 117.246 166.497 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.17 -46.83 82.46 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 165.036 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -60.36 -51.86 67.72 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 172.842 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.77 -32.1 73.49 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 171.314 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.27 -49.01 83.15 Favored Glycine 0 N--CA 1.495 2.575 0 N-CA-C 117.823 1.889 . . . . 0.0 117.823 161.663 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.89 -53.56 30.97 Favored 'General case' 0 CA--C 1.578 2.05 0 N-CA-C 115.781 1.771 . . . . 0.0 115.781 174.634 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.8 -49.52 20.44 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 176.831 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -83.57 -61.19 1.9 Allowed Glycine 0 N--CA 1.492 2.415 0 N-CA-C 117.252 1.661 . . . . 0.0 117.252 -175.765 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.47 -47.45 67.06 Favored 'General case' 0 CA--C 1.571 1.778 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 179.3 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.45 -22.68 43.82 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 118.058 2.614 . . . . 0.0 118.058 171.554 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.86 -6.77 77.27 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 120.056 2.783 . . . . 0.0 120.056 -175.788 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.2 p -77.9 99.81 6.14 Favored 'General case' 0 CA--C 1.565 1.549 0 CA-C-N 119.669 1.734 . . . . 0.0 112.352 175.609 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 59.6 p . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -164.87 . . . . . . . . 0 0 . 1 . 013 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 90.7 t . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 121.497 0.665 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 013 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -58.59 4.66 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 116.848 1.499 . . . . 0.0 116.848 178.094 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -62.4 -36.52 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 177.267 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.95 -51.36 54.0 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 117.068 1.587 . . . . 0.0 117.068 168.797 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.13 -40.73 86.38 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 169.325 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 tp -61.86 -48.97 78.13 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 170.215 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -66.22 -40.98 90.69 Favored 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 173.081 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 tp -49.47 -49.93 43.36 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 116.459 2.022 . . . . 0.0 116.459 162.037 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.86 -45.04 96.5 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 118.402 2.121 . . . . 0.0 118.402 167.906 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -58.16 -46.14 86.23 Favored 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.542 2.053 . . . . 0.0 116.542 168.909 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.0 mt -54.04 -46.4 71.9 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 168.255 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.09 -49.6 45.93 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 118.345 2.098 . . . . 0.0 118.345 170.813 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.28 80.38 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 178.639 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.86 -37.02 56.36 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 168.61 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.06 66.52 1.65 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 116.107 1.203 . . . . 0.0 116.107 177.577 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.8 m -159.78 147.07 16.65 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.605 -0.938 . . . . 0.0 112.158 -176.204 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.5 p . . . . . 0 N--CA 1.498 1.968 0 O-C-N 120.938 -1.101 . . . . 0.0 110.899 173.196 . . . . . . . . 0 0 . 1 . 014 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 121.57 0.7 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 014 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.88 -57.38 4.95 Favored Glycine 0 N--CA 1.496 2.688 0 O-C-N 120.632 -1.292 . . . . 0.0 116.117 -170.047 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.4 mt -57.76 -47.68 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 124.521 1.128 . . . . 0.0 113.917 177.454 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.67 -42.04 99.17 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 118.464 2.146 . . . . 0.0 118.464 169.221 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.54 -42.02 95.66 Favored 'General case' 0 CA--C 1.575 1.914 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 166.581 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.0 -51.42 66.3 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 163.998 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -57.71 -42.68 84.25 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 171.459 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.0 mt -60.92 -44.69 96.84 Favored 'General case' 0 CA--C 1.574 1.879 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 169.349 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.21 -47.39 91.07 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 117.981 1.953 . . . . 0.0 117.981 166.848 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -47.16 -54.16 11.29 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 160.844 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.34 -43.56 90.53 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 179.238 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.14 -42.86 99.92 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 118.323 2.089 . . . . 0.0 118.323 168.513 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.94 94.55 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 169.098 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.78 -37.74 64.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 172.62 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 62.85 1.57 Allowed Glycine 0 N--CA 1.493 2.455 0 CA-C-N 119.724 1.147 . . . . 0.0 115.796 -176.297 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.1 t -145.79 -179.73 6.89 Favored 'General case' 0 CA--C 1.573 1.847 0 CA-C-O 122.711 1.243 . . . . 0.0 113.233 -172.628 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.6 m . . . . . 0 N--CA 1.497 1.922 0 O-C-N 119.96 -1.713 . . . . 0.0 108.082 170.353 . . . . . . . . 0 0 . 1 . 015 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 m . . . . . 0 N--CA 1.504 2.248 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 . . . . . . . . . 0 0 . 1 . 015 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.52 -56.64 4.54 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 116.674 1.43 . . . . 0.0 116.674 176.45 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.257 36.9 pt -63.75 -40.05 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 172.99 . . . . . . . . 2 2 . 1 . 015 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.68 -48.63 70.16 Favored Glycine 0 N--CA 1.496 2.671 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 167.829 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 166.349 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -62.07 -46.09 90.63 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 167.02 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -59.38 -48.55 81.22 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 171.494 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.9 mt -59.96 -43.38 95.07 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 169.932 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.61 -50.87 62.72 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 117.786 1.874 . . . . 0.0 117.786 167.82 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -61.91 -47.61 84.18 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 171.428 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.69 -36.35 80.63 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 174.558 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.76 -53.35 7.33 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 117.821 1.888 . . . . 0.0 117.821 167.899 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.64 -46.55 18.95 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -177.867 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.59 -37.54 24.89 Favored 'General case' 0 CA--C 1.571 1.762 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 171.129 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.04 47.93 5.35 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 118.275 2.07 . . . . 0.0 118.275 173.808 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.8 p -84.23 69.78 10.48 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.02 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.8 m . . . . . 0 N--CA 1.499 1.979 0 C-N-CA 123.394 0.678 . . . . 0.0 112.746 -177.483 . . . . . . . . 0 0 . 1 . 016 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.5 t . . . . . 0 N--CA 1.5 2.045 0 CA-C-O 121.589 0.709 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 016 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -57.97 4.97 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 117.278 1.671 . . . . 0.0 117.278 -179.039 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 31.2 mt -63.01 -41.55 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 177.214 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.32 -44.99 96.13 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 168.553 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.31 91.76 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.005 2.224 . . . . 0.0 117.005 166.501 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.87 -47.69 84.02 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 167.631 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -62.53 -41.73 99.06 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 169.345 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.9 -47.98 81.21 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 169.351 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.35 -48.82 77.64 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 166.971 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -49.16 -50.73 36.38 Favored 'General case' 0 CA--C 1.579 2.073 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 164.465 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.63 -49.02 79.21 Favored 'General case' 0 CA--C 1.574 1.871 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 174.322 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.22 -50.73 63.88 Favored Glycine 0 N--CA 1.494 2.54 0 N-CA-C 118.246 2.058 . . . . 0.0 118.246 170.914 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.55 74.9 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 172.273 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.2 -2.37 21.42 Favored 'General case' 0 CA--C 1.577 1.982 0 N-CA-C 118.746 2.869 . . . . 0.0 118.746 167.34 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 54.49 36.16 57.83 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 119.712 2.645 . . . . 0.0 119.712 -177.506 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.0 p -165.02 135.06 3.73 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.547 0.674 . . . . 0.0 110.226 -161.158 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 69.3 p . . . . . 0 N--CA 1.5 2.05 0 O-C-N 120.985 -1.072 . . . . 0.0 113.874 -172.907 . . . . . . . . 0 0 . 1 . 017 ecloud nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.3 m . . . . . 0 N--CA 1.497 1.923 0 CA-C-O 121.299 0.571 . . . . 0.0 112.024 . . . . . . . . . 0 0 . 1 . 017 ecloud nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.88 -37.86 71.8 Favored Glycine 0 N--CA 1.499 2.897 0 N-CA-C 119.608 2.603 . . . . 0.0 119.608 177.436 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.11 -48.69 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.267 0 CA-C-N 118.333 1.067 . . . . 0.0 113.154 171.497 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.34 -51.76 55.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.339 1.696 . . . . 0.0 117.339 169.84 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.9 71.35 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 117.715 2.487 . . . . 0.0 117.715 171.293 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.2 -55.74 12.82 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 169.868 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.32 -41.37 94.07 Favored 'General case' 0 CA--C 1.572 1.82 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 -176.126 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.36 -42.8 99.29 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.332 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -61.45 -49.0 81.74 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 117.814 1.886 . . . . 0.0 117.814 164.358 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -52.9 -57.42 10.31 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.169 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.4 tp -68.52 -37.63 80.19 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 178.905 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.34 -47.11 91.58 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 165.181 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.28 78.01 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 167.558 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.91 -36.86 85.32 Favored 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.827 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.45 -60.32 0.45 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 116.342 1.297 . . . . 0.0 116.342 173.346 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 85.3 p -77.12 89.71 3.63 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.03 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.5 p . . . . . 0 N--CA 1.497 1.902 0 O-C-N 121.493 -0.754 . . . . 0.0 112.877 -173.382 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.565 0 CA-C-O 121.783 0.801 . . . . 0.0 112.685 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 96.2 t -86.68 83.23 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.012 -1.055 . . . . 0.0 110.114 -177.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -65.12 -55.34 22.16 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 118.268 2.067 . . . . 0.0 118.268 -174.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 38.4 pt -62.02 -34.51 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 173.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -64.15 -55.16 25.53 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 116.234 1.254 . . . . 0.0 116.234 167.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -52.57 -42.14 64.2 Favored 'General case' 0 CA--C 1.575 1.941 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 167.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.9 tp -64.93 -57.21 9.37 Favored 'General case' 0 CA--C 1.57 1.733 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 172.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -68.81 -41.66 78.34 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.75 -39.41 73.29 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.374 1.443 . . . . 0.0 114.598 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.26 -48.0 86.1 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 117.669 1.827 . . . . 0.0 117.669 162.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -47.96 -52.48 19.48 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 116.569 2.063 . . . . 0.0 116.569 161.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.6 -45.13 94.32 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.76 -43.7 98.88 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 118.486 2.154 . . . . 0.0 118.486 168.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.84 91.25 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 170.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.63 -39.18 58.19 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 174.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.32 43.08 55.72 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 118.234 2.054 . . . . 0.0 118.234 -176.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 m -165.33 153.73 11.67 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.494 1.117 . . . . 0.0 110.487 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.3 p -77.42 78.75 3.94 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 120.515 -1.366 . . . . 0.0 113.314 -177.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 59.4 mtt -93.56 73.18 4.38 Favored 'General case' 0 CA--C 1.57 1.736 0 CA-C-O 121.838 0.828 . . . . 0.0 112.925 -171.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -162.13 81.69 0.13 Allowed Glycine 0 N--CA 1.492 2.372 0 O-C-N 121.169 -0.957 . . . . 0.0 113.575 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -83.16 81.61 8.61 Favored 'General case' 0 CA--C 1.57 1.721 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -88.27 79.9 7.68 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-O 121.998 0.904 . . . . 0.0 112.716 -169.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.1 t -84.64 73.27 10.6 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.138 1.447 . . . . 0.0 114.403 -175.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.813 0 O-C-N 117.371 -3.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.547 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 . . . . . . . . . 0 0 . 1 . 002 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.7 p -85.11 104.1 12.85 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.849 0 O-C-N 120.917 -1.114 . . . . 0.0 111.607 178.743 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -57.38 -38.39 86.57 Favored Glycine 0 N--CA 1.498 2.826 0 N-CA-C 119.849 2.7 . . . . 0.0 119.849 -179.831 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.83 -39.15 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 CA-C-N 118.606 1.203 . . . . 0.0 113.876 172.921 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.36 -48.71 83.71 Favored Glycine 0 N--CA 1.498 2.78 0 N-CA-C 117.544 1.778 . . . . 0.0 117.544 166.527 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.79 -43.04 80.49 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 117.385 2.365 . . . . 0.0 117.385 167.245 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -57.98 -46.47 85.14 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 167.009 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 170.946 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.8 mt -54.8 -40.59 69.64 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 163.382 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.55 -47.45 69.91 Favored Glycine 0 N--CA 1.496 2.646 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 162.979 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -55.6 -54.0 49.49 Favored 'General case' 0 CA--C 1.578 2.029 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 163.792 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.2 mt -52.82 -44.03 66.38 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 176.911 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.3 -52.8 11.82 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 168.513 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.21 75.89 Favored 'General case' 0 CA--C 1.571 1.759 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.664 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.75 -33.32 64.26 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 116.625 2.083 . . . . 0.0 116.625 165.47 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.26 64.35 1.85 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 116.138 1.215 . . . . 0.0 116.138 176.308 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 m -160.01 123.89 3.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.74 -0.859 . . . . 0.0 110.607 -176.174 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m -82.35 101.78 10.81 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.018 -1.051 . . . . 0.0 110.861 178.296 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 24.1 mmt -83.43 83.54 7.84 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 113.483 0.919 . . . . 0.0 113.483 -173.281 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -86.03 66.79 3.64 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 115.94 1.136 . . . . 0.0 115.94 173.899 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.05 -51.92 28.18 Favored 'General case' 0 CA--C 1.567 1.624 0 N-CA-C 116.511 2.041 . . . . 0.0 116.511 -175.042 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.79 60.36 6.18 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 174.598 . . . . . . . . 2 2 . 1 . 002 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.0 m -89.19 86.75 6.94 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 123.486 1.612 . . . . 0.0 112.546 -176.009 . . . . . . . . 1 1 . 1 . 002 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.781 0 O-C-N 117.416 -3.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.577 0 CA-C-O 121.764 0.792 . . . . 0.0 112.661 . . . . . . . . . 0 0 . 1 . 003 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.0 m -83.71 104.12 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.014 -1.054 . . . . 0.0 112.071 -178.932 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.48 -42.62 84.27 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 174.526 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.255 9.9 tp -63.22 -38.79 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 168.009 . . . . . . . . 2 2 . 1 . 003 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.42 -43.05 98.83 Favored Glycine 0 N--CA 1.498 2.785 0 N-CA-C 117.796 1.878 . . . . 0.0 117.796 170.839 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.23 -47.74 80.57 Favored 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 165.326 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.1 tp -64.19 -47.82 78.3 Favored 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 115.632 1.715 . . . . 0.0 115.632 171.142 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -59.36 -37.07 76.94 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 172.957 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.7 tt -61.3 -45.48 94.3 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 170.229 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.84 -48.63 85.1 Favored Glycine 0 N--CA 1.501 2.994 0 N-CA-C 117.843 1.897 . . . . 0.0 117.843 167.01 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -48.68 -45.64 39.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 163.804 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 tt -73.2 -54.16 9.14 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 174.191 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.93 -52.35 7.04 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 118.447 2.139 . . . . 0.0 118.447 -177.712 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.13 -47.47 18.12 Favored 'General case' 0 CA--C 1.57 1.725 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 176.978 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.79 -11.29 53.87 Favored 'General case' 0 CA--C 1.576 1.979 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 173.778 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.6 26.52 56.5 Favored Glycine 0 N--CA 1.497 2.739 0 N-CA-C 120.102 2.801 . . . . 0.0 120.102 178.768 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.0 t -117.27 98.97 6.71 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 119.448 1.624 . . . . 0.0 112.547 -172.192 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t -87.67 57.4 4.36 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 174.661 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 43.3 ttp -89.17 73.61 8.1 Favored 'General case' 0 CA--C 1.573 1.847 0 O-C-N 120.34 -1.475 . . . . 0.0 113.572 -172.98 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.13 88.7 1.2 Allowed Glycine 0 N--CA 1.492 2.381 0 O-C-N 120.904 -1.122 . . . . 0.0 114.18 177.124 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.73 83.71 6.43 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -178.92 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -92.74 86.01 5.4 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.868 0.842 . . . . 0.0 111.946 -169.754 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.2 m -157.34 134.02 9.97 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 123.0 1.381 . . . . 0.0 111.023 179.817 . . . . . . . . 1 1 . 1 . 003 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.76 0 O-C-N 117.079 -3.513 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.555 0 CA-C-O 121.784 0.802 . . . . 0.0 112.668 . . . . . . . . . 0 0 . 1 . 004 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 64.4 t -86.69 90.06 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 120.966 -1.084 . . . . 0.0 109.736 -177.092 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.05 -50.31 67.26 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 119.238 2.455 . . . . 0.0 119.238 -175.446 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.0 pt -64.19 -31.5 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 N-CA-C 116.182 1.919 . . . . 0.0 116.182 170.382 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.18 -46.65 87.01 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 117.248 1.659 . . . . 0.0 117.248 165.895 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.46 91.22 Favored 'General case' 0 CA--C 1.574 1.894 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 167.656 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.62 -52.58 50.82 Favored 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 170.065 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -72.65 -73.95 0.18 Allowed 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 119.714 1.143 . . . . 0.0 112.46 -178.698 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mp -66.97 -35.88 80.95 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 -177.026 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -55.86 -54.49 34.76 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 168.699 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -66.19 -47.69 73.11 Favored 'General case' 0 CA--C 1.575 1.938 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 170.321 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.46 -44.48 68.94 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 173.507 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.01 -54.43 5.29 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 118.051 1.98 . . . . 0.0 118.051 171.07 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.82 -44.38 41.37 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 117.343 2.349 . . . . 0.0 117.343 -177.21 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.02 -35.57 28.71 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 170.176 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.13 76.08 1.32 Allowed Glycine 0 N--CA 1.493 2.453 0 CA-C-N 119.895 1.225 . . . . 0.0 114.381 178.985 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.1 m -162.79 152.93 16.23 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.913 . . . . 0.0 111.883 -173.271 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -76.09 54.44 0.86 Allowed 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 177.812 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 36.4 ttm -86.74 95.35 9.79 Favored 'General case' 0 CA--C 1.568 1.658 0 O-C-N 120.488 -1.383 . . . . 0.0 110.712 175.86 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -166.37 91.95 0.1 Allowed Glycine 0 N--CA 1.487 2.046 0 O-C-N 121.629 -0.669 . . . . 0.0 113.195 -174.322 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -108.32 61.29 0.61 Allowed 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 172.132 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.92 -44.2 3.49 Favored 'General case' 0 CA--C 1.57 1.735 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 177.181 . . . . . . . . 2 2 . 1 . 004 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.9 m -156.33 99.7 1.93 Allowed 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 123.221 1.486 . . . . 0.0 110.122 178.528 . . . . . . . . 1 1 . 1 . 004 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.781 0 O-C-N 117.085 -3.509 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.543 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 . . . . . . . . . 0 0 . 1 . 005 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.2 m -84.09 104.92 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 120.959 -1.088 . . . . 0.0 111.77 -179.434 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.01 -42.56 81.36 Favored Glycine 0 N--CA 1.499 2.885 0 N-CA-C 119.277 2.471 . . . . 0.0 119.277 177.606 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.254 10.3 tp -62.8 -38.54 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 169.268 . . . . . . . . 2 2 . 1 . 005 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -66.39 -46.95 74.11 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 117.398 1.719 . . . . 0.0 117.398 167.623 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.75 -42.4 71.6 Favored 'General case' 0 CA--C 1.575 1.91 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 165.948 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.49 -44.7 95.68 Favored 'General case' 0 CA--C 1.572 1.8 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 167.102 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -55.32 -51.49 66.57 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 168.426 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.8 mt -52.26 -46.6 65.87 Favored 'General case' 0 N--CA 1.499 1.98 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 171.426 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.53 -44.86 95.98 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 118.411 2.124 . . . . 0.0 118.411 168.434 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -51.52 -43.91 62.42 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 175.189 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.3 mt -56.63 -46.14 81.14 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -178.26 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -85.66 -51.41 3.66 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 117.734 1.854 . . . . 0.0 117.734 170.688 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.73 -40.03 69.7 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.635 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.31 -47.38 11.55 Favored 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 165.228 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 115.39 86.0 1.3 Allowed Glycine 0 N--CA 1.49 2.285 0 CA-C-N 119.25 0.932 . . . . 0.0 113.81 174.134 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.3 m -159.88 123.72 3.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.821 -0.811 . . . . 0.0 111.309 -179.45 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -83.59 63.08 7.19 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.737 -1.227 . . . . 0.0 114.059 171.823 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 25.0 ttt -104.25 129.09 52.07 Favored 'General case' 0 CA--C 1.568 1.646 0 O-C-N 121.155 -0.965 . . . . 0.0 112.004 -175.996 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -103.02 122.33 7.46 Favored Glycine 0 N--CA 1.489 2.175 0 O-C-N 121.424 -0.797 . . . . 0.0 114.301 176.074 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.22 78.51 8.0 Favored 'General case' 0 CA--C 1.573 1.845 0 O-C-N 121.631 -0.923 . . . . 0.0 112.945 170.488 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -158.68 122.58 3.96 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.333 -0.854 . . . . 0.0 111.414 -165.962 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -83.2 74.93 9.97 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 123.015 1.388 . . . . 0.0 114.165 -179.272 . . . . . . . . 1 1 . 1 . 005 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.8 0 O-C-N 117.449 -3.282 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.539 0 CA-C-O 121.799 0.809 . . . . 0.0 112.727 . . . . . . . . . 0 0 . 1 . 006 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 84.9 t -86.67 84.71 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 120.998 -1.063 . . . . 0.0 110.216 -176.839 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.26 -55.06 17.25 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 118.219 2.047 . . . . 0.0 118.219 -177.092 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.6 mm -64.58 -39.35 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 178.577 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.42 -45.03 97.24 Favored Glycine 0 N--CA 1.498 2.783 0 N-CA-C 118.19 2.036 . . . . 0.0 118.19 167.221 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.16 84.56 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 166.755 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -61.86 -52.33 64.55 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 165.691 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -51.28 -54.39 26.47 Favored 'General case' 0 CA--C 1.573 1.839 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 171.994 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.98 -27.62 64.86 Favored 'General case' 0 CA--C 1.573 1.852 0 N-CA-C 116.573 2.064 . . . . 0.0 116.573 172.96 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.16 -49.95 70.84 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 117.468 1.747 . . . . 0.0 117.468 161.93 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -65.57 -53.72 38.03 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 168.693 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.35 -59.2 3.6 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -177.809 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.69 -50.83 4.05 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 118.307 2.083 . . . . 0.0 118.307 -176.184 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.61 -49.66 25.05 Favored 'General case' 0 CA--C 1.57 1.726 0 N-CA-C 116.613 2.079 . . . . 0.0 116.613 179.963 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.79 -45.05 19.51 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 172.793 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.59 89.71 2.11 Favored Glycine 0 N--CA 1.489 2.2 0 CA-C-N 119.276 0.943 . . . . 0.0 113.112 -176.299 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.2 m -155.87 138.7 15.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.497 -1.002 . . . . 0.0 111.66 -177.574 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.1 p -80.75 79.24 7.44 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.503 -1.373 . . . . 0.0 112.319 178.359 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 24.0 mmt -90.94 93.11 9.06 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-O 121.814 0.816 . . . . 0.0 110.666 -177.001 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -88.08 77.68 1.84 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 116.358 1.303 . . . . 0.0 116.358 -176.101 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.23 81.94 7.94 Favored 'General case' 0 CA--C 1.57 1.743 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 177.548 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -144.33 -67.62 0.33 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.647 -0.658 . . . . 0.0 112.099 -178.422 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.7 m -158.63 127.6 5.51 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 122.829 1.3 . . . . 0.0 110.446 179.819 . . . . . . . . 1 1 . 1 . 006 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.755 0 O-C-N 117.26 -3.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.552 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 . . . . . . . . . 0 0 . 1 . 007 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.8 t -87.35 85.05 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 120.846 -1.159 . . . . 0.0 110.131 -177.832 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.69 26.76 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -175.92 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.283 6.8 tp -66.57 -33.62 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 174.565 . . . . . . . . 2 2 . 1 . 007 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.13 -48.19 87.2 Favored Glycine 0 N--CA 1.497 2.752 0 N-CA-C 117.019 1.567 . . . . 0.0 117.019 165.707 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.15 -45.09 75.64 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 166.507 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.4 tt -63.22 -56.09 19.56 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 169.748 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.64 -38.83 92.59 Favored 'General case' 0 CA--C 1.569 1.7 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -178.08 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.97 -42.36 99.81 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 120.882 1.674 . . . . 0.0 115.507 170.498 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -60.12 -50.34 68.71 Favored Glycine 0 N--CA 1.498 2.784 0 N-CA-C 117.683 1.833 . . . . 0.0 117.683 165.377 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -50.6 -53.95 26.57 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 165.839 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.59 -40.06 94.85 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 179.534 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.34 -45.86 94.11 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 118.131 2.012 . . . . 0.0 118.131 166.117 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.21 97.11 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 171.44 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.06 -39.97 71.92 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 117.006 2.225 . . . . 0.0 117.006 169.814 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 75.73 1.31 Allowed Glycine 0 N--CA 1.49 2.254 0 CA-C-N 119.563 1.074 . . . . 0.0 114.962 178.322 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.7 m -154.61 138.49 16.28 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.651 -0.911 . . . . 0.0 112.381 -177.87 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t -86.08 129.89 34.7 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.186 -0.946 . . . . 0.0 112.113 171.439 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 26.1 ttt -81.42 123.8 28.88 Favored 'General case' 0 CA--C 1.571 1.764 0 O-C-N 121.098 -1.001 . . . . 0.0 112.683 -179.509 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -163.52 -82.19 0.04 OUTLIER Glycine 0 N--CA 1.489 2.195 0 O-C-N 121.686 -0.634 . . . . 0.0 113.037 176.746 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.79 73.08 9.85 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 175.46 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -91.87 86.24 5.84 Favored 'General case' 0 CA--C 1.568 1.664 0 O-C-N 121.1 -1.0 . . . . 0.0 111.78 -176.452 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -84.04 70.77 10.54 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 123.127 1.442 . . . . 0.0 114.376 -178.638 . . . . . . . . 1 1 . 1 . 007 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.734 0 O-C-N 117.301 -3.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.531 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 . . . . . . . . . 0 0 . 1 . 008 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.1 t -86.2 82.15 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 120.901 -1.124 . . . . 0.0 110.443 -176.474 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.68 -59.11 4.57 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 116.919 1.527 . . . . 0.0 116.919 179.907 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.256 13.7 tt -57.96 -41.65 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 172.393 . . . . . . . . 2 2 . 1 . 008 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.03 -44.73 97.37 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 117.964 1.946 . . . . 0.0 117.964 169.125 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.91 -40.94 97.19 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 117.344 2.35 . . . . 0.0 117.344 169.466 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 45.0 tp -62.58 -47.37 84.12 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 167.812 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -57.88 -56.3 23.7 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 169.98 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 41.5 tp -66.13 -40.52 90.71 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 116.435 2.013 . . . . 0.0 116.435 178.114 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.23 -48.02 85.92 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 117.797 1.879 . . . . 0.0 117.797 166.873 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -66.08 -38.68 88.9 Favored 'General case' 0 CA--C 1.578 2.03 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 170.129 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.01 -57.1 12.93 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 170.747 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.1 -53.4 3.32 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 118.367 2.107 . . . . 0.0 118.367 -176.99 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.39 -41.23 48.62 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 -179.605 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.3 -49.8 11.89 Favored 'General case' 0 CA--C 1.573 1.836 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 168.029 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 112.18 82.52 1.21 Allowed Glycine 0 N--CA 1.49 2.278 0 CA-C-N 119.229 0.922 . . . . 0.0 113.897 177.251 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.0 m -158.6 105.7 1.85 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.733 -0.863 . . . . 0.0 111.514 -177.408 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.1 t -81.57 110.83 17.32 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.929 -1.107 . . . . 0.0 112.721 176.994 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -79.96 88.71 5.32 Favored 'General case' 0 CA--C 1.571 1.787 0 O-C-N 121.026 -1.046 . . . . 0.0 112.847 -175.837 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -83.18 78.7 1.99 Allowed Glycine 0 N--CA 1.493 2.477 0 N-CA-C 116.14 1.216 . . . . 0.0 116.14 -179.545 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.57 86.14 5.25 Favored 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -177.58 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -86.68 80.62 8.5 Favored 'General case' 0 CA--C 1.57 1.717 0 O-C-N 121.292 -0.88 . . . . 0.0 112.614 -172.732 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.1 t -84.98 73.59 10.66 Favored 'General case' 0 CA--C 1.569 1.673 0 CA-C-O 123.175 1.464 . . . . 0.0 114.434 -175.534 . . . . . . . . 1 1 . 1 . 008 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.773 0 O-C-N 117.346 -3.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.567 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 . . . . . . . . . 0 0 . 1 . 009 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 62.2 t -85.16 106.61 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.294 -0.879 . . . . 0.0 109.355 -175.125 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.23 -69.71 2.97 Favored Glycine 0 N--CA 1.494 2.538 0 O-C-N 121.339 -0.851 . . . . 0.0 114.936 -172.772 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 28.9 pt -63.03 -36.46 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 176.998 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.79 -46.27 92.24 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 117.535 1.774 . . . . 0.0 117.535 167.343 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.29 -43.34 96.36 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.039 2.237 . . . . 0.0 117.039 167.577 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.6 tp -61.92 -45.47 93.58 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.526 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.57 -41.79 95.31 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 167.919 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.8 tp -60.86 -42.96 98.87 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 116.196 1.924 . . . . 0.0 116.196 169.432 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.89 -47.91 85.74 Favored Glycine 0 N--CA 1.498 2.768 0 N-CA-C 117.837 1.895 . . . . 0.0 117.837 165.972 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -53.76 -59.15 4.98 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 164.833 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.2 tp -68.96 -40.42 78.91 Favored 'General case' 0 CA--C 1.572 1.807 0 N-CA-C 116.309 1.966 . . . . 0.0 116.309 -176.893 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.91 -40.74 97.24 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 118.478 2.151 . . . . 0.0 118.478 167.692 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.4 87.04 Favored 'General case' 0 CA--C 1.573 1.859 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 167.095 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.69 -45.35 59.25 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 117.279 2.326 . . . . 0.0 117.279 174.588 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.99 75.38 1.3 Allowed Glycine 0 N--CA 1.491 2.331 0 CA-C-N 119.483 1.038 . . . . 0.0 115.405 179.981 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.5 m -157.87 148.33 20.67 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.478 -1.013 . . . . 0.0 112.447 -179.363 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 65.2 p -90.58 74.57 6.75 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.58 -1.325 . . . . 0.0 111.915 175.929 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 12.8 tpt -101.55 88.16 3.36 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.132 -0.98 . . . . 0.0 111.316 -174.959 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -153.47 -51.22 0.01 OUTLIER Glycine 0 N--CA 1.497 2.729 0 N-CA-C 117.635 1.814 . . . . 0.0 117.635 -178.321 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.36 89.11 2.6 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -173.502 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.7 ptt-85 -145.19 -56.1 0.32 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -179.523 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.6 t -85.06 74.72 10.46 Favored 'General case' 0 CA--C 1.569 1.685 0 CA-C-O 122.972 1.368 . . . . 0.0 114.062 -176.631 . . . . . . . . 1 1 . 1 . 009 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.791 0 O-C-N 117.538 -3.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.523 0 CA-C-O 121.912 0.863 . . . . 0.0 112.714 . . . . . . . . . 0 0 . 1 . 010 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.3 t -86.38 82.35 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 120.806 -1.184 . . . . 0.0 110.174 -177.753 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.3 -56.64 6.71 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 117.385 1.714 . . . . 0.0 117.385 -178.428 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.27 10.3 tp -60.46 -37.16 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 175.545 . . . . . . . . 2 2 . 1 . 010 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.18 -49.67 69.4 Favored Glycine 0 N--CA 1.498 2.788 0 N-CA-C 117.624 1.81 . . . . 0.0 117.624 167.977 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.88 85.22 Favored 'General case' 0 CA--C 1.574 1.893 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 167.839 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.0 tp -61.1 -45.78 93.32 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 168.752 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -61.13 -39.15 88.96 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 116.485 2.032 . . . . 0.0 116.485 170.364 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.2 mt -58.48 -41.51 85.45 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 164.623 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.8 -47.83 69.56 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.301 2.08 . . . . 0.0 118.301 161.3 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -56.9 -49.34 75.86 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 115.924 1.824 . . . . 0.0 115.924 170.1 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 19.7 tp -63.33 -46.1 88.23 Favored 'General case' 0 CA--C 1.573 1.854 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 173.045 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.13 -43.87 95.05 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 118.719 2.248 . . . . 0.0 118.719 170.026 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.71 -36.94 85.92 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 117.585 2.439 . . . . 0.0 117.585 167.413 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.51 -42.47 67.95 Favored 'General case' 0 CA--C 1.571 1.781 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 172.877 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.52 -57.06 4.18 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.295 1.678 . . . . 0.0 117.295 178.798 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.3 p -72.66 102.51 3.33 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -179.287 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 p -81.07 91.43 6.1 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.591 -0.693 . . . . 0.0 112.598 -173.108 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -89.44 90.11 8.16 Favored 'General case' 0 CA--C 1.57 1.717 0 CA-C-O 121.656 0.741 . . . . 0.0 111.849 -176.132 . . . . . . . . 2 2 . 1 . 010 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.77 61.83 1.65 Allowed Glycine 0 N--CA 1.497 2.707 0 N-CA-C 116.462 1.345 . . . . 0.0 116.462 177.796 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -140.91 96.21 2.97 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 117.603 0.702 . . . . 0.0 110.897 -178.077 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -89.32 83.57 6.44 Favored 'General case' 0 CA--C 1.57 1.734 0 O-C-N 121.091 -1.006 . . . . 0.0 111.854 -171.783 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.0 p -84.47 86.01 7.33 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.94 1.353 . . . . 0.0 113.657 -177.106 . . . . . . . . 1 1 . 1 . 010 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.804 0 O-C-N 117.679 -3.138 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.55 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 . . . . . . . . . 0 0 . 1 . 011 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.8 m -85.46 110.54 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 120.932 -1.105 . . . . 0.0 112.095 179.485 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.41 93.2 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 118.828 2.291 . . . . 0.0 118.828 176.446 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.59 -40.79 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.374 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 172.568 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.12 -44.36 97.32 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 118.204 2.042 . . . . 0.0 118.204 168.753 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.14 -44.22 83.18 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 116.938 2.199 . . . . 0.0 116.938 165.456 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 mt -56.77 -48.42 77.9 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 165.676 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.28 -38.22 90.27 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 174.908 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 tt -57.58 -45.41 85.27 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 162.814 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.9 -45.6 61.32 Favored Glycine 0 N--CA 1.496 2.648 0 N-CA-C 118.758 2.263 . . . . 0.0 118.758 163.884 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -61.11 -52.2 65.88 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 170.607 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 60.7 tp -46.53 -52.81 12.58 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 117.087 2.254 . . . . 0.0 117.087 167.059 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.85 -56.48 4.88 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 117.832 1.893 . . . . 0.0 117.832 177.109 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.13 92.29 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 117.403 2.372 . . . . 0.0 117.403 -179.429 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.24 20.74 2.64 Favored 'General case' 0 CA--C 1.58 2.123 0 N-CA-C 117.111 2.263 . . . . 0.0 117.111 164.683 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 41.46 49.6 4.74 Favored Glycine 0 N--CA 1.499 2.866 0 N-CA-C 121.799 3.479 . . . . 0.0 121.799 169.581 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p -159.1 134.88 8.72 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 117.821 0.811 . . . . 0.0 112.281 -164.713 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.5 m -78.05 94.48 4.67 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.165 -0.959 . . . . 0.0 111.323 -179.073 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 68.2 mtt -84.94 96.19 9.28 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 121.883 0.849 . . . . 0.0 112.669 -169.879 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.69 74.2 2.53 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 115.864 1.106 . . . . 0.0 115.864 177.128 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.56 -52.07 9.01 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -179.301 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.55 -57.79 2.86 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 167.554 . . . . . . . . 2 2 . 1 . 011 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.5 t -85.27 77.33 10.01 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 123.042 1.401 . . . . 0.0 111.906 164.616 . . . . . . . . 1 1 . 1 . 011 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.771 0 O-C-N 117.711 -3.118 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.559 0 CA-C-O 121.754 0.787 . . . . 0.0 112.82 . . . . . . . . . 0 0 . 1 . 012 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 t -90.85 133.01 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.2 -0.937 . . . . 0.0 109.999 -179.729 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -54.17 -43.25 74.07 Favored Glycine 0 N--CA 1.502 3.094 0 N-CA-C 119.358 2.503 . . . . 0.0 119.358 173.903 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 58.2 mt -61.91 -40.03 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 167.422 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.57 -48.32 85.34 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 117.822 1.889 . . . . 0.0 117.822 168.618 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.93 -41.47 78.27 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 117.246 2.313 . . . . 0.0 117.246 166.497 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -57.17 -46.83 82.46 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 165.036 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -60.36 -51.86 67.72 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 172.842 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.77 -32.1 73.49 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 171.314 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.27 -49.01 83.15 Favored Glycine 0 N--CA 1.495 2.575 0 N-CA-C 117.823 1.889 . . . . 0.0 117.823 161.663 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.89 -53.56 30.97 Favored 'General case' 0 CA--C 1.578 2.05 0 N-CA-C 115.781 1.771 . . . . 0.0 115.781 174.634 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.8 -49.52 20.44 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 176.831 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -83.57 -61.19 1.9 Allowed Glycine 0 N--CA 1.492 2.415 0 N-CA-C 117.252 1.661 . . . . 0.0 117.252 -175.765 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.47 -47.45 67.06 Favored 'General case' 0 CA--C 1.571 1.778 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 179.3 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.45 -22.68 43.82 Favored 'General case' 0 CA--C 1.573 1.848 0 N-CA-C 118.058 2.614 . . . . 0.0 118.058 171.554 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.86 -6.77 77.27 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 120.056 2.783 . . . . 0.0 120.056 -175.788 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.2 p -77.9 99.81 6.14 Favored 'General case' 0 CA--C 1.565 1.549 0 CA-C-N 119.669 1.734 . . . . 0.0 112.352 175.609 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 59.6 p -80.2 98.21 7.25 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -164.87 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 28.1 ttt -78.3 108.88 11.96 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 121.508 -0.745 . . . . 0.0 112.045 171.926 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.92 73.65 2.59 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 116.303 1.281 . . . . 0.0 116.303 178.864 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.72 88.31 5.2 Favored 'General case' 0 CA--C 1.569 1.71 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -177.344 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -85.03 81.9 8.68 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.244 -0.91 . . . . 0.0 112.952 -174.8 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.9 t -87.57 69.42 9.74 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.064 1.412 . . . . 0.0 114.512 -175.135 . . . . . . . . 1 1 . 1 . 012 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.807 0 O-C-N 117.354 -3.341 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.563 0 CA-C-O 121.802 0.81 . . . . 0.0 112.682 . . . . . . . . . 0 0 . 1 . 013 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 90.7 t -86.3 85.49 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.021 -1.05 . . . . 0.0 110.471 -176.992 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -58.59 4.66 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 116.848 1.499 . . . . 0.0 116.848 178.094 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -62.4 -36.52 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 177.267 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.95 -51.36 54.0 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 117.068 1.587 . . . . 0.0 117.068 168.797 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.13 -40.73 86.38 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 169.325 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 tp -61.86 -48.97 78.13 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 170.215 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -66.22 -40.98 90.69 Favored 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 173.081 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 tp -49.47 -49.93 43.36 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 116.459 2.022 . . . . 0.0 116.459 162.037 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.86 -45.04 96.5 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 118.402 2.121 . . . . 0.0 118.402 167.906 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -58.16 -46.14 86.23 Favored 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.542 2.053 . . . . 0.0 116.542 168.909 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.0 mt -54.04 -46.4 71.9 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 168.255 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.09 -49.6 45.93 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 118.345 2.098 . . . . 0.0 118.345 170.813 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.28 80.38 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 117.56 2.43 . . . . 0.0 117.56 178.639 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.86 -37.02 56.36 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 168.61 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.06 66.52 1.65 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 116.107 1.203 . . . . 0.0 116.107 177.577 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.8 m -159.78 147.07 16.65 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.605 -0.938 . . . . 0.0 112.158 -176.204 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.5 p -82.42 93.59 7.24 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.938 -1.101 . . . . 0.0 110.899 173.196 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 48.8 mtt -92.07 91.91 8.02 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.565 0.698 . . . . 0.0 112.033 -168.448 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -158.41 75.96 0.2 Allowed Glycine 0 N--CA 1.49 2.233 0 N-CA-C 116.1 1.2 . . . . 0.0 116.1 -178.584 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -83.28 75.34 9.96 Favored 'General case' 0 CA--C 1.571 1.778 0 CA-C-O 121.821 0.819 . . . . 0.0 112.671 169.757 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.8 mtm-85 -129.62 -62.99 0.95 Allowed 'General case' 0 N--CA 1.496 1.868 0 C-N-CA 123.267 0.627 . . . . 0.0 112.397 -170.133 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.1 p -83.8 85.17 7.34 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-O 122.834 1.302 . . . . 0.0 113.623 -178.742 . . . . . . . . 1 1 . 1 . 013 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.785 0 O-C-N 117.716 -3.115 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.505 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 . . . . . . . . . 0 0 . 1 . 014 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 m -79.15 93.44 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.036 -1.04 . . . . 0.0 112.294 -175.657 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.88 -57.38 4.95 Favored Glycine 0 N--CA 1.496 2.688 0 O-C-N 120.632 -1.292 . . . . 0.0 116.117 -170.047 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.4 mt -57.76 -47.68 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 124.521 1.128 . . . . 0.0 113.917 177.454 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.67 -42.04 99.17 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 118.464 2.146 . . . . 0.0 118.464 169.221 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.54 -42.02 95.66 Favored 'General case' 0 CA--C 1.575 1.914 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 166.581 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.0 -51.42 66.3 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 163.998 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -57.71 -42.68 84.25 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 171.459 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.0 mt -60.92 -44.69 96.84 Favored 'General case' 0 CA--C 1.574 1.879 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 169.349 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -59.21 -47.39 91.07 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 117.981 1.953 . . . . 0.0 117.981 166.848 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -47.16 -54.16 11.29 Favored 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 160.844 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.34 -43.56 90.53 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 179.238 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.14 -42.86 99.92 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 118.323 2.089 . . . . 0.0 118.323 168.513 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.94 94.55 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 169.098 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.78 -37.74 64.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 172.62 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 62.85 1.57 Allowed Glycine 0 N--CA 1.493 2.455 0 CA-C-N 119.724 1.147 . . . . 0.0 115.796 -176.297 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.1 t -145.79 -179.73 6.89 Favored 'General case' 0 CA--C 1.573 1.847 0 CA-C-O 122.711 1.243 . . . . 0.0 113.233 -172.628 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.6 m -138.07 99.94 4.02 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 119.96 -1.713 . . . . 0.0 108.082 170.353 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 25.7 ttt -120.66 116.33 25.09 Favored 'General case' 0 CA--C 1.567 1.621 0 C-N-CA 123.529 0.732 . . . . 0.0 110.85 -171.189 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.52 83.49 1.63 Allowed Glycine 0 N--CA 1.491 2.336 0 N-CA-C 115.9 1.12 . . . . 0.0 115.9 179.89 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.94 -42.75 94.37 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 179.2 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -84.23 81.79 8.66 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.064 -1.022 . . . . 0.0 111.052 167.738 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 82.2 p -85.25 85.18 7.48 Favored 'General case' 0 CA--C 1.566 1.589 0 CA-C-O 122.973 1.368 . . . . 0.0 113.761 -172.215 . . . . . . . . 1 1 . 1 . 014 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.78 0 O-C-N 117.665 -3.147 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.526 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 . . . . . . . . . 0 0 . 1 . 015 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 m -83.51 59.78 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.248 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -176.192 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.52 -56.64 4.54 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 116.674 1.43 . . . . 0.0 116.674 176.45 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.257 36.9 pt -63.75 -40.05 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 172.99 . . . . . . . . 2 2 . 1 . 015 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.68 -48.63 70.16 Favored Glycine 0 N--CA 1.496 2.671 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 167.829 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.573 1.843 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 166.349 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -62.07 -46.09 90.63 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 167.02 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -59.38 -48.55 81.22 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 171.494 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.9 mt -59.96 -43.38 95.07 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 169.932 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.61 -50.87 62.72 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 117.786 1.874 . . . . 0.0 117.786 167.82 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -61.91 -47.61 84.18 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 171.428 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.69 -36.35 80.63 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 174.558 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.76 -53.35 7.33 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 117.821 1.888 . . . . 0.0 117.821 167.899 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.64 -46.55 18.95 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -177.867 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.59 -37.54 24.89 Favored 'General case' 0 CA--C 1.571 1.762 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 171.129 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.04 47.93 5.35 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 118.275 2.07 . . . . 0.0 118.275 173.808 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.8 p -84.23 69.78 10.48 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.02 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.8 m -78.94 -59.68 2.68 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 123.394 0.678 . . . . 0.0 112.746 -177.483 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 67.1 mtt -83.44 81.11 8.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.975 -1.078 . . . . 0.0 110.565 168.703 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 169.86 -70.02 0.14 Allowed Glycine 0 N--CA 1.489 2.21 0 O-C-N 121.397 -0.814 . . . . 0.0 114.643 -171.745 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -83.12 78.73 9.55 Favored 'General case' 0 CA--C 1.57 1.721 0 CA-C-N 117.979 0.89 . . . . 0.0 113.308 177.61 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.6 tpm_? -90.76 89.95 7.72 Favored 'General case' 0 CA--C 1.568 1.646 0 CA-C-O 121.801 0.81 . . . . 0.0 112.874 -173.459 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.3 t -85.93 76.15 9.89 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-O 123.124 1.44 . . . . 0.0 112.796 172.117 . . . . . . . . 1 1 . 1 . 015 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.789 0 O-C-N 117.495 -3.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.549 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 . . . . . . . . . 0 0 . 1 . 016 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.5 t -86.72 83.73 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 120.969 -1.082 . . . . 0.0 110.292 -176.745 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.07 -57.97 4.97 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 117.278 1.671 . . . . 0.0 117.278 -179.039 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 31.2 mt -63.01 -41.55 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 177.214 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.32 -44.99 96.13 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 168.553 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.31 91.76 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 117.005 2.224 . . . . 0.0 117.005 166.501 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.87 -47.69 84.02 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 167.631 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -62.53 -41.73 99.06 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 169.345 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.9 -47.98 81.21 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 169.351 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.35 -48.82 77.64 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 117.997 1.959 . . . . 0.0 117.997 166.971 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -49.16 -50.73 36.38 Favored 'General case' 0 CA--C 1.579 2.073 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 164.465 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.63 -49.02 79.21 Favored 'General case' 0 CA--C 1.574 1.871 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 174.322 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.22 -50.73 63.88 Favored Glycine 0 N--CA 1.494 2.54 0 N-CA-C 118.246 2.058 . . . . 0.0 118.246 170.914 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.55 74.9 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 172.273 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.2 -2.37 21.42 Favored 'General case' 0 CA--C 1.577 1.982 0 N-CA-C 118.746 2.869 . . . . 0.0 118.746 167.34 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 54.49 36.16 57.83 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 119.712 2.645 . . . . 0.0 119.712 -177.506 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.0 p -165.02 135.06 3.73 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.547 0.674 . . . . 0.0 110.226 -161.158 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 69.3 p -79.79 73.81 6.52 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 120.985 -1.072 . . . . 0.0 113.874 -172.907 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.17 120.88 12.94 Favored 'General case' 0 CA--C 1.57 1.733 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -169.59 . . . . . . . . 2 2 . 1 . 016 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 106.98 -77.3 0.23 Allowed Glycine 0 N--CA 1.49 2.249 0 O-C-N 121.859 -0.526 . . . . 0.0 112.707 -161.941 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.82 75.99 5.64 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 175.143 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -96.24 83.9 3.67 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.868 -1.145 . . . . 0.0 111.201 178.192 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.1 m -158.11 114.78 2.85 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.818 1.294 . . . . 0.0 110.191 179.585 . . . . . . . . 1 1 . 1 . 016 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.756 0 O-C-N 117.126 -3.484 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.491 0 CA-C-O 121.855 0.836 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 017 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.3 m -82.69 99.11 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 120.944 -1.097 . . . . 0.0 112.024 -178.602 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.88 -37.86 71.8 Favored Glycine 0 N--CA 1.499 2.897 0 N-CA-C 119.608 2.603 . . . . 0.0 119.608 177.436 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.11 -48.69 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.267 0 CA-C-N 118.333 1.067 . . . . 0.0 113.154 171.497 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.34 -51.76 55.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 117.339 1.696 . . . . 0.0 117.339 169.84 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.9 71.35 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 117.715 2.487 . . . . 0.0 117.715 171.293 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.2 -55.74 12.82 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 169.868 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.32 -41.37 94.07 Favored 'General case' 0 CA--C 1.572 1.82 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 -176.126 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.36 -42.8 99.29 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.332 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -61.45 -49.0 81.74 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 117.814 1.886 . . . . 0.0 117.814 164.358 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -52.9 -57.42 10.31 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.169 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.4 tp -68.52 -37.63 80.19 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 178.905 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -58.34 -47.11 91.58 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 118.197 2.039 . . . . 0.0 118.197 165.181 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.28 78.01 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 167.558 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.91 -36.86 85.32 Favored 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.827 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.45 -60.32 0.45 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 116.342 1.297 . . . . 0.0 116.342 173.346 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 85.3 p -77.12 89.71 3.63 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.03 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.5 p -85.14 82.22 8.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.493 -0.754 . . . . 0.0 112.877 -173.382 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 13.6 tpt -140.71 123.02 15.87 Favored 'General case' 0 CA--C 1.566 1.581 0 C-N-CA 123.731 0.813 . . . . 0.0 110.457 178.481 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.75 82.39 1.69 Allowed Glycine 0 N--CA 1.494 2.515 0 O-C-N 121.043 -1.036 . . . . 0.0 114.274 169.531 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.76 95.25 5.93 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -174.78 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.6 mmt-85 -119.19 -60.86 1.7 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -178.736 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.0 p -82.44 85.39 6.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.526 -1.359 . . . . 0.0 113.64 -179.385 . . . . . . . . 1 1 . 1 . 017 ecloud nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.794 0 O-C-N 117.725 -3.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_