data_2pg4_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 2pg4 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' MSE . . . . . 0.606 ' O ' ' CD1' ' A' ' 6' ' ' LEU . 41.4 ttm . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 121.484 0.659 . . . . 52.16 111.02 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -74.24 11.17 1.0 Allowed 'General case' 0 C--O 1.244 0.802 0 N-CA-C 115.516 1.673 . . . . 61.04 115.516 -174.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -59.4 131.89 52.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 116.902 -1.919 . . . . 63.54 107.746 179.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -74.33 -12.88 60.66 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.526 -0.546 . . . . 71.2 109.526 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 96.7 m -52.12 -36.96 52.71 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 123.99 0.806 . . . . 53.85 112.383 167.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . 0.606 ' CD1' ' O ' ' A' ' 1' ' ' MSE . 83.1 mt -64.75 -24.33 67.53 Favored 'General case' 0 C--O 1.205 -1.249 0 N-CA-C 112.939 0.718 . . . . 49.42 112.939 -179.65 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . . . -87.45 -8.1 56.88 Favored 'General case' 0 N--CA 1.438 -1.059 0 C-N-CA 123.553 0.741 . . . . 62.45 111.346 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 72.2 mt -78.61 157.91 28.59 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.066 0.46 . . . . 46.69 110.136 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -80.59 145.55 31.68 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 107.432 -1.322 . . . . 47.72 107.432 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -67.37 -46.73 72.46 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.359 -0.978 . . . . 43.49 108.359 -171.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.81 -49.39 58.5 Favored Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.59 1.796 . . . . 51.61 117.59 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -54.88 -43.2 72.95 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 113.397 0.888 . . . . 50.47 113.397 172.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.2 mt -65.68 -53.96 34.02 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 112.793 0.664 . . . . 52.28 112.793 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.55 -23.7 34.0 Favored 'Isoleucine or valine' 0 C--O 1.251 1.164 0 N-CA-C 113.671 0.989 . . . . 52.77 113.671 -177.629 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 63.2 mtt85 -80.9 -58.31 3.14 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 115.246 1.572 . . . . 84.25 115.246 171.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.3 mt -74.43 -40.72 49.42 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.075 0 N-CA-C 112.979 0.733 . . . . 59.06 112.979 -171.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mp -72.25 -50.63 8.51 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 113.065 0.765 . . . . 46.24 113.065 -170.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -53.72 -39.72 82.5 Favored 'Trans proline' 0 C--N 1.357 1.01 0 N-CA-C 118.786 2.572 . . . . 44.31 118.786 163.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.7 m -57.93 -45.83 85.97 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-O 122.127 0.965 . . . . 54.19 110.253 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -67.15 -37.58 84.02 Favored 'General case' 0 C--O 1.243 0.718 0 O-C-N 120.872 -1.142 . . . . 50.19 112.953 -179.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.5 tp -60.77 -38.47 85.38 Favored 'General case' 0 CA--C 1.563 1.455 0 CA-C-O 121.625 0.726 . . . . 44.81 112.865 172.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -72.55 -38.14 68.07 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.692 -0.63 . . . . 63.16 112.65 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -59.93 -46.21 90.12 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.89 0.476 . . . . 48.86 110.791 169.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -61.57 -42.71 99.25 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.564 0.95 . . . . 65.1 113.564 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -60.94 -32.75 72.26 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 121.054 -0.258 . . . . 53.98 110.853 174.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -81.64 -4.26 55.67 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.186 1.55 . . . . 56.38 115.186 175.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 78.05 15.61 80.88 Favored Glycine 0 CA--C 1.541 1.697 0 N-CA-C 116.714 1.446 . . . . 42.85 116.714 -173.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -103.67 135.96 44.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 118.607 1.203 . . . . 45.95 110.946 -172.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -101.23 98.34 8.77 Favored Pre-proline 0 C--O 1.246 0.918 0 C-N-CA 125.604 1.562 . . . . 57.7 112.465 173.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -86.46 149.13 8.89 Favored 'Trans proline' 0 N--CA 1.438 -1.774 0 O-C-N 123.771 1.406 . . . . 44.57 113.728 -173.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . 0.402 ' OG ' ' O2 ' ' A' ' 97' ' ' EDO . 83.6 p -73.84 161.4 30.21 Favored 'General case' 0 C--O 1.21 -0.997 0 CA-C-N 114.715 -1.13 . . . . 41.26 109.58 175.181 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 73.1 mt -54.15 -37.65 64.64 Favored 'General case' 0 C--O 1.198 -1.652 0 O-C-N 121.471 -0.768 . . . . 41.93 110.699 177.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.3 -42.12 93.38 Favored 'General case' 0 CA--C 1.567 1.601 0 C-N-CA 124.272 1.029 . . . . 43.66 111.181 179.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -69.92 -38.38 76.23 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 121.86 -0.525 . . . . 48.8 109.856 179.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 70.2 mt -58.09 -46.88 88.12 Favored 'Isoleucine or valine' 0 C--O 1.252 1.206 0 CA-C-O 121.323 0.582 . . . . 43.83 111.868 174.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 46.2 t -61.85 -49.08 85.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 CA-C-O 121.211 0.529 . . . . 45.88 111.24 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . . . -58.82 -52.12 67.08 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.926 0.89 . . . . 57.21 112.295 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.42 87.25 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 113.461 0.912 . . . . 47.84 113.461 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.0 p -77.74 -33.57 52.88 Favored 'General case' 0 N--CA 1.509 2.475 0 N-CA-C 114.913 1.449 . . . . 48.86 114.913 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.64 6.13 66.1 Favored Glycine 0 C--O 1.211 -1.294 0 C-N-CA 120.262 -0.971 . . . . 46.93 113.587 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.6 m -74.0 159.64 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-N 119.171 1.486 . . . . 49.51 108.402 170.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.8 p -78.3 146.67 34.64 Favored 'General case' 0 C--O 1.252 1.223 0 C-N-CA 118.923 -1.111 . . . . 52.43 108.053 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -58.76 -43.65 90.39 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.325 -0.55 . . . . 47.45 111.067 178.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.32 -51.52 69.19 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.576 0.584 . . . . 52.67 112.576 174.724 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 90.6 m -52.47 -43.45 64.97 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 114.513 1.301 . . . . 48.12 114.513 169.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -62.14 -56.75 15.68 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 122.087 0.946 . . . . 49.19 113.402 178.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -81.55 -8.33 59.7 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 115.115 1.524 . . . . 51.38 115.115 -172.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' MSE . . . . . . . . . . . . . . . -108.51 17.55 21.92 Favored 'General case' 0 C--O 1.21 -1.004 0 C-N-CA 122.981 0.513 . . . . 46.84 110.01 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 154.44 -39.36 0.66 Allowed Glycine 0 C--O 1.215 -1.032 0 N-CA-C 118.19 2.036 . . . . 45.24 118.19 174.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 23.2 tp -59.35 -51.56 69.38 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 115.046 1.498 . . . . 44.05 115.046 -172.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -46.3 -54.01 9.73 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.554 0.946 . . . . 44.18 113.554 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -65.91 -28.95 69.32 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 120.296 -0.562 . . . . 57.54 112.136 -176.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 95.5 mtm-85 -70.35 -36.45 74.19 Favored 'General case' 0 C--O 1.249 1.027 0 N-CA-C 112.146 0.424 . . . . 48.18 112.146 176.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.3 mt -68.27 -37.91 81.18 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 123.548 0.53 . . . . 45.01 109.6 177.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.68 -52.48 59.17 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 N-CA-C 111.851 0.315 . . . . 47.54 111.851 172.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 44.9 mtm-85 -51.38 -48.42 62.56 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.516 -0.311 . . . . 53.13 111.323 176.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.96 0.19 4.82 Favored 'General case' 0 C--O 1.248 0.984 0 N-CA-C 116.958 2.207 . . . . 46.74 116.958 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 77.87 21.19 71.97 Favored Glycine 0 N--CA 1.483 1.789 0 CA-C-N 118.052 0.387 . . . . 44.54 112.705 172.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 83.1 mt -97.74 -25.61 15.02 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.024 0.75 . . . . 42.25 113.024 -172.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 23.4 m -149.76 159.83 5.19 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.8 0 N-CA-C 108.633 -0.877 . . . . 44.5 108.633 -177.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -130.28 141.43 50.61 Favored 'General case' 0 C--O 1.205 -1.249 0 CA-C-N 115.842 -0.617 . . . . 64.55 109.393 168.276 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -87.78 135.22 33.48 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 123.732 0.813 . . . . 59.26 110.161 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -134.38 154.39 51.38 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.858 -0.61 . . . . 69.97 109.525 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 55.2 m -71.38 129.13 38.06 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.461 -0.79 . . . . 52.77 110.066 171.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.9 tp -92.76 -63.54 1.21 Allowed 'General case' 0 C--O 1.258 1.538 0 CA-C-O 122.529 1.157 . . . . 54.47 108.579 174.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 89.5 p -143.46 -167.33 2.54 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 115.505 -0.77 . . . . 61.26 109.616 169.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -53.55 120.1 5.72 Favored 'General case' 0 C--O 1.25 1.097 0 C-N-CA 120.025 -0.67 . . . . 72.13 111.173 175.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . . . 76.89 3.7 3.37 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 113.218 0.822 . . . . 57.42 113.218 173.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 46.7 t -131.16 123.09 52.85 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 CA-C-N 118.101 0.409 . . . . 53.71 110.191 -173.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . 0.491 ' NZ ' ' O ' ' A' ' 113' ' ' HOH . 21.6 mmtp -111.32 158.29 19.2 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 125.464 1.728 . . . . 69.63 110.305 -178.839 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 12.9 t -133.23 167.54 20.17 Favored 'General case' 0 C--O 1.249 1.051 0 N-CA-C 107.453 -1.314 . . . . 42.02 107.453 175.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 95.8 mt -110.2 134.18 52.48 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 107.938 -1.134 . . . . 45.67 107.938 167.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . . . -106.84 130.94 54.45 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 124.554 1.159 . . . . 63.81 110.495 169.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.2 mt -61.11 142.67 56.52 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 112.531 0.567 . . . . 44.59 112.531 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.4 p -87.88 170.65 10.98 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 103.876 -2.639 . . . . 45.43 103.876 171.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -57.04 -46.76 82.18 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 118.232 0.469 . . . . 45.13 110.755 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.3 tttt -58.51 -40.66 83.48 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 114.696 1.369 . . . . 49.8 114.696 171.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.06 -37.82 92.1 Favored Glycine 0 C--O 1.214 -1.104 0 N-CA-C 110.967 -0.853 . . . . 44.48 110.967 176.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 ttm105 -71.39 -39.63 71.05 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.607 0.595 . . . . 62.21 112.607 176.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 -59.89 -45.32 92.88 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 120.458 -0.497 . . . . 67.7 111.148 174.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 17.9 tp -67.88 -44.31 77.32 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 113.218 0.822 . . . . 54.88 113.218 177.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -46.37 -47.23 18.76 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 112.807 0.669 . . . . 43.55 112.807 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . 0.405 ' O ' ' NZ ' ' A' ' 87' ' ' LYS . 21.9 mm-40 -63.4 -42.11 98.78 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.014 -0.539 . . . . 61.92 111.716 178.565 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 83.5 m -63.42 -42.51 98.72 Favored 'General case' 0 C--O 1.209 -1.054 0 C-N-CA 120.897 -0.321 . . . . 55.82 110.722 175.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.3 mt -66.97 -15.34 63.65 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 115.628 1.714 . . . . 53.9 115.628 177.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -71.43 -35.2 70.86 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.986 -0.746 . . . . 62.47 108.986 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . 0.405 ' NZ ' ' O ' ' A' ' 83' ' ' GLU . 29.4 mmtm -75.65 -37.15 59.87 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.165 -0.68 . . . . 69.9 109.165 -178.98 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 69.2 m -55.18 -44.45 75.26 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 108.516 -0.92 . . . . 52.39 108.516 174.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -58.48 -39.43 79.98 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.43 0.9 . . . . 72.38 113.43 179.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -57.91 -53.05 62.55 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.479 0.487 . . . . 70.47 110.685 177.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.2 t -50.12 -53.29 11.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 O-C-N 124.237 0.961 . . . . 64.52 110.521 176.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 10.3 mt . . . . . 0 C--N 1.325 -0.498 0 N-CA-C 108.546 -0.909 . . . . 62.85 108.546 178.459 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 32.6 t0 . . . . . 0 N--CA 1.497 1.882 0 CA-C-O 121.474 0.654 . . . . 69.17 110.449 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 26.6 tp10 -76.52 -26.14 54.93 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.529 -1.285 . . . . 85.76 107.529 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 11.1 m -52.12 -42.49 63.35 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 112.68 0.622 . . . . 53.61 112.68 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mp -66.89 -26.73 67.02 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 113.503 0.927 . . . . 53.22 113.503 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . . . -79.71 -8.8 59.46 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.416 0.524 . . . . 64.94 112.416 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 75.8 mt -75.55 152.04 37.81 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-O 121.797 0.808 . . . . 53.57 113.096 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -75.84 135.12 40.21 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 114.341 -1.299 . . . . 46.2 107.721 175.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -57.69 -43.42 85.09 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 113.626 0.973 . . . . 46.72 113.626 179.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.77 -43.64 96.34 Favored Glycine 0 N--CA 1.476 1.349 0 N-CA-C 115.257 0.863 . . . . 45.55 115.257 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' HIS . . . . . 0.578 ' NE2' ' O6 ' ' B' ' 97' ' ' CIT . 66.4 m170 -62.96 -36.09 82.32 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 112.328 0.492 . . . . 48.49 112.328 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 12.4 mt -69.8 -46.37 65.88 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-O 123.41 1.576 . . . . 55.33 109.278 -179.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -26.38 31.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 113.343 -1.753 . . . . 57.45 110.175 -172.652 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 81.5 mtt-85 -85.49 -49.47 8.05 Favored 'General case' 0 C--O 1.206 -1.204 0 N-CA-C 113.221 0.823 . . . . 51.74 113.221 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 9.1 mm -72.03 -52.17 26.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 114.24 1.2 . . . . 50.06 114.24 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 mt -71.46 -45.07 13.3 Favored Pre-proline 0 N--CA 1.477 0.91 0 CA-C-N 119.021 0.828 . . . . 49.87 112.435 -168.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -54.46 -38.42 89.74 Favored 'Trans proline' 0 CA--C 1.553 1.432 0 N-CA-C 116.599 1.73 . . . . 46.78 116.599 167.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 3.2 m -63.46 -45.26 91.66 Favored 'General case' 0 CA--C 1.504 -0.822 0 O-C-N 121.605 -0.684 . . . . 47.75 110.218 179.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.87 -45.92 90.29 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.11 0.782 . . . . 48.1 113.11 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 14.1 tp -57.2 -45.6 83.63 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 112.37 0.507 . . . . 48.52 112.37 175.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -65.01 -38.24 90.29 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-O 119.183 -0.437 . . . . 74.84 111.841 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -58.89 -44.77 91.23 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 118.47 0.577 . . . . 50.7 110.45 172.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -65.93 -40.5 91.46 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.091 0.957 . . . . 69.66 113.314 -175.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -62.36 -34.41 76.62 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 123.242 0.617 . . . . 57.24 111.716 175.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -82.31 -5.96 58.93 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.035 1.124 . . . . 63.75 114.035 173.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.87 18.57 78.69 Favored Glycine 0 C--O 1.242 0.619 0 N-CA-C 113.929 0.332 . . . . 49.04 113.929 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -97.26 140.57 31.55 Favored 'General case' 0 C--O 1.204 -1.292 0 CA-C-O 121.746 0.784 . . . . 49.09 112.686 -175.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLU . . . . . 0.543 ' OE1' ' NZ ' ' B' ' 73' ' ' LYS . 19.1 mt-10 -115.89 96.16 46.07 Favored Pre-proline 0 C--O 1.256 1.396 0 C-N-CA 123.512 0.725 . . . . 69.72 109.402 -175.883 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -83.87 148.38 12.21 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 121.796 1.664 . . . . 49.44 113.46 -173.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 66.0 p -70.4 171.16 10.49 Favored 'General case' 0 C--O 1.247 0.923 0 O-C-N 124.295 0.997 . . . . 45.74 110.251 167.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.06 -40.69 96.83 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 119.428 -0.909 . . . . 48.25 112.522 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.78 74.63 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 113.087 0.773 . . . . 46.29 113.087 174.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -68.53 -32.77 72.96 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 121.324 -0.86 . . . . 47.51 109.648 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 47.0 mt -66.51 -46.22 86.96 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 O-C-N 120.855 -1.153 . . . . 49.06 110.277 178.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 76.9 t -56.54 -52.48 52.65 Favored 'Isoleucine or valine' 0 C--O 1.242 0.697 0 CA-C-O 121.732 0.777 . . . . 47.22 110.648 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.22 -51.84 48.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 O-C-N 120.911 -1.118 . . . . 66.39 110.236 -174.245 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.33 -37.92 79.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 120.169 -0.612 . . . . 46.07 110.759 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 93.4 p -77.35 -21.71 52.93 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 116.054 1.872 . . . . 49.45 116.054 -176.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.49 3.5 90.04 Favored Glycine 0 CA--C 1.53 0.985 0 N-CA-C 116.541 1.376 . . . . 48.92 116.541 -178.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 17.1 m -78.91 153.67 4.87 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.897 0 N-CA-C 108.607 -0.886 . . . . 52.1 108.607 165.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 40.5 p -83.33 158.07 22.34 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 122.171 0.986 . . . . 51.36 110.888 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -55.93 -42.52 76.23 Favored 'General case' 0 C--O 1.248 0.99 0 CA-C-N 115.289 -0.868 . . . . 56.28 110.97 175.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . . . -66.42 -45.51 79.64 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 113.514 0.931 . . . . 53.02 113.514 -179.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' THR . . . . . 0.587 ' OG1' ' O4 ' ' B' ' 97' ' ' CIT . 52.9 m -57.19 -50.45 72.81 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-O 122.001 0.905 . . . . 46.88 113.11 170.627 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -60.18 -49.74 76.43 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 120.978 -1.076 . . . . 51.15 113.768 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -85.77 -11.37 53.71 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 115.615 1.709 . . . . 55.74 115.615 -173.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' MSE . . . . . . . . . . . . . 13.4 tpp -106.48 15.99 25.23 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 117.857 -1.068 . . . . 63.82 111.923 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 160.71 -33.75 0.4 Allowed Glycine 0 C--O 1.213 -1.183 0 N-CA-C 119.048 2.379 . . . . 50.34 119.048 168.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 56.5 tp -67.23 -49.15 65.56 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 113.319 0.859 . . . . 46.52 113.319 -170.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -43.98 -54.6 5.27 Favored 'General case' 0 C--O 1.267 1.977 0 CA-C-O 122.45 1.119 . . . . 49.34 112.714 172.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -70.62 -24.73 62.78 Favored 'General case' 0 C--O 1.205 -1.279 0 CA-C-N 114.156 -1.384 . . . . 65.46 112.519 -175.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ARG . . . . . . . . . . . . . 86.8 mtm-85 -71.95 -37.09 70.02 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.741 0.781 . . . . 55.64 110.75 173.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 89.2 mt -70.02 -31.56 69.27 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 120.301 -0.56 . . . . 46.19 110.022 -178.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 93.2 mt -70.99 -52.06 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 108.73 -0.841 . . . . 49.28 108.73 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.2 mtm-85 -56.83 -28.84 62.15 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 116.648 2.092 . . . . 68.67 116.648 174.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.45 -2.48 49.74 Favored 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 112.663 0.616 . . . . 44.35 112.663 172.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 72.05 29.25 67.09 Favored Glycine 0 C--O 1.213 -1.176 0 CA-C-N 118.506 0.594 . . . . 44.61 112.691 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.21 -26.09 14.04 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 118.691 -1.203 . . . . 46.28 110.182 -175.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 5.6 m -142.48 162.33 18.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 O-C-N 124.17 0.919 . . . . 47.84 109.107 -178.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -126.96 132.5 50.81 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 104.914 -2.254 . . . . 69.96 104.914 173.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -83.54 132.36 34.93 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 118.52 0.6 . . . . 53.14 112.607 169.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -132.04 146.14 51.88 Favored 'General case' 0 C--O 1.204 -1.326 0 N-CA-C 112.706 0.632 . . . . 60.91 112.706 176.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' THR . . . . . . . . . . . . . 3.4 m -76.05 116.2 16.52 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 107.913 -1.143 . . . . 50.11 107.913 165.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 22.1 tp -83.31 -40.43 19.52 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 114.876 -1.056 . . . . 45.52 112.412 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 59.1 p -151.52 178.93 8.81 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 125.545 1.538 . . . . 44.26 111.244 173.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -56.72 -19.11 15.0 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.887 0.851 . . . . 61.58 111.137 171.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -98.68 -42.65 7.14 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 113.78 1.03 . . . . 57.56 113.78 -168.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 35.5 m -137.15 157.96 35.57 Favored 'Isoleucine or valine' 0 C--O 1.258 1.532 0 CA-C-O 121.657 0.742 . . . . 48.88 111.485 -169.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -114.3 165.16 12.99 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 113.77 -1.559 . . . . 58.12 108.469 170.34 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 6.8 t -142.0 171.73 13.66 Favored 'General case' 0 C--O 1.253 1.289 0 O-C-N 124.926 1.391 . . . . 49.92 108.119 178.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 89.1 mt -120.75 135.09 55.24 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 107.309 -1.367 . . . . 49.22 107.309 169.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' LYS . . . . . 0.543 ' NZ ' ' OE1' ' B' ' 29' ' ' GLU . 32.3 mmtm -107.96 138.62 43.89 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 124.764 1.29 . . . . 68.69 109.172 174.649 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 44.7 mt -71.3 137.35 48.44 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 110.073 -0.343 . . . . 48.62 110.073 172.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 53.2 p -83.42 178.44 8.03 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 103.1 -2.926 . . . . 45.09 103.1 171.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.56 -39.25 77.52 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 118.341 0.519 . . . . 65.4 111.253 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 21.6 ttpt -56.05 -52.56 63.82 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 119.965 -0.694 . . . . 53.92 111.414 169.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.18 -41.69 70.67 Favored Glycine 0 CA--C 1.502 -0.739 0 N-CA-C 111.865 -0.494 . . . . 47.05 111.865 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 42.5 ttm105 -64.57 -45.28 87.72 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 113.87 1.063 . . . . 62.49 113.87 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 21.2 mtp180 -64.77 -44.08 91.19 Favored 'General case' 0 C--O 1.216 -0.679 0 N-CA-C 110.414 -0.217 . . . . 73.24 110.414 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.11 -34.75 79.14 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.511 0.93 . . . . 48.64 113.511 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.11 88.72 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 119.42 -0.324 . . . . 48.47 111.102 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -59.52 -40.74 88.12 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 124.022 0.826 . . . . 63.62 112.884 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 61.7 m -69.2 -35.59 76.38 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 111.962 0.356 . . . . 59.72 111.962 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 22.0 mt -73.62 -27.43 61.27 Favored 'General case' 0 CA--C 1.557 1.212 0 N-CA-C 113.122 0.786 . . . . 52.36 113.122 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -57.53 -46.89 83.32 Favored 'General case' 0 CA--C 1.507 -0.699 0 C-N-CA 122.813 0.445 . . . . 69.37 111.421 168.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -63.66 -40.15 96.11 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.064 -0.517 . . . . 75.44 109.868 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' CYS . . . . . . . . . . . . . 23.2 m -58.39 -35.82 72.59 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.396 0.678 . . . . 56.59 111.282 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 4.8 mtp180 -70.23 -30.55 67.65 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.843 -1.071 . . . . 85.7 112.695 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -65.94 -31.37 72.26 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 123.227 0.329 . . . . 67.86 111.003 173.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.6 -39.36 75.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 113.179 0.807 . . . . 62.66 113.179 174.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 70.7 mt -85.29 -88.62 0.11 Allowed 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 109.481 -0.563 . . . . 68.87 109.481 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.684 0 N-CA-C 112.591 -0.204 . . . . 78.52 112.591 178.141 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' EDO . . . . . 0.402 ' O2 ' ' OG ' ' A' ' 31' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' CIT . . . . . 0.587 ' O4 ' ' OG1' ' B' ' 45' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' PEG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . 0.491 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MSE . . . . . 0.688 ' O ' HD12 ' A' ' 6' ' ' LEU . 41.4 ttm . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 121.484 0.659 . . . . 69.260000000000005 111.02 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -74.24 11.17 1.0 Allowed 'General case' 0 C--O 1.244 0.802 0 N-CA-C 115.516 1.673 . . . . 70.019999999999996 115.516 -174.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . 0.479 ' H ' ' C ' ' A' ' 1' ' ' MSE . 18.0 t0 -59.4 131.89 52.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 116.902 -1.919 . . . . 63.539999999999999 107.746 179.269 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -74.33 -12.88 60.66 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.526 -0.546 . . . . 71.200000000000003 109.526 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 96.7 m -52.12 -36.96 52.71 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 123.99 0.806 . . . . 53.850000000000001 112.383 167.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 1' ' ' MSE . 83.1 mt -64.75 -24.33 67.53 Favored 'General case' 0 C--O 1.205 -1.249 0 N-CA-C 112.939 0.718 . . . . 49.420000000000002 112.939 -179.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . . . -87.45 -8.1 56.88 Favored 'General case' 0 N--CA 1.438 -1.059 0 C-N-CA 123.553 0.741 . . . . 62.450000000000003 111.346 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 72.2 mt -78.61 157.91 28.59 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.066 0.46 . . . . 46.689999999999998 110.136 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -80.59 145.55 31.68 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 107.432 -1.322 . . . . 47.719999999999999 107.432 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -67.37 -46.73 72.46 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.359 -0.978 . . . . 43.490000000000002 108.359 -171.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLY . . . . . 0.403 ' HA2' HG22 ' A' ' 14' ' ' ILE . . . -53.81 -49.39 58.5 Favored Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.59 1.796 . . . . 51.609999999999999 117.59 178.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -54.88 -43.2 72.95 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 113.397 0.888 . . . . 50.469999999999999 113.397 172.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.2 mt -65.68 -53.96 34.02 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 112.793 0.664 . . . . 52.280000000000001 112.793 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ILE . . . . . 0.403 HG22 ' HA2' ' A' ' 11' ' ' GLY . 0.9 OUTLIER -63.55 -23.7 34.0 Favored 'Isoleucine or valine' 0 C--O 1.251 1.164 0 N-CA-C 113.671 0.989 . . . . 52.770000000000003 113.671 -177.629 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 63.2 mtt85 -80.9 -58.31 3.14 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 115.246 1.572 . . . . 84.25 115.246 171.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.3 mt -74.43 -40.72 49.42 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.075 0 N-CA-C 112.979 0.733 . . . . 59.060000000000002 112.979 -171.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mp -72.25 -50.63 8.51 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 113.065 0.765 . . . . 46.240000000000002 113.065 -170.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -53.72 -39.72 82.5 Favored 'Trans proline' 0 C--N 1.357 1.01 0 N-CA-C 118.786 2.572 . . . . 44.310000000000002 118.786 163.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.7 m -57.93 -45.83 85.97 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-O 122.127 0.965 . . . . 54.189999999999998 110.253 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -67.15 -37.58 84.02 Favored 'General case' 0 C--O 1.243 0.718 0 O-C-N 120.872 -1.142 . . . . 50.189999999999998 112.953 -179.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 27.5 tp -60.77 -38.47 85.38 Favored 'General case' 0 CA--C 1.563 1.455 0 CA-C-O 121.625 0.726 . . . . 44.810000000000002 112.865 172.754 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -72.55 -38.14 68.07 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.692 -0.63 . . . . 63.159999999999997 112.65 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -59.93 -46.21 90.12 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.89 0.476 . . . . 48.859999999999999 110.791 169.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -61.57 -42.71 99.25 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.564 0.95 . . . . 65.099999999999994 113.564 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 21' ' ' LEU . 12.0 mtmt -60.94 -32.75 72.26 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 121.054 -0.258 . . . . 53.979999999999997 110.853 174.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -81.64 -4.26 55.67 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.186 1.55 . . . . 56.380000000000003 115.186 175.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 78.05 15.61 80.88 Favored Glycine 0 CA--C 1.541 1.697 0 N-CA-C 116.714 1.446 . . . . 42.850000000000001 116.714 -173.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -103.67 135.96 44.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 118.607 1.203 . . . . 45.950000000000003 110.946 -172.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -101.23 98.34 8.77 Favored Pre-proline 0 C--O 1.246 0.918 0 C-N-CA 125.604 1.562 . . . . 57.700000000000003 112.465 173.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -86.46 149.13 8.89 Favored 'Trans proline' 0 N--CA 1.438 -1.774 0 O-C-N 123.771 1.406 . . . . 44.57 113.728 -173.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 83.6 p -73.84 161.4 30.21 Favored 'General case' 0 C--O 1.21 -0.997 0 CA-C-N 114.715 -1.13 . . . . 41.259999999999998 109.58 175.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 73.1 mt -54.15 -37.65 64.64 Favored 'General case' 0 C--O 1.198 -1.652 0 O-C-N 121.471 -0.768 . . . . 41.93 110.699 177.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.3 -42.12 93.38 Favored 'General case' 0 CA--C 1.567 1.601 0 C-N-CA 124.272 1.029 . . . . 43.659999999999997 111.181 179.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -69.92 -38.38 76.23 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 121.86 -0.525 . . . . 48.799999999999997 109.856 179.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 70.2 mt -58.09 -46.88 88.12 Favored 'Isoleucine or valine' 0 C--O 1.252 1.206 0 CA-C-O 121.323 0.582 . . . . 43.829999999999998 111.868 174.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . 0.969 HG11 ' HG3' ' A' ' 43' ' ' GLU . 46.2 t -61.85 -49.08 85.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 CA-C-O 121.211 0.529 . . . . 45.880000000000003 111.24 177.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . . . -58.82 -52.12 67.08 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.926 0.89 . . . . 57.210000000000001 112.295 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.42 87.25 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 113.461 0.912 . . . . 47.840000000000003 113.461 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.0 p -77.74 -33.57 52.88 Favored 'General case' 0 N--CA 1.509 2.475 0 N-CA-C 114.913 1.449 . . . . 48.859999999999999 114.913 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.64 6.13 66.1 Favored Glycine 0 C--O 1.211 -1.294 0 C-N-CA 120.262 -0.971 . . . . 46.93 113.587 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.6 m -74.0 159.64 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-N 119.171 1.486 . . . . 49.509999999999998 108.402 170.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.8 p -78.3 146.67 34.64 Favored 'General case' 0 C--O 1.252 1.223 0 C-N-CA 118.923 -1.111 . . . . 52.43 108.053 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . 0.969 ' HG3' HG11 ' A' ' 36' ' ' VAL . 31.4 mt-10 -58.76 -43.65 90.39 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.325 -0.55 . . . . 47.450000000000003 111.067 178.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.32 -51.52 69.19 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.576 0.584 . . . . 52.670000000000002 112.576 174.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 90.6 m -52.47 -43.45 64.97 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 114.513 1.301 . . . . 48.119999999999997 114.513 169.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . 0.403 ' HA ' ' HB3' ' A' ' 50' ' ' LEU . 41.5 t80 -62.14 -56.75 15.68 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 122.087 0.946 . . . . 49.189999999999998 113.402 178.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -81.55 -8.33 59.7 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 115.115 1.524 . . . . 51.380000000000003 115.115 -172.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' MSE . . . . . . . . . . . . . . . -108.51 17.55 21.92 Favored 'General case' 0 C--O 1.21 -1.004 0 C-N-CA 122.981 0.513 . . . . 46.840000000000003 110.01 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 154.44 -39.36 0.66 Allowed Glycine 0 C--O 1.215 -1.032 0 N-CA-C 118.19 2.036 . . . . 45.240000000000002 118.19 174.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . 0.403 ' HB3' ' HA ' ' A' ' 46' ' ' PHE . 23.2 tp -59.35 -51.56 69.38 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 115.046 1.498 . . . . 44.049999999999997 115.046 -172.633 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -46.3 -54.01 9.73 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.554 0.946 . . . . 44.18 113.554 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -65.91 -28.95 69.32 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 120.296 -0.562 . . . . 57.539999999999999 112.136 -176.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 95.5 mtm-85 -70.35 -36.45 74.19 Favored 'General case' 0 C--O 1.249 1.027 0 N-CA-C 112.146 0.424 . . . . 48.18 112.146 176.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.3 mt -68.27 -37.91 81.18 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 123.548 0.53 . . . . 45.009999999999998 109.6 177.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.68 -52.48 59.17 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 N-CA-C 111.851 0.315 . . . . 47.539999999999999 111.851 172.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 44.9 mtm-85 -51.38 -48.42 62.56 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.516 -0.311 . . . . 53.130000000000003 111.323 176.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.96 0.19 4.82 Favored 'General case' 0 C--O 1.248 0.984 0 N-CA-C 116.958 2.207 . . . . 46.740000000000002 116.958 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 77.87 21.19 71.97 Favored Glycine 0 N--CA 1.483 1.789 0 CA-C-N 118.052 0.387 . . . . 44.539999999999999 112.705 172.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 83.1 mt -97.74 -25.61 15.02 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.024 0.75 . . . . 42.25 113.024 -172.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 23.4 m -149.76 159.83 5.19 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.8 0 N-CA-C 108.633 -0.877 . . . . 44.5 108.633 -177.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . 0.458 ' HZ3' ' H ' ' A' ' 62' ' ' GLU . 0.7 OUTLIER -130.28 141.43 50.61 Favored 'General case' 0 C--O 1.205 -1.249 0 CA-C-N 115.842 -0.617 . . . . 64.549999999999997 109.393 168.276 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . 0.458 ' H ' ' HZ3' ' A' ' 61' ' ' LYS . 42.4 tt0 -87.78 135.22 33.48 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 123.732 0.813 . . . . 59.259999999999998 110.161 -179.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -134.38 154.39 51.38 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.858 -0.61 . . . . 69.969999999999999 109.525 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 55.2 m -71.38 129.13 38.06 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.461 -0.79 . . . . 52.770000000000003 110.066 171.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.9 tp -92.76 -63.54 1.21 Allowed 'General case' 0 C--O 1.258 1.538 0 CA-C-O 122.529 1.157 . . . . 54.469999999999999 108.579 174.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 89.5 p -143.46 -167.33 2.54 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 115.505 -0.77 . . . . 61.259999999999998 109.616 169.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -53.55 120.1 5.72 Favored 'General case' 0 C--O 1.25 1.097 0 C-N-CA 120.025 -0.67 . . . . 72.129999999999995 111.173 175.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . . . 76.89 3.7 3.37 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 113.218 0.822 . . . . 57.420000000000002 113.218 173.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . 0.503 HG13 ' H21' ' A' ' 96' ' ' EDO . 46.7 t -131.16 123.09 52.85 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 CA-C-N 118.101 0.409 . . . . 53.710000000000001 110.191 -173.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 mmtp -111.32 158.29 19.2 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 125.464 1.728 . . . . 69.629999999999995 110.305 -178.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 12.9 t -133.23 167.54 20.17 Favored 'General case' 0 C--O 1.249 1.051 0 N-CA-C 107.453 -1.314 . . . . 42.020000000000003 107.453 175.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 95.8 mt -110.2 134.18 52.48 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 107.938 -1.134 . . . . 45.670000000000002 107.938 167.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . . . -106.84 130.94 54.45 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 124.554 1.159 . . . . 63.810000000000002 110.495 169.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.2 mt -61.11 142.67 56.52 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 112.531 0.567 . . . . 44.590000000000003 112.531 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.4 p -87.88 170.65 10.98 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 103.876 -2.639 . . . . 45.43 103.876 171.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -57.04 -46.76 82.18 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 118.232 0.469 . . . . 47.060000000000002 110.755 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.3 tttt -58.51 -40.66 83.48 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 114.696 1.369 . . . . 49.799999999999997 114.696 171.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.06 -37.82 92.1 Favored Glycine 0 C--O 1.214 -1.104 0 N-CA-C 110.967 -0.853 . . . . 44.479999999999997 110.967 176.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 ttm105 -71.39 -39.63 71.05 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.607 0.595 . . . . 62.210000000000001 112.607 176.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 -59.89 -45.32 92.88 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 120.458 -0.497 . . . . 67.700000000000003 111.148 174.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 17.9 tp -67.88 -44.31 77.32 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 113.218 0.822 . . . . 54.880000000000003 113.218 177.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -46.37 -47.23 18.76 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 112.807 0.669 . . . . 43.549999999999997 112.807 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -63.4 -42.11 98.78 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.014 -0.539 . . . . 61.920000000000002 111.716 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 83.5 m -63.42 -42.51 98.72 Favored 'General case' 0 C--O 1.209 -1.054 0 C-N-CA 120.897 -0.321 . . . . 55.82 110.722 175.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.3 mt -66.97 -15.34 63.65 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 115.628 1.714 . . . . 53.899999999999999 115.628 177.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -71.43 -35.2 70.86 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.986 -0.746 . . . . 62.469999999999999 108.986 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -75.65 -37.15 59.87 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.165 -0.68 . . . . 69.900000000000006 109.165 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 69.2 m -55.18 -44.45 75.26 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 108.516 -0.92 . . . . 52.390000000000001 108.516 174.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -58.48 -39.43 79.98 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.43 0.9 . . . . 72.379999999999995 113.43 179.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -57.91 -53.05 62.55 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.479 0.487 . . . . 70.469999999999999 110.685 177.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.2 t -50.12 -53.29 11.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 O-C-N 124.237 0.961 . . . . 64.519999999999996 110.521 176.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 10.3 mt . . . . . 0 C--N 1.325 -0.498 0 N-CA-C 108.546 -0.909 . . . . 62.850000000000001 108.546 178.459 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 32.6 t0 . . . . . 0 N--CA 1.497 1.882 0 CA-C-O 121.474 0.654 . . . . 69.170000000000002 110.449 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 26.6 tp10 -76.52 -26.14 54.93 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.529 -1.285 . . . . 85.760000000000005 107.529 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 11.1 m -52.12 -42.49 63.35 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 112.68 0.622 . . . . 53.609999999999999 112.68 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mp -66.89 -26.73 67.02 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 113.503 0.927 . . . . 53.219999999999999 113.503 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . . . -79.71 -8.8 59.46 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.416 0.524 . . . . 64.939999999999998 112.416 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LEU . . . . . 0.432 ' CD1' HD21 ' B' ' 13' ' ' LEU . 75.8 mt -75.55 152.04 37.81 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-O 121.797 0.808 . . . . 53.57 113.096 178.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 9' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -75.84 135.12 40.21 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 114.341 -1.299 . . . . 46.200000000000003 107.721 175.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -57.69 -43.42 85.09 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 113.626 0.973 . . . . 46.719999999999999 113.626 179.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.77 -43.64 96.34 Favored Glycine 0 N--CA 1.476 1.349 0 N-CA-C 115.257 0.863 . . . . 45.549999999999997 115.257 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' HIS . . . . . 0.472 ' HD2' ' H22' ' B' ' 97' ' ' CIT . 66.4 m170 -62.96 -36.09 82.32 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 112.328 0.492 . . . . 48.490000000000002 112.328 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LEU . . . . . 0.432 HD21 ' CD1' ' B' ' 8' ' ' LEU . 12.4 mt -69.8 -46.37 65.88 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-O 123.41 1.576 . . . . 55.329999999999998 109.278 -179.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -26.38 31.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 113.343 -1.753 . . . . 57.450000000000003 110.175 -172.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 81.5 mtt-85 -85.49 -49.47 8.05 Favored 'General case' 0 C--O 1.206 -1.204 0 N-CA-C 113.221 0.823 . . . . 51.740000000000002 113.221 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 9.1 mm -72.03 -52.17 26.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 114.24 1.2 . . . . 50.060000000000002 114.24 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 mt -71.46 -45.07 13.3 Favored Pre-proline 0 N--CA 1.477 0.91 0 CA-C-N 119.021 0.828 . . . . 49.869999999999997 112.435 -168.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -54.46 -38.42 89.74 Favored 'Trans proline' 0 CA--C 1.553 1.432 0 N-CA-C 116.599 1.73 . . . . 46.780000000000001 116.599 167.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 3.2 m -63.46 -45.26 91.66 Favored 'General case' 0 CA--C 1.504 -0.822 0 O-C-N 121.605 -0.684 . . . . 47.75 110.218 179.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.87 -45.92 90.29 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.11 0.782 . . . . 48.100000000000001 113.11 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 14.1 tp -57.2 -45.6 83.63 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 112.37 0.507 . . . . 48.520000000000003 112.37 175.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -65.01 -38.24 90.29 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-O 119.183 -0.437 . . . . 74.840000000000003 111.841 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -58.89 -44.77 91.23 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 118.47 0.577 . . . . 50.700000000000003 110.45 172.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -65.93 -40.5 91.46 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.091 0.957 . . . . 69.659999999999997 113.314 -175.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -62.36 -34.41 76.62 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 123.242 0.617 . . . . 57.240000000000002 111.716 175.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -82.31 -5.96 58.93 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.035 1.124 . . . . 63.75 114.035 173.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.87 18.57 78.69 Favored Glycine 0 C--O 1.242 0.619 0 N-CA-C 113.929 0.332 . . . . 49.039999999999999 113.929 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -97.26 140.57 31.55 Favored 'General case' 0 C--O 1.204 -1.292 0 CA-C-O 121.746 0.784 . . . . 49.090000000000003 112.686 -175.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLU . . . . . 0.499 ' OE1' ' NZ ' ' B' ' 73' ' ' LYS . 19.1 mt-10 -115.89 96.16 46.07 Favored Pre-proline 0 C--O 1.256 1.396 0 C-N-CA 123.512 0.725 . . . . 69.719999999999999 109.402 -175.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -83.87 148.38 12.21 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 121.796 1.664 . . . . 49.439999999999998 113.46 -173.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 66.0 p -70.4 171.16 10.49 Favored 'General case' 0 C--O 1.247 0.923 0 O-C-N 124.295 0.997 . . . . 45.740000000000002 110.251 167.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.06 -40.69 96.83 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 119.428 -0.909 . . . . 48.25 112.522 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.78 74.63 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 113.087 0.773 . . . . 46.289999999999999 113.087 174.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -68.53 -32.77 72.96 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 121.324 -0.86 . . . . 47.509999999999998 109.648 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 47.0 mt -66.51 -46.22 86.96 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 O-C-N 120.855 -1.153 . . . . 49.060000000000002 110.277 178.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 76.9 t -56.54 -52.48 52.65 Favored 'Isoleucine or valine' 0 C--O 1.242 0.697 0 CA-C-O 121.732 0.777 . . . . 47.219999999999999 110.648 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.22 -51.84 48.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 O-C-N 120.911 -1.118 . . . . 66.390000000000001 110.236 -174.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.33 -37.92 79.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 120.169 -0.612 . . . . 46.07 110.759 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 93.4 p -77.35 -21.71 52.93 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 116.054 1.872 . . . . 49.450000000000003 116.054 -176.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.49 3.5 90.04 Favored Glycine 0 CA--C 1.53 0.985 0 N-CA-C 116.541 1.376 . . . . 48.920000000000002 116.541 -178.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' VAL . . . . . 0.646 ' HA ' ' H41' ' B' ' 97' ' ' CIT . 17.1 m -78.91 153.67 4.87 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.897 0 N-CA-C 108.607 -0.886 . . . . 52.100000000000001 108.607 165.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 40.5 p -83.33 158.07 22.34 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 122.171 0.986 . . . . 51.359999999999999 110.888 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -55.93 -42.52 76.23 Favored 'General case' 0 C--O 1.248 0.99 0 CA-C-N 115.289 -0.868 . . . . 56.280000000000001 110.97 175.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LYS . . . . . 0.515 ' HG3' ' HE2' ' B' ' 48' ' ' MSE . . . -66.42 -45.51 79.64 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 113.514 0.931 . . . . 53.020000000000003 113.514 -179.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' THR . . . . . 0.535 ' OG1' ' O4 ' ' B' ' 97' ' ' CIT . 52.9 m -57.19 -50.45 72.81 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-O 122.001 0.905 . . . . 46.880000000000003 113.11 170.627 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -60.18 -49.74 76.43 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 120.978 -1.076 . . . . 51.149999999999999 113.768 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -85.77 -11.37 53.71 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 115.615 1.709 . . . . 55.740000000000002 115.615 -173.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' MSE . . . . . 0.515 ' HE2' ' HG3' ' B' ' 44' ' ' LYS . 13.4 tpp -106.48 15.99 25.23 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 117.857 -1.068 . . . . 63.82 111.923 -179.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 160.71 -33.75 0.4 Allowed Glycine 0 C--O 1.213 -1.183 0 N-CA-C 119.048 2.379 . . . . 50.340000000000003 119.048 168.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 56.5 tp -67.23 -49.15 65.56 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 113.319 0.859 . . . . 46.520000000000003 113.319 -170.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -43.98 -54.6 5.27 Favored 'General case' 0 C--O 1.267 1.977 0 CA-C-O 122.45 1.119 . . . . 49.340000000000003 112.714 172.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -70.62 -24.73 62.78 Favored 'General case' 0 C--O 1.205 -1.279 0 CA-C-N 114.156 -1.384 . . . . 65.459999999999994 112.519 -175.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ARG . . . . . . . . . . . . . 86.8 mtm-85 -71.95 -37.09 70.02 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.741 0.781 . . . . 55.640000000000001 110.75 173.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 89.2 mt -70.02 -31.56 69.27 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 120.301 -0.56 . . . . 46.189999999999998 110.022 -178.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 93.2 mt -70.99 -52.06 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 108.73 -0.841 . . . . 49.280000000000001 108.73 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.2 mtm-85 -56.83 -28.84 62.15 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 116.648 2.092 . . . . 68.670000000000002 116.648 174.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.45 -2.48 49.74 Favored 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 112.663 0.616 . . . . 44.350000000000001 112.663 172.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 72.05 29.25 67.09 Favored Glycine 0 C--O 1.213 -1.176 0 CA-C-N 118.506 0.594 . . . . 44.609999999999999 112.691 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.21 -26.09 14.04 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 118.691 -1.203 . . . . 46.280000000000001 110.182 -175.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 5.6 m -142.48 162.33 18.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 O-C-N 124.17 0.919 . . . . 47.840000000000003 109.107 -178.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -126.96 132.5 50.81 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 104.914 -2.254 . . . . 69.959999999999994 104.914 173.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -83.54 132.36 34.93 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 118.52 0.6 . . . . 53.140000000000001 112.607 169.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -132.04 146.14 51.88 Favored 'General case' 0 C--O 1.204 -1.326 0 N-CA-C 112.706 0.632 . . . . 60.909999999999997 112.706 176.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' THR . . . . . . . . . . . . . 3.4 m -76.05 116.2 16.52 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 107.913 -1.143 . . . . 50.109999999999999 107.913 165.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 22.1 tp -83.31 -40.43 19.52 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 114.876 -1.056 . . . . 45.520000000000003 112.412 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 59.1 p -151.52 178.93 8.81 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 125.545 1.538 . . . . 44.259999999999998 111.244 173.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -56.72 -19.11 15.0 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.887 0.851 . . . . 61.579999999999998 111.137 171.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -98.68 -42.65 7.14 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 113.78 1.03 . . . . 57.560000000000002 113.78 -168.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 35.5 m -137.15 157.96 35.57 Favored 'Isoleucine or valine' 0 C--O 1.258 1.532 0 CA-C-O 121.657 0.742 . . . . 48.880000000000003 111.485 -169.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LYS . . . . . 0.506 ' HB2' ' H12' ' B' ' 100' ' ' PEG . 0.5 OUTLIER -114.3 165.16 12.99 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 113.77 -1.559 . . . . 58.119999999999997 108.469 170.34 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 6.8 t -142.0 171.73 13.66 Favored 'General case' 0 C--O 1.253 1.289 0 O-C-N 124.926 1.391 . . . . 49.920000000000002 108.119 178.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 89.1 mt -120.75 135.09 55.24 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 107.309 -1.367 . . . . 49.219999999999999 107.309 169.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' LYS . . . . . 0.499 ' NZ ' ' OE1' ' B' ' 29' ' ' GLU . 32.3 mmtm -107.96 138.62 43.89 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 124.764 1.29 . . . . 68.689999999999998 109.172 174.649 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' B' ' 79' ' ' ARG . 44.7 mt -71.3 137.35 48.44 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 110.073 -0.343 . . . . 48.619999999999997 110.073 172.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 53.2 p -83.42 178.44 8.03 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 103.1 -2.926 . . . . 45.090000000000003 103.1 171.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.56 -39.25 77.52 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 118.341 0.519 . . . . 65.400000000000006 111.253 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 21.6 ttpt -56.05 -52.56 63.82 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 119.965 -0.694 . . . . 53.920000000000002 111.414 169.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.18 -41.69 70.67 Favored Glycine 0 CA--C 1.502 -0.739 0 N-CA-C 111.865 -0.494 . . . . 47.049999999999997 111.865 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ARG . . . . . 0.446 ' HA ' HD13 ' B' ' 74' ' ' LEU . 42.5 ttm105 -64.57 -45.28 87.72 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 113.87 1.063 . . . . 62.490000000000002 113.87 179.669 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 21.2 mtp180 -64.77 -44.08 91.19 Favored 'General case' 0 C--O 1.216 -0.679 0 N-CA-C 110.414 -0.217 . . . . 73.239999999999995 110.414 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.11 -34.75 79.14 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.511 0.93 . . . . 48.640000000000001 113.511 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.11 88.72 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 119.42 -0.324 . . . . 48.469999999999999 111.102 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -59.52 -40.74 88.12 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 124.022 0.826 . . . . 63.619999999999997 112.884 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 61.7 m -69.2 -35.59 76.38 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 111.962 0.356 . . . . 59.719999999999999 111.962 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 22.0 mt -73.62 -27.43 61.27 Favored 'General case' 0 CA--C 1.557 1.212 0 N-CA-C 113.122 0.786 . . . . 52.359999999999999 113.122 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -57.53 -46.89 83.32 Favored 'General case' 0 CA--C 1.507 -0.699 0 C-N-CA 122.813 0.445 . . . . 69.370000000000005 111.421 168.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -63.66 -40.15 96.11 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.064 -0.517 . . . . 75.439999999999998 109.868 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' CYS . . . . . . . . . . . . . 23.2 m -58.39 -35.82 72.59 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.396 0.678 . . . . 56.590000000000003 111.282 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 4.8 mtp180 -70.23 -30.55 67.65 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.843 -1.071 . . . . 85.700000000000003 112.695 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -65.94 -31.37 72.26 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 123.227 0.329 . . . . 67.859999999999999 111.003 173.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.6 -39.36 75.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 113.179 0.807 . . . . 62.659999999999997 113.179 174.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 70.7 mt -85.29 -88.62 0.11 Allowed 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 109.481 -0.563 . . . . 68.870000000000005 109.481 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.684 0 N-CA-C 112.591 -0.204 . . . . 78.519999999999996 112.591 178.141 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' EDO . . . . . 0.503 ' H21' HG13 ' A' ' 69' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 97' ' ' CIT . . . . . 0.646 ' H41' ' HA ' ' B' ' 41' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 99' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 100' ' ' PEG . . . . . 0.506 ' H12' ' HB2' ' B' ' 70' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MSE . . . . . 0.688 ' O ' HD12 ' A' ' 6' ' ' LEU . 41.4 ttm . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 121.484 0.659 . . . . 69.26 111.02 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -74.24 11.17 1.0 Allowed 'General case' 0 C--O 1.244 0.802 0 N-CA-C 115.516 1.673 . . . . 70.02 115.516 -174.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.479 ' H ' ' C ' ' A' ' 1' ' ' MSE . 18.0 t0 -59.4 131.89 52.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 116.902 -1.919 . . . . 63.54 107.746 179.269 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -74.33 -12.88 60.66 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.526 -0.546 . . . . 71.2 109.526 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 96.7 m -52.12 -36.96 52.71 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 123.99 0.806 . . . . 53.85 112.383 167.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 1' ' ' MSE . 83.1 mt -64.75 -24.33 67.53 Favored 'General case' 0 C--O 1.205 -1.249 0 N-CA-C 112.939 0.718 . . . . 49.42 112.939 -179.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . . . -87.45 -8.1 56.88 Favored 'General case' 0 N--CA 1.438 -1.059 0 C-N-CA 123.553 0.741 . . . . 62.45 111.346 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 72.2 mt -78.61 157.91 28.59 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.066 0.46 . . . . 46.69 110.136 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -80.59 145.55 31.68 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 107.432 -1.322 . . . . 47.72 107.432 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -67.37 -46.73 72.46 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.359 -0.978 . . . . 43.49 108.359 -171.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.403 ' HA2' HG22 ' A' ' 14' ' ' ILE . . . -53.81 -49.39 58.5 Favored Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.59 1.796 . . . . 51.61 117.59 178.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -54.88 -43.2 72.95 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 113.397 0.888 . . . . 50.47 113.397 172.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.2 mt -65.68 -53.96 34.02 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 112.793 0.664 . . . . 52.28 112.793 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.403 HG22 ' HA2' ' A' ' 11' ' ' GLY . 0.9 OUTLIER -63.55 -23.7 34.0 Favored 'Isoleucine or valine' 0 C--O 1.251 1.164 0 N-CA-C 113.671 0.989 . . . . 52.77 113.671 -177.629 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 63.2 mtt85 -80.9 -58.31 3.14 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 115.246 1.572 . . . . 84.25 115.246 171.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.3 mt -74.43 -40.72 49.42 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.075 0 N-CA-C 112.979 0.733 . . . . 59.06 112.979 -171.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mp -72.25 -50.63 8.51 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 113.065 0.765 . . . . 46.24 113.065 -170.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -53.72 -39.72 82.5 Favored 'Trans proline' 0 C--N 1.357 1.01 0 N-CA-C 118.786 2.572 . . . . 44.31 118.786 163.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.7 m -57.93 -45.83 85.97 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-O 122.127 0.965 . . . . 54.19 110.253 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -67.15 -37.58 84.02 Favored 'General case' 0 C--O 1.243 0.718 0 O-C-N 120.872 -1.142 . . . . 50.19 112.953 -179.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 27.5 tp -60.77 -38.47 85.38 Favored 'General case' 0 CA--C 1.563 1.455 0 CA-C-O 121.625 0.726 . . . . 44.81 112.865 172.754 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -72.55 -38.14 68.07 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.692 -0.63 . . . . 63.16 112.65 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -59.93 -46.21 90.12 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.89 0.476 . . . . 48.86 110.791 169.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -61.57 -42.71 99.25 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.564 0.95 . . . . 65.1 113.564 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 21' ' ' LEU . 12.0 mtmt -60.94 -32.75 72.26 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 121.054 -0.258 . . . . 53.98 110.853 174.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -81.64 -4.26 55.67 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.186 1.55 . . . . 56.38 115.186 175.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 78.05 15.61 80.88 Favored Glycine 0 CA--C 1.541 1.697 0 N-CA-C 116.714 1.446 . . . . 42.85 116.714 -173.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -103.67 135.96 44.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 118.607 1.203 . . . . 45.95 110.946 -172.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -101.23 98.34 8.77 Favored Pre-proline 0 C--O 1.246 0.918 0 C-N-CA 125.604 1.562 . . . . 57.7 112.465 173.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -86.46 149.13 8.89 Favored 'Trans proline' 0 N--CA 1.438 -1.774 0 O-C-N 123.771 1.406 . . . . 44.57 113.728 -173.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 83.6 p -73.84 161.4 30.21 Favored 'General case' 0 C--O 1.21 -0.997 0 CA-C-N 114.715 -1.13 . . . . 41.26 109.58 175.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 73.1 mt -54.15 -37.65 64.64 Favored 'General case' 0 C--O 1.198 -1.652 0 O-C-N 121.471 -0.768 . . . . 41.93 110.699 177.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.3 -42.12 93.38 Favored 'General case' 0 CA--C 1.567 1.601 0 C-N-CA 124.272 1.029 . . . . 43.66 111.181 179.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -69.92 -38.38 76.23 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 121.86 -0.525 . . . . 48.8 109.856 179.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 70.2 mt -58.09 -46.88 88.12 Favored 'Isoleucine or valine' 0 C--O 1.252 1.206 0 CA-C-O 121.323 0.582 . . . . 43.83 111.868 174.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.969 HG11 ' HG3' ' A' ' 43' ' ' GLU . 46.2 t -61.85 -49.08 85.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 CA-C-O 121.211 0.529 . . . . 45.88 111.24 177.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . . . -58.82 -52.12 67.08 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.926 0.89 . . . . 57.21 112.295 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.42 87.25 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 113.461 0.912 . . . . 47.84 113.461 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.0 p -77.74 -33.57 52.88 Favored 'General case' 0 N--CA 1.509 2.475 0 N-CA-C 114.913 1.449 . . . . 48.86 114.913 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.64 6.13 66.1 Favored Glycine 0 C--O 1.211 -1.294 0 C-N-CA 120.262 -0.971 . . . . 46.93 113.587 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.6 m -74.0 159.64 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-N 119.171 1.486 . . . . 49.51 108.402 170.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.8 p -78.3 146.67 34.64 Favored 'General case' 0 C--O 1.252 1.223 0 C-N-CA 118.923 -1.111 . . . . 52.43 108.053 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.969 ' HG3' HG11 ' A' ' 36' ' ' VAL . 31.4 mt-10 -58.76 -43.65 90.39 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.325 -0.55 . . . . 47.45 111.067 178.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.32 -51.52 69.19 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.576 0.584 . . . . 52.67 112.576 174.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 90.6 m -52.47 -43.45 64.97 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 114.513 1.301 . . . . 48.12 114.513 169.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.403 ' HA ' ' HB3' ' A' ' 50' ' ' LEU . 41.5 t80 -62.14 -56.75 15.68 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 122.087 0.946 . . . . 49.19 113.402 178.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -81.55 -8.33 59.7 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 115.115 1.524 . . . . 51.38 115.115 -172.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' MSE . . . . . . . . . . . . . . . -108.51 17.55 21.92 Favored 'General case' 0 C--O 1.21 -1.004 0 C-N-CA 122.981 0.513 . . . . 46.84 110.01 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 154.44 -39.36 0.66 Allowed Glycine 0 C--O 1.215 -1.032 0 N-CA-C 118.19 2.036 . . . . 45.24 118.19 174.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.403 ' HB3' ' HA ' ' A' ' 46' ' ' PHE . 23.2 tp -59.35 -51.56 69.38 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 115.046 1.498 . . . . 44.05 115.046 -172.633 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -46.3 -54.01 9.73 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.554 0.946 . . . . 44.18 113.554 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -65.91 -28.95 69.32 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 120.296 -0.562 . . . . 57.54 112.136 -176.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 95.5 mtm-85 -70.35 -36.45 74.19 Favored 'General case' 0 C--O 1.249 1.027 0 N-CA-C 112.146 0.424 . . . . 48.18 112.146 176.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.3 mt -68.27 -37.91 81.18 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 123.548 0.53 . . . . 45.01 109.6 177.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.68 -52.48 59.17 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 N-CA-C 111.851 0.315 . . . . 47.54 111.851 172.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 44.9 mtm-85 -51.38 -48.42 62.56 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.516 -0.311 . . . . 53.13 111.323 176.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.96 0.19 4.82 Favored 'General case' 0 C--O 1.248 0.984 0 N-CA-C 116.958 2.207 . . . . 46.74 116.958 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 77.87 21.19 71.97 Favored Glycine 0 N--CA 1.483 1.789 0 CA-C-N 118.052 0.387 . . . . 44.54 112.705 172.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 83.1 mt -97.74 -25.61 15.02 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.024 0.75 . . . . 42.25 113.024 -172.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 23.4 m -149.76 159.83 5.19 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.8 0 N-CA-C 108.633 -0.877 . . . . 44.5 108.633 -177.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.458 ' HZ3' ' H ' ' A' ' 62' ' ' GLU . 0.7 OUTLIER -130.28 141.43 50.61 Favored 'General case' 0 C--O 1.205 -1.249 0 CA-C-N 115.842 -0.617 . . . . 64.55 109.393 168.276 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.458 ' H ' ' HZ3' ' A' ' 61' ' ' LYS . 42.4 tt0 -87.78 135.22 33.48 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 123.732 0.813 . . . . 59.26 110.161 -179.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -134.38 154.39 51.38 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.858 -0.61 . . . . 69.97 109.525 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 55.2 m -71.38 129.13 38.06 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.461 -0.79 . . . . 52.77 110.066 171.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.9 tp -92.76 -63.54 1.21 Allowed 'General case' 0 C--O 1.258 1.538 0 CA-C-O 122.529 1.157 . . . . 54.47 108.579 174.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 89.5 p -143.46 -167.33 2.54 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 115.505 -0.77 . . . . 61.26 109.616 169.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -53.55 120.1 5.72 Favored 'General case' 0 C--O 1.25 1.097 0 C-N-CA 120.025 -0.67 . . . . 72.13 111.173 175.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . . . 76.89 3.7 3.37 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 113.218 0.822 . . . . 57.42 113.218 173.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.503 HG13 ' H21' ' A' ' 96' ' ' EDO . 46.7 t -131.16 123.09 52.85 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 CA-C-N 118.101 0.409 . . . . 53.71 110.191 -173.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 mmtp -111.32 158.29 19.2 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 125.464 1.728 . . . . 69.63 110.305 -178.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 12.9 t -133.23 167.54 20.17 Favored 'General case' 0 C--O 1.249 1.051 0 N-CA-C 107.453 -1.314 . . . . 42.02 107.453 175.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 95.8 mt -110.2 134.18 52.48 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 107.938 -1.134 . . . . 45.67 107.938 167.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . . . -106.84 130.94 54.45 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 124.554 1.159 . . . . 63.81 110.495 169.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.2 mt -61.11 142.67 56.52 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 112.531 0.567 . . . . 44.59 112.531 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.4 p -87.88 170.65 10.98 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 103.876 -2.639 . . . . 45.43 103.876 171.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -57.04 -46.76 82.18 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 118.232 0.469 . . . . 47.06 110.755 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.3 tttt -58.51 -40.66 83.48 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 114.696 1.369 . . . . 49.8 114.696 171.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.06 -37.82 92.1 Favored Glycine 0 C--O 1.214 -1.104 0 N-CA-C 110.967 -0.853 . . . . 44.48 110.967 176.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 ttm105 -71.39 -39.63 71.05 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.607 0.595 . . . . 62.21 112.607 176.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 -59.89 -45.32 92.88 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 120.458 -0.497 . . . . 67.7 111.148 174.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 17.9 tp -67.88 -44.31 77.32 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 113.218 0.822 . . . . 54.88 113.218 177.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -46.37 -47.23 18.76 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 112.807 0.669 . . . . 43.55 112.807 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -63.4 -42.11 98.78 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.014 -0.539 . . . . 61.92 111.716 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 83.5 m -63.42 -42.51 98.72 Favored 'General case' 0 C--O 1.209 -1.054 0 C-N-CA 120.897 -0.321 . . . . 55.82 110.722 175.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.3 mt -66.97 -15.34 63.65 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 115.628 1.714 . . . . 53.9 115.628 177.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -71.43 -35.2 70.86 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.986 -0.746 . . . . 62.47 108.986 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -75.65 -37.15 59.87 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.165 -0.68 . . . . 69.9 109.165 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 69.2 m -55.18 -44.45 75.26 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 108.516 -0.92 . . . . 52.39 108.516 174.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -58.48 -39.43 79.98 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.43 0.9 . . . . 72.38 113.43 179.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -57.91 -53.05 62.55 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.479 0.487 . . . . 70.47 110.685 177.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.2 t -50.12 -53.29 11.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 O-C-N 124.237 0.961 . . . . 64.52 110.521 176.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 10.3 mt . . . . . 0 C--N 1.325 -0.498 0 N-CA-C 108.546 -0.909 . . . . 62.85 108.546 178.459 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 32.6 t0 . . . . . 0 N--CA 1.497 1.882 0 CA-C-O 121.474 0.654 . . . . 69.17 110.449 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 26.6 tp10 -76.52 -26.14 54.93 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.529 -1.285 . . . . 85.76 107.529 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 11.1 m -52.12 -42.49 63.35 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 112.68 0.622 . . . . 53.61 112.68 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mp -66.89 -26.73 67.02 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 113.503 0.927 . . . . 53.22 113.503 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . . . -79.71 -8.8 59.46 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.416 0.524 . . . . 64.94 112.416 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.432 ' CD1' HD21 ' B' ' 13' ' ' LEU . 75.8 mt -75.55 152.04 37.81 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-O 121.797 0.808 . . . . 53.57 113.096 178.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -75.84 135.12 40.21 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 114.341 -1.299 . . . . 46.2 107.721 175.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -57.69 -43.42 85.09 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 113.626 0.973 . . . . 46.72 113.626 179.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.77 -43.64 96.34 Favored Glycine 0 N--CA 1.476 1.349 0 N-CA-C 115.257 0.863 . . . . 45.55 115.257 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' HIS . . . . . 0.472 ' HD2' ' H22' ' B' ' 97' ' ' CIT . 66.4 m170 -62.96 -36.09 82.32 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 112.328 0.492 . . . . 48.49 112.328 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.432 HD21 ' CD1' ' B' ' 8' ' ' LEU . 12.4 mt -69.8 -46.37 65.88 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-O 123.41 1.576 . . . . 55.33 109.278 -179.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -26.38 31.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 113.343 -1.753 . . . . 57.45 110.175 -172.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 81.5 mtt-85 -85.49 -49.47 8.05 Favored 'General case' 0 C--O 1.206 -1.204 0 N-CA-C 113.221 0.823 . . . . 51.74 113.221 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 9.1 mm -72.03 -52.17 26.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 114.24 1.2 . . . . 50.06 114.24 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 mt -71.46 -45.07 13.3 Favored Pre-proline 0 N--CA 1.477 0.91 0 CA-C-N 119.021 0.828 . . . . 49.87 112.435 -168.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -54.46 -38.42 89.74 Favored 'Trans proline' 0 CA--C 1.553 1.432 0 N-CA-C 116.599 1.73 . . . . 46.78 116.599 167.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 3.2 m -63.46 -45.26 91.66 Favored 'General case' 0 CA--C 1.504 -0.822 0 O-C-N 121.605 -0.684 . . . . 47.75 110.218 179.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.87 -45.92 90.29 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.11 0.782 . . . . 48.1 113.11 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 14.1 tp -57.2 -45.6 83.63 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 112.37 0.507 . . . . 48.52 112.37 175.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -65.01 -38.24 90.29 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-O 119.183 -0.437 . . . . 74.84 111.841 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -58.89 -44.77 91.23 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 118.47 0.577 . . . . 50.7 110.45 172.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -65.93 -40.5 91.46 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.091 0.957 . . . . 69.66 113.314 -175.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -62.36 -34.41 76.62 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 123.242 0.617 . . . . 57.24 111.716 175.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -82.31 -5.96 58.93 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.035 1.124 . . . . 63.75 114.035 173.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.87 18.57 78.69 Favored Glycine 0 C--O 1.242 0.619 0 N-CA-C 113.929 0.332 . . . . 49.04 113.929 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -97.26 140.57 31.55 Favored 'General case' 0 C--O 1.204 -1.292 0 CA-C-O 121.746 0.784 . . . . 49.09 112.686 -175.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.499 ' OE1' ' NZ ' ' B' ' 73' ' ' LYS . 19.1 mt-10 -115.89 96.16 46.07 Favored Pre-proline 0 C--O 1.256 1.396 0 C-N-CA 123.512 0.725 . . . . 69.72 109.402 -175.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -83.87 148.38 12.21 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 121.796 1.664 . . . . 49.44 113.46 -173.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 66.0 p -70.4 171.16 10.49 Favored 'General case' 0 C--O 1.247 0.923 0 O-C-N 124.295 0.997 . . . . 45.74 110.251 167.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.06 -40.69 96.83 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 119.428 -0.909 . . . . 48.25 112.522 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.78 74.63 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 113.087 0.773 . . . . 46.29 113.087 174.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -68.53 -32.77 72.96 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 121.324 -0.86 . . . . 47.51 109.648 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 47.0 mt -66.51 -46.22 86.96 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 O-C-N 120.855 -1.153 . . . . 49.06 110.277 178.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 76.9 t -56.54 -52.48 52.65 Favored 'Isoleucine or valine' 0 C--O 1.242 0.697 0 CA-C-O 121.732 0.777 . . . . 47.22 110.648 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.22 -51.84 48.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 O-C-N 120.911 -1.118 . . . . 66.39 110.236 -174.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.33 -37.92 79.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 120.169 -0.612 . . . . 46.07 110.759 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 93.4 p -77.35 -21.71 52.93 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 116.054 1.872 . . . . 49.45 116.054 -176.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.49 3.5 90.04 Favored Glycine 0 CA--C 1.53 0.985 0 N-CA-C 116.541 1.376 . . . . 48.92 116.541 -178.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' VAL . . . . . 0.646 ' HA ' ' H41' ' B' ' 97' ' ' CIT . 17.1 m -78.91 153.67 4.87 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.897 0 N-CA-C 108.607 -0.886 . . . . 52.1 108.607 165.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 40.5 p -83.33 158.07 22.34 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 122.171 0.986 . . . . 51.36 110.888 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -55.93 -42.52 76.23 Favored 'General case' 0 C--O 1.248 0.99 0 CA-C-N 115.289 -0.868 . . . . 56.28 110.97 175.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.515 ' HG3' ' HE2' ' B' ' 48' ' ' MSE . . . -66.42 -45.51 79.64 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 113.514 0.931 . . . . 53.02 113.514 -179.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' THR . . . . . 0.535 ' OG1' ' O4 ' ' B' ' 97' ' ' CIT . 52.9 m -57.19 -50.45 72.81 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-O 122.001 0.905 . . . . 46.88 113.11 170.627 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -60.18 -49.74 76.43 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 120.978 -1.076 . . . . 51.15 113.768 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -85.77 -11.37 53.71 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 115.615 1.709 . . . . 55.74 115.615 -173.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' MSE . . . . . 0.515 ' HE2' ' HG3' ' B' ' 44' ' ' LYS . 13.4 tpp -106.48 15.99 25.23 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 117.857 -1.068 . . . . 63.82 111.923 -179.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 160.71 -33.75 0.4 Allowed Glycine 0 C--O 1.213 -1.183 0 N-CA-C 119.048 2.379 . . . . 50.34 119.048 168.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 56.5 tp -67.23 -49.15 65.56 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 113.319 0.859 . . . . 46.52 113.319 -170.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -43.98 -54.6 5.27 Favored 'General case' 0 C--O 1.267 1.977 0 CA-C-O 122.45 1.119 . . . . 49.34 112.714 172.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -70.62 -24.73 62.78 Favored 'General case' 0 C--O 1.205 -1.279 0 CA-C-N 114.156 -1.384 . . . . 65.46 112.519 -175.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ARG . . . . . . . . . . . . . 86.8 mtm-85 -71.95 -37.09 70.02 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.741 0.781 . . . . 55.64 110.75 173.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 89.2 mt -70.02 -31.56 69.27 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 120.301 -0.56 . . . . 46.19 110.022 -178.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 93.2 mt -70.99 -52.06 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 108.73 -0.841 . . . . 49.28 108.73 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.2 mtm-85 -56.83 -28.84 62.15 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 116.648 2.092 . . . . 68.67 116.648 174.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.45 -2.48 49.74 Favored 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 112.663 0.616 . . . . 44.35 112.663 172.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 72.05 29.25 67.09 Favored Glycine 0 C--O 1.213 -1.176 0 CA-C-N 118.506 0.594 . . . . 44.61 112.691 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.21 -26.09 14.04 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 118.691 -1.203 . . . . 46.28 110.182 -175.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 5.6 m -142.48 162.33 18.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 O-C-N 124.17 0.919 . . . . 47.84 109.107 -178.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -126.96 132.5 50.81 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 104.914 -2.254 . . . . 69.96 104.914 173.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -83.54 132.36 34.93 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 118.52 0.6 . . . . 53.14 112.607 169.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -132.04 146.14 51.88 Favored 'General case' 0 C--O 1.204 -1.326 0 N-CA-C 112.706 0.632 . . . . 60.91 112.706 176.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' THR . . . . . . . . . . . . . 3.4 m -76.05 116.2 16.52 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 107.913 -1.143 . . . . 50.11 107.913 165.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 22.1 tp -83.31 -40.43 19.52 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 114.876 -1.056 . . . . 45.52 112.412 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 59.1 p -151.52 178.93 8.81 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 125.545 1.538 . . . . 44.26 111.244 173.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -56.72 -19.11 15.0 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.887 0.851 . . . . 61.58 111.137 171.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -98.68 -42.65 7.14 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 113.78 1.03 . . . . 57.56 113.78 -168.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 35.5 m -137.15 157.96 35.57 Favored 'Isoleucine or valine' 0 C--O 1.258 1.532 0 CA-C-O 121.657 0.742 . . . . 48.88 111.485 -169.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.506 ' HB2' ' H12' ' B' ' 100' ' ' PEG . 0.5 OUTLIER -114.3 165.16 12.99 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 113.77 -1.559 . . . . 58.12 108.469 170.34 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 6.8 t -142.0 171.73 13.66 Favored 'General case' 0 C--O 1.253 1.289 0 O-C-N 124.926 1.391 . . . . 49.92 108.119 178.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 89.1 mt -120.75 135.09 55.24 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 107.309 -1.367 . . . . 49.22 107.309 169.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' LYS . . . . . 0.499 ' NZ ' ' OE1' ' B' ' 29' ' ' GLU . 32.3 mmtm -107.96 138.62 43.89 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 124.764 1.29 . . . . 68.69 109.172 174.649 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' B' ' 79' ' ' ARG . 44.7 mt -71.3 137.35 48.44 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 110.073 -0.343 . . . . 48.62 110.073 172.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 53.2 p -83.42 178.44 8.03 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 103.1 -2.926 . . . . 45.09 103.1 171.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.56 -39.25 77.52 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 118.341 0.519 . . . . 65.4 111.253 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 21.6 ttpt -56.05 -52.56 63.82 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 119.965 -0.694 . . . . 53.92 111.414 169.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.18 -41.69 70.67 Favored Glycine 0 CA--C 1.502 -0.739 0 N-CA-C 111.865 -0.494 . . . . 47.05 111.865 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ARG . . . . . 0.446 ' HA ' HD13 ' B' ' 74' ' ' LEU . 42.5 ttm105 -64.57 -45.28 87.72 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 113.87 1.063 . . . . 62.49 113.87 179.669 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 21.2 mtp180 -64.77 -44.08 91.19 Favored 'General case' 0 C--O 1.216 -0.679 0 N-CA-C 110.414 -0.217 . . . . 73.24 110.414 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.11 -34.75 79.14 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.511 0.93 . . . . 48.64 113.511 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.11 88.72 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 119.42 -0.324 . . . . 48.47 111.102 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -59.52 -40.74 88.12 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 124.022 0.826 . . . . 63.62 112.884 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 61.7 m -69.2 -35.59 76.38 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 111.962 0.356 . . . . 59.72 111.962 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 22.0 mt -73.62 -27.43 61.27 Favored 'General case' 0 CA--C 1.557 1.212 0 N-CA-C 113.122 0.786 . . . . 52.36 113.122 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -57.53 -46.89 83.32 Favored 'General case' 0 CA--C 1.507 -0.699 0 C-N-CA 122.813 0.445 . . . . 69.37 111.421 168.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -63.66 -40.15 96.11 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.064 -0.517 . . . . 75.44 109.868 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' CYS . . . . . . . . . . . . . 23.2 m -58.39 -35.82 72.59 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.396 0.678 . . . . 56.59 111.282 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 4.8 mtp180 -70.23 -30.55 67.65 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.843 -1.071 . . . . 85.7 112.695 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -65.94 -31.37 72.26 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 123.227 0.329 . . . . 67.86 111.003 173.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.6 -39.36 75.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 113.179 0.807 . . . . 62.66 113.179 174.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 70.7 mt -85.29 -88.62 0.11 Allowed 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 109.481 -0.563 . . . . 68.87 109.481 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.684 0 N-CA-C 112.591 -0.204 . . . . 78.52 112.591 178.141 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' EDO . . . . . 0.503 ' H21' HG13 ' A' ' 69' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' CIT . . . . . 0.646 ' H41' ' HA ' ' B' ' 41' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' PEG . . . . . 0.506 ' H12' ' HB2' ' B' ' 70' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_