data_1bmz_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 1bmz _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 ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 107.974 -1.121 . . . . 50.79 107.974 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -81.98 -9.78 11.75 Favored 'Trans proline' 0 C--O 1.201 -1.359 0 C-N-CA 116.631 -1.78 . . . . 29.7 115.129 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.2 tp -141.17 117.57 10.79 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.309 -0.626 . . . . 27.87 109.309 -178.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 6.6 tmm? -129.6 144.61 51.35 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 124.262 0.976 . . . . 63.31 109.24 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.3 t -126.42 135.76 62.83 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.653 0 N-CA-C 107.738 -1.208 . . . . 17.92 107.738 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -130.79 130.49 43.76 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.082 -1.081 . . . . 54.51 108.082 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.8 t -126.41 131.33 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-O 121.424 0.631 . . . . 18.55 112.626 -177.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.5 mt -120.49 152.16 38.39 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 122.743 1.259 . . . . 18.33 112.285 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.5 t0 -104.44 116.7 32.57 Favored 'General case' 0 CA--C 1.559 1.323 0 N-CA-C 107.132 -1.433 . . . . 22.17 107.132 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.58 -10.28 58.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.799 1.24 . . . . 20.1 112.663 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.1 t -90.78 -35.72 7.5 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.446 0 N-CA-C 109.874 -0.417 . . . . 20.63 109.874 178.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . 0.485 ' NH2' ' O ' ' A' ' 142' ' ' HOH . 31.6 mtm180 -104.17 -12.38 16.73 Favored 'General case' 0 C--O 1.206 -1.207 0 N-CA-C 113.632 0.975 . . . . 62.23 113.632 -178.462 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.66 46.2 70.43 Favored Glycine 0 C--O 1.256 1.474 0 CA-C-O 122.567 1.093 . . . . 18.12 110.835 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 82.2 p -151.86 169.76 8.96 Favored Pre-proline 0 CA--C 1.506 -0.723 0 CA-C-O 121.82 0.819 . . . . 33.84 111.107 -179.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -70.72 146.32 53.96 Favored 'Trans proline' 0 CA--C 1.551 1.371 0 N-CA-C 107.036 -1.948 . . . . 26.68 107.036 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.09 107.94 18.66 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 103.395 -2.817 . . . . 18.37 103.395 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 35.1 mt -91.82 143.83 10.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 113.82 -1.536 . . . . 31.16 112.919 -176.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.5 m120 62.76 32.37 16.06 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 117.249 2.314 . . . . 54.76 117.249 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 93.5 t -86.47 128.22 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 N-CA-C 106.966 -1.494 . . . . 21.97 106.966 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.36 137.14 42.59 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 108.46 -0.941 . . . . 17.69 108.46 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 64.0 t -132.55 131.74 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 107.446 -1.316 . . . . 17.36 107.446 177.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HIS . . . . . 0.494 ' CD2' ' O ' ' A' ' 147' ' ' HOH . 70.3 m80 -124.79 131.11 53.48 Favored 'General case' 0 C--O 1.209 -1.056 0 N-CA-C 105.993 -1.854 . . . . 27.62 105.993 178.37 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 47.8 t -111.41 136.18 48.32 Favored 'Isoleucine or valine' 0 C--O 1.261 1.661 0 N-CA-C 108.322 -0.992 . . . . 19.08 108.322 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -126.36 155.37 42.18 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.449 -0.945 . . . . 21.43 108.449 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ARG . . . . . 0.421 ' NH2' ' O ' ' A' ' 66' ' ' GLU . 76.3 ttt-85 -125.74 135.28 51.89 Favored 'General case' 0 C--O 1.25 1.108 0 N-CA-C 107.527 -1.286 . . . . 46.28 107.527 178.444 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 tttp -69.21 121.96 17.86 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.701 -0.852 . . . . 52.26 108.701 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.41 162.96 25.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.055 -1.429 . . . . 39.74 109.826 -178.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.31 -34.78 58.8 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 114.296 -1.32 . . . . 55.94 111.072 179.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -91.73 29.13 1.6 Allowed 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.216 0.531 . . . . 71.93 111.66 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.74 19.97 4.77 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.703 2.483 . . . . 74.84 117.703 -179.824 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.5 p -101.21 157.38 16.82 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.464 -0.939 . . . . 52.84 108.464 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -87.87 110.78 20.78 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.343 -0.543 . . . . 38.36 111.457 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -87.07 139.29 32.47 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 108.987 -0.746 . . . . 73.9 108.987 176.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -61.44 134.73 53.22 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 123.998 3.132 . . . . 31.96 105.199 178.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -121.35 -44.16 2.38 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 118.196 -1.401 . . . . 22.36 111.076 -177.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -163.82 159.96 21.79 Favored 'General case' 0 C--O 1.254 1.303 0 N-CA-C 106.751 -1.574 . . . . 19.6 106.751 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 99.7 p -159.32 161.51 35.84 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.532 0.682 . . . . 20.37 109.949 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.47 -172.13 43.27 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.776 -1.33 . . . . 21.96 109.776 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -127.86 142.97 51.13 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.386 -1.339 . . . . 44.56 107.386 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 67.7 p -66.79 151.48 47.4 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 122.066 0.936 . . . . 20.77 109.422 177.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 97.2 p -86.45 -172.49 4.06 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.819 -0.628 . . . . 32.73 109.494 -179.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -64.29 -17.84 64.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.459 0.704 . . . . 74.24 110.2 179.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 80.7 p -95.45 8.33 43.58 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 119.985 -0.686 . . . . 33.46 111.299 178.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.69 12.35 80.63 Favored Glycine 0 C--O 1.222 -0.631 0 O-C-N 123.621 0.576 . . . . 18.58 114.126 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -109.23 147.27 32.85 Favored 'General case' 0 CA--C 1.485 -1.521 0 N-CA-C 116.262 1.949 . . . . 49.02 116.262 -178.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.8 tp -126.47 112.4 15.54 Favored 'General case' 0 C--O 1.2 -1.524 0 N-CA-C 107.883 -1.155 . . . . 19.4 107.883 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -114.13 168.3 9.94 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.834 -0.621 . . . . 40.35 111.458 178.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 65.74 31.63 80.47 Favored Glycine 0 C--O 1.213 -1.215 0 N-CA-C 117.496 1.758 . . . . 29.04 117.496 175.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.8 mt -69.06 -40.47 78.5 Favored 'General case' 0 N--CA 1.442 -0.852 0 O-C-N 124.061 0.506 . . . . 28.83 110.299 178.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . 0.278 0.0 OUTLIER -145.88 -174.04 4.31 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.111 0.564 . . . . 32.24 111.847 -178.213 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.3 p -126.64 162.19 26.32 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 103.305 -2.85 . . . . 28.42 103.305 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.93 -27.32 67.38 Favored 'General case' 0 CA--C 1.497 -1.068 0 C-N-CA 117.244 -1.782 . . . . 67.22 109.938 -179.085 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.44 -45.35 93.99 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 124.076 0.86 . . . . 72.32 111.048 -179.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -84.24 -21.18 31.25 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 115.669 1.729 . . . . 65.36 115.669 -177.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -87.78 78.43 8.4 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.899 -0.591 . . . . 25.24 109.699 -177.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -89.72 170.0 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 124.091 0.957 . . . . 20.33 111.415 -178.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . 0.421 ' O ' ' NH2' ' A' ' 34' ' ' ARG . 97.3 mt-10 -56.37 144.27 31.32 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 107.992 -1.114 . . . . 56.46 107.992 177.982 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 167.86 -179.74 40.98 Favored Glycine 0 CA--C 1.499 -0.948 0 N-CA-C 106.846 -2.501 . . . . 21.6 106.846 177.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 97.1 mt -106.69 125.93 62.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 N-CA-C 101.275 -3.602 . . . . 22.74 101.275 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -115.87 149.66 38.29 Favored 'General case' 0 CA--C 1.506 -0.714 0 O-C-N 124.954 1.409 . . . . 19.65 111.685 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.2 ttpp -126.67 120.5 29.62 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 107.816 -1.179 . . . . 39.46 107.816 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 62.5 t -103.0 120.71 53.22 Favored 'Isoleucine or valine' 0 C--O 1.242 0.684 0 N-CA-C 106.927 -1.508 . . . . 17.78 106.927 176.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -112.97 125.14 54.08 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.394 -0.965 . . . . 46.48 108.394 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 97.9 mt -109.81 118.98 58.09 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.922 0 N-CA-C 106.876 -1.527 . . . . 19.39 106.876 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASP . . . . . 0.494 ' CB ' ' O ' ' A' ' 128' ' ' HOH . 29.6 t0 -75.72 74.26 2.69 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 112.897 0.703 . . . . 58.7 112.897 -178.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 72.9 p -67.3 -35.79 80.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.339 -1.301 . . . . 24.91 112.662 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.4 tttp -58.53 -46.9 85.82 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.514 0.931 . . . . 51.74 113.514 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 66.0 m -60.53 -44.41 96.09 Favored 'General case' 0 CA--C 1.491 -1.32 0 C-N-CA 120.804 -0.359 . . . . 41.63 111.303 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -52.94 -57.52 10.01 Favored 'General case' 0 C--O 1.248 0.99 0 O-C-N 124.62 1.2 . . . . 30.28 112.281 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 73.2 m95 -64.93 -36.08 83.23 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 113.105 0.78 . . . . 29.68 113.105 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -56.64 -44.83 81.67 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 109.882 -0.414 . . . . 72.81 109.882 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.0 -28.76 69.79 Favored 'General case' 0 CA--C 1.505 -0.786 0 O-C-N 123.843 0.714 . . . . 47.23 109.987 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 14.5 mt -86.81 6.89 29.41 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.42 0.628 . . . . 44.41 110.482 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 69.3 23.02 76.47 Favored Glycine 0 CA--C 1.497 -1.04 0 CA-C-N 116.243 -0.435 . . . . 44.98 112.066 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 97.7 mt -108.78 146.2 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 N-CA-C 108.378 -0.971 . . . . 42.56 108.378 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 t -101.37 101.26 16.27 Favored Pre-proline 0 N--CA 1.472 0.669 0 N-CA-C 109.261 -0.644 . . . . 54.34 109.261 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -73.74 159.78 44.88 Favored 'Trans proline' 0 C--O 1.21 -0.915 0 C-N-CA 124.728 3.619 . . . . 35.41 114.687 -179.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -87.18 -45.45 10.65 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 120.634 0.254 . . . . 27.77 110.365 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 49.7 m80 -80.94 146.75 30.61 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 116.913 2.19 . . . . 27.81 116.913 -177.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -71.02 -42.18 69.9 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 106.568 -1.641 . . . . 36.12 106.568 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' CD2' ' CD ' ' A' ' 92' ' ' GLU . 3.7 p-80 -171.92 172.12 4.88 Favored 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 107.961 -1.125 . . . . 31.44 107.961 177.962 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -107.57 130.91 54.83 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.979 -1.859 . . . . 23.5 105.979 177.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . 0.407 ' CD ' ' CD2' ' A' ' 90' ' ' HIS . 0.3 OUTLIER -115.84 143.27 45.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.685 0.755 . . . . 66.55 110.343 179.02 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.9 t -130.42 113.85 26.8 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 N-CA-C 103.332 -2.84 . . . . 29.18 103.332 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 26.9 t -111.42 125.58 68.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 O-C-N 123.737 0.648 . . . . 18.03 109.908 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -153.49 156.97 39.14 Favored 'General case' 0 C--O 1.205 -1.277 0 N-CA-C 112.939 0.718 . . . . 19.34 112.939 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 85.1 m -88.12 131.91 34.51 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 104.425 -2.435 . . . . 24.41 104.425 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -118.1 151.02 38.37 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.054 -0.404 . . . . 27.11 111.282 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 10.8 m120 50.42 16.33 0.27 Allowed 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 119.405 3.113 . . . . 42.12 119.405 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -56.59 -30.78 63.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.838 0.29 . . . . 70.62 110.829 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.5 m -112.3 35.04 3.95 Favored 'General case' 0 C--O 1.214 -0.796 0 N-CA-C 109.94 -0.393 . . . . 75.62 109.94 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 100.3 162.82 28.43 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 108.975 -1.65 . . . . 61.13 108.975 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -69.16 136.28 34.16 Favored 'Trans proline' 0 CA--C 1.511 -0.629 0 C-N-CA 123.488 2.792 . . . . 60.11 114.651 -179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 52.9 mmt-85 -131.0 171.16 13.54 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 104.109 -2.552 . . . . 59.46 104.109 179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -104.92 129.2 53.34 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 100.904 -3.739 . . . . 85.44 100.904 176.422 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -115.99 125.15 52.11 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 123.781 0.833 . . . . 26.65 111.091 -178.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 77.2 m -116.15 116.76 28.42 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 104.503 -2.406 . . . . 22.59 104.503 174.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 40.0 mm -102.3 120.06 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 103.587 -2.746 . . . . 25.73 103.587 -179.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -112.07 141.22 46.0 Favored 'General case' 0 C--O 1.253 1.239 0 N-CA-C 107.997 -1.112 . . . . 25.01 107.997 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -129.85 136.25 49.34 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 109.145 -0.687 . . . . 19.23 109.145 177.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 49.2 tp -115.78 122.55 45.79 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 103.903 -2.629 . . . . 21.53 103.903 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 15.4 mt -111.69 139.26 47.29 Favored 'General case' 0 N--CA 1.475 0.803 1 N-CA-C 122.474 4.249 . . . . 19.68 122.474 -174.85 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 70.2 m -138.3 159.99 65.74 Favored Pre-proline 0 N--CA 1.477 0.879 0 N-CA-C 104.071 -2.566 . . . . 22.2 104.071 175.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -53.15 -41.73 70.02 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 122.408 2.072 . . . . 19.3 115.42 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -114.31 15.56 18.04 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 116.47 2.026 . . . . 40.37 116.47 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 41.1 t -159.39 151.43 20.8 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 112.46 0.541 . . . . 23.03 112.46 -179.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -152.79 152.97 32.24 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 107.811 -1.181 . . . . 29.4 107.811 173.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 95.6 p -130.54 153.52 48.77 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 104.169 -2.53 . . . . 31.59 104.169 176.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.9 t -142.53 134.84 27.65 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 106.238 -1.764 . . . . 22.53 106.238 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.78 152.69 49.84 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 118.432 -1.307 . . . . 32.54 109.338 176.755 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -114.79 128.41 56.28 Favored 'General case' 0 CA--C 1.505 -0.775 0 O-C-N 124.857 1.348 . . . . 18.99 110.845 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 61.4 t -110.69 113.42 44.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 105.106 -2.183 . . . . 22.81 105.106 175.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 70.9 t -108.82 124.26 65.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 O-C-N 121.477 -0.764 . . . . 27.31 110.125 -176.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 63.7 p . . . . . 0 C--N 1.322 -0.608 0 N-CA-C 107.557 -1.275 . . . . 45.78 107.557 179.433 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.502 2.157 0 N-CA-C 105.483 -2.043 . . . . 53.15 105.483 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -85.31 -8.27 8.72 Favored 'Trans proline' 0 C--N 1.322 -0.846 0 C-N-CA 116.401 -1.933 . . . . 31.11 113.152 179.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 50.1 tp -138.94 116.6 11.41 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.386 0.994 . . . . 31.87 109.238 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -128.73 143.67 50.98 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.396 0.617 . . . . 65.62 110.305 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 92.4 t -122.91 138.06 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 N-CA-C 107.941 -1.133 . . . . 20.95 107.941 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -130.36 128.95 42.49 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 108.712 -0.847 . . . . 53.88 108.712 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 15.5 t -125.86 126.92 70.75 Favored 'Isoleucine or valine' 0 C--O 1.254 1.31 0 N-CA-C 112.125 0.417 . . . . 19.14 112.125 -178.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 94.5 mt -115.42 151.92 33.83 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-O 121.329 0.585 . . . . 20.92 112.359 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -107.01 114.12 28.01 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 105.709 -1.96 . . . . 18.25 105.709 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.07 -11.74 60.0 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 124.708 1.203 . . . . 19.22 113.89 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 87.0 t -88.02 -39.51 12.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-O 120.832 0.349 . . . . 20.74 110.805 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ARG . . . . . 0.559 ' NH2' ' O ' ' B' ' 135' ' ' HOH . 31.9 mtm180 -101.83 -11.12 19.3 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 113.057 0.762 . . . . 62.09 113.057 -178.661 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.61 47.44 61.99 Favored Glycine 0 C--N 1.344 0.977 0 CA-C-O 122.516 1.065 . . . . 19.82 111.714 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 88.9 p -152.8 170.66 7.78 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 121.83 -0.806 . . . . 33.58 111.721 -178.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.45 146.21 44.15 Favored 'Trans proline' 0 C--O 1.243 0.742 0 N-CA-C 107.405 -1.806 . . . . 25.08 107.405 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.18 104.88 15.46 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 106.446 -1.687 . . . . 22.1 106.446 177.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 34.4 mt -90.47 142.75 12.48 Favored 'Isoleucine or valine' 0 C--O 1.251 1.15 0 CA-C-N 115.002 -0.999 . . . . 33.97 113.243 -176.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.23 34.8 13.09 Favored 'General case' 0 CA--C 1.476 -1.897 0 N-CA-C 115.395 1.628 . . . . 52.69 115.395 177.086 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 96.7 t -87.95 131.69 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 105.88 -1.896 . . . . 26.66 105.88 179.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.37 134.23 36.59 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.607 0.718 . . . . 20.56 109.686 178.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 98.8 t -129.04 134.7 63.65 Favored 'Isoleucine or valine' 0 C--O 1.249 1.04 0 N-CA-C 107.271 -1.381 . . . . 22.53 107.271 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -125.12 128.48 48.48 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 108.752 -0.833 . . . . 29.66 108.752 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 65.3 t -107.88 135.65 45.84 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 108.709 -0.848 . . . . 24.73 108.709 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -123.98 152.14 42.88 Favored 'General case' 0 C--O 1.25 1.093 0 C-N-CA 123.35 0.66 . . . . 26.19 109.366 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ARG . . . . . . . . . . . . . 73.0 ttt-85 -119.28 137.67 53.52 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 107.351 -1.352 . . . . 53.69 107.351 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -72.94 124.42 25.41 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 107.499 -1.297 . . . . 49.08 107.499 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -81.48 157.03 25.03 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 125.736 1.614 . . . . 42.45 110.822 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -49.03 -37.97 22.29 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 114.872 -1.058 . . . . 57.59 109.733 -178.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -89.06 28.59 1.17 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.804 -1.089 . . . . 73.47 111.571 -178.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.97 19.24 4.45 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 118.235 2.679 . . . . 77.42 118.235 179.904 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.9 p -100.93 159.2 15.41 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 106.809 -1.552 . . . . 55.64 106.809 178.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -88.85 108.51 19.56 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 112.681 0.623 . . . . 38.79 112.681 178.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -84.53 135.62 40.72 Favored Pre-proline 0 C--N 1.315 -0.926 0 N-CA-C 109.528 -0.545 . . . . 74.53 109.528 178.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -60.34 141.12 94.97 Favored 'Trans proline' 0 C--N 1.333 -0.245 0 N-CA-C 104.609 -2.881 . . . . 34.57 104.609 178.44 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -127.86 -43.58 1.52 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 119.02 -1.072 . . . . 22.96 113.318 -175.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -162.99 157.97 21.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.663 -1.236 . . . . 21.96 107.663 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 81.7 p -158.27 161.6 37.72 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 120.773 0.32 . . . . 25.71 111.455 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 179.42 -169.31 40.36 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 118.994 -1.574 . . . . 24.3 110.174 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -131.0 139.16 49.95 Favored 'General case' 0 C--O 1.252 1.19 0 N-CA-C 109.165 -0.68 . . . . 45.57 109.165 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 75.9 p -64.87 145.38 56.37 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-O 122.147 0.975 . . . . 26.09 108.673 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 96.2 p -80.19 -171.98 3.24 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.076 -1.42 . . . . 31.7 110.061 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -65.97 -15.94 63.44 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.648 0.592 . . . . 74.89 110.445 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 56.4 p -100.58 11.25 39.9 Favored 'General case' 0 C--O 1.217 -0.628 0 C-N-CA 119.86 -0.736 . . . . 37.73 109.726 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.19 11.7 79.41 Favored Glycine 0 C--O 1.224 -0.483 0 CA-C-O 121.732 0.629 . . . . 20.43 114.517 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -108.02 154.64 21.37 Favored 'General case' 0 C--O 1.253 1.268 0 N-CA-C 114.725 1.38 . . . . 50.77 114.725 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 11.0 tp -132.7 110.73 10.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.474 -1.306 . . . . 23.08 107.474 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' HIS . . . . . . . . . . . . . 78.9 m80 -113.34 168.07 10.04 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 114.96 -1.018 . . . . 41.63 111.979 -178.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.41 34.37 89.76 Favored Glycine 0 C--O 1.213 -1.191 0 CA-C-N 114.869 -1.06 . . . . 31.4 115.284 176.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 28.0 mt -71.07 -36.17 72.18 Favored 'General case' 0 CA--C 1.552 1.056 0 CA-C-N 117.272 0.536 . . . . 30.84 111.764 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' THR . . . . . . . . . . . . 0.306 0.0 OUTLIER -147.83 -170.9 3.69 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.597 0.759 . . . . 35.73 110.708 -179.451 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 51.2 p -128.73 159.82 34.44 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 104.314 -2.476 . . . . 29.98 104.314 177.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.15 -26.22 68.08 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 117.459 -1.696 . . . . 67.33 109.918 -179.22 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.66 -47.13 86.81 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.605 0.717 . . . . 69.16 111.308 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -81.81 -24.38 35.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.546 -1.206 . . . . 67.87 114.249 -176.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -84.04 77.19 9.98 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.884 -0.598 . . . . 31.95 111.917 -177.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.6 m -89.22 169.76 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-O 121.886 0.851 . . . . 25.89 112.853 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -59.35 144.28 47.08 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 106.305 -1.739 . . . . 55.12 106.305 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 170.69 -178.27 43.34 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 106.02 -2.832 . . . . 26.82 106.02 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 67.9 mt -106.51 130.75 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.052 0 N-CA-C 100.439 -3.912 . . . . 26.99 100.439 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -122.8 151.8 41.29 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.248 -0.887 . . . . 24.03 110.434 -178.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.0 ttpp -129.84 120.67 25.34 Favored 'General case' 0 C--O 1.247 0.941 0 CA-C-N 114.412 -1.267 . . . . 39.03 108.215 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 58.2 t -102.75 124.16 56.58 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.814 0 N-CA-C 104.971 -2.233 . . . . 21.96 104.971 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -116.45 119.72 36.51 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 109.115 -0.698 . . . . 51.36 109.115 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 76.3 mt -104.09 117.88 50.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-N 115.378 -0.828 . . . . 24.55 109.206 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -77.41 77.89 3.94 Favored 'General case' 0 CA--C 1.494 -1.181 0 C-N-CA 118.679 -1.208 . . . . 58.51 112.353 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 47.4 p -70.18 -35.58 74.05 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 124.892 1.37 . . . . 28.11 112.576 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 15.4 tttp -57.82 -45.89 85.49 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.479 0.918 . . . . 53.22 113.479 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 58.1 m -59.87 -44.88 93.93 Favored 'General case' 0 CA--C 1.499 -1.007 0 O-C-N 123.388 0.43 . . . . 39.4 110.434 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -52.03 -59.12 4.72 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 125.13 1.519 . . . . 31.38 112.797 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 80.7 m95 -61.98 -39.29 91.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.592 0.96 . . . . 30.82 113.592 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -57.35 -43.09 83.16 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.001 -1.111 . . . . 72.57 108.001 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.8 -33.13 72.52 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.507 0.67 . . . . 45.06 109.903 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.6 mt -85.64 12.32 9.01 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 119.931 -0.708 . . . . 42.91 110.591 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 65.43 23.95 70.53 Favored Glycine 0 N--CA 1.441 -0.991 0 C-N-CA 120.21 -0.995 . . . . 46.43 112.074 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 72.9 mt -110.7 148.75 13.9 Favored 'Isoleucine or valine' 0 C--O 1.248 0.988 0 CA-C-N 118.69 1.245 . . . . 47.58 110.704 179.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 7.0 t -96.29 104.67 18.19 Favored Pre-proline 0 C--O 1.233 0.225 0 C-N-CA 120.715 -0.394 . . . . 55.75 110.611 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -80.6 158.81 22.08 Favored 'Trans proline' 0 C--O 1.245 0.871 0 C-N-CA 120.995 1.13 . . . . 35.76 114.048 -179.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -84.83 -45.93 11.84 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 121.476 0.655 . . . . 27.72 111.905 176.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -81.45 146.0 30.48 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 116.939 2.2 . . . . 26.13 116.939 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -70.89 -37.39 73.01 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 106.071 -1.826 . . . . 35.13 106.071 175.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -176.8 175.32 1.66 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 107.181 -1.415 . . . . 33.76 107.181 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.37 135.86 49.73 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 105.891 -1.892 . . . . 25.52 105.891 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -123.18 139.95 53.52 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.736 -1.209 . . . . 65.13 107.736 179.787 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 58.1 t -126.23 116.63 46.21 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 N-CA-C 102.865 -3.013 . . . . 26.72 102.865 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 45.7 t -113.04 128.74 69.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.824 -0.806 . . . . 18.06 108.824 179.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -155.48 158.25 38.23 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 120.334 -0.546 . . . . 23.4 111.286 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 33.0 m -93.55 131.46 38.79 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 104.002 -2.592 . . . . 24.8 104.002 177.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' B' ' 99' ' ' ASP . . . -110.7 162.0 15.2 Favored 'General case' 0 N--CA 1.428 -1.565 0 C-N-CA 119.462 -0.895 . . . . 33.24 110.028 -178.258 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 9.5 m120 38.58 13.41 0.0 OUTLIER 'General case' 0 C--O 1.256 1.442 0 N-CA-C 119.14 3.015 . . . . 55.93 119.14 175.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASP . . . . . 0.438 ' OD1' ' N ' ' B' ' 99' ' ' ASP . 17.4 p-10 -50.84 -29.4 11.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 120.109 -0.636 . . . . 71.04 109.484 -179.199 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' SER . . . . . 0.427 ' O ' ' NH2' ' B' ' 103' ' ' ARG . 17.9 m -113.37 38.1 2.99 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.904 0.859 . . . . 77.54 110.246 178.463 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 94.93 163.52 35.03 Favored Glycine 0 C--O 1.248 0.991 0 N-CA-C 107.245 -2.342 . . . . 65.31 107.245 -179.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -72.48 140.15 32.69 Favored 'Trans proline' 0 CA--C 1.498 -1.292 0 C-N-CA 124.465 3.444 . . . . 66.19 113.957 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ARG . . . . . 0.427 ' NH2' ' O ' ' B' ' 100' ' ' SER . 46.2 mmt-85 -129.46 -178.18 4.57 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 103.319 -2.845 . . . . 65.14 103.319 178.712 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.89 125.81 52.4 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 103.016 -2.957 . . . . 85.83 103.016 173.044 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -113.47 128.08 56.32 Favored 'General case' 0 CA--C 1.483 -1.616 0 CA-C-N 116.439 -0.346 . . . . 33.21 110.323 -177.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 99.6 m -116.35 124.67 50.67 Favored 'General case' 0 C--O 1.252 1.23 0 N-CA-C 101.756 -3.424 . . . . 22.92 101.756 173.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 44.4 mm -107.29 122.04 60.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 103.731 -2.692 . . . . 26.61 103.731 176.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -113.73 144.41 43.0 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.234 -1.395 . . . . 22.47 107.234 178.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -132.61 137.95 47.22 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 106.483 -1.673 . . . . 21.06 106.483 178.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 59.0 tp -117.86 122.81 44.32 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 103.261 -2.866 . . . . 24.35 103.261 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 13.9 mt -111.6 142.83 43.41 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 119.027 2.973 . . . . 19.25 119.027 -174.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 35.9 m -138.99 160.79 61.29 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 104.551 -2.388 . . . . 23.39 104.551 174.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -53.74 -43.72 55.4 Favored 'Trans proline' 0 C--O 1.243 0.747 0 N-CA-C 116.18 1.569 . . . . 19.5 116.18 -179.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -111.05 17.05 20.8 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 115.484 1.661 . . . . 36.62 115.484 -178.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 48.1 t -161.94 153.96 19.21 Favored 'General case' 0 CA--C 1.492 -1.258 0 C-N-CA 118.745 -1.182 . . . . 22.24 111.94 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 29.6 p90 -153.7 151.87 30.14 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-O 121.98 0.895 . . . . 31.24 111.655 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 84.0 p -129.69 150.74 50.87 Favored 'General case' 0 N--CA 1.424 -1.759 0 N-CA-C 105.001 -2.222 . . . . 33.69 105.001 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 5.8 t -140.04 138.39 35.36 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 106.466 -1.679 . . . . 20.08 106.466 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' THR . . . . . 0.502 ' CG2' ' O ' ' B' ' 149' ' ' HOH . 0.1 OUTLIER -135.78 148.86 48.93 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 121.169 0.509 . . . . 33.01 109.976 178.2 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -109.36 125.18 52.08 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.012 -0.995 . . . . 24.63 111.008 -178.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 48.5 t -108.13 109.99 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 105.246 -2.131 . . . . 26.31 105.246 175.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 85.2 t -104.38 127.29 58.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.169 -0.612 . . . . 32.99 111.266 -179.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 58.2 p . . . . . 0 C--O 1.25 1.092 0 N-CA-C 109.287 -0.635 . . . . 51.81 109.287 178.991 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . 0.494 ' O ' ' CB ' ' A' ' 74' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . 0.485 ' O ' ' NH2' ' A' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . 0.494 ' O ' ' CD2' ' A' ' 31' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' HOH . . . . . 0.559 ' O ' ' NH2' ' B' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' HOH . . . . . 0.502 ' O ' ' CG2' ' B' ' 119' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 107.974 -1.121 . . . . 50.79 107.974 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . 0.544 ' HA ' ' HD3' ' A' ' 104' ' ' ARG . 68.3 Cg_endo -81.98 -9.78 11.75 Favored 'Trans proline' 0 C--O 1.201 -1.359 0 C-N-CA 116.631 -1.78 . . . . 29.7 115.129 -179.744 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.2 tp -141.17 117.57 10.79 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.309 -0.626 . . . . 27.87 109.309 -178.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 6.6 tmm? -129.6 144.61 51.35 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 124.262 0.976 . . . . 63.31 109.24 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.3 t -126.42 135.76 62.83 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.653 0 N-CA-C 107.738 -1.208 . . . . 17.92 107.738 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -130.79 130.49 43.76 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.082 -1.081 . . . . 54.51 108.082 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.8 t -126.41 131.33 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-O 121.424 0.631 . . . . 18.55 112.626 -177.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.5 mt -120.49 152.16 38.39 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 122.743 1.259 . . . . 18.33 112.285 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.5 t0 -104.44 116.7 32.57 Favored 'General case' 0 CA--C 1.559 1.323 0 N-CA-C 107.132 -1.433 . . . . 22.17 107.132 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.58 -10.28 58.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.799 1.24 . . . . 20.1 112.663 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.1 t -90.78 -35.72 7.5 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.446 0 N-CA-C 109.874 -0.417 . . . . 20.63 109.874 178.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . 0.485 ' NH2' ' O ' ' A' ' 142' ' ' HOH . 31.6 mtm180 -104.17 -12.38 16.73 Favored 'General case' 0 C--O 1.206 -1.207 0 N-CA-C 113.632 0.975 . . . . 62.23 113.632 -178.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.66 46.2 70.43 Favored Glycine 0 C--O 1.256 1.474 0 CA-C-O 122.567 1.093 . . . . 18.12 110.835 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . 0.492 ' HB2' ' HD2' ' A' ' 24' ' ' PRO . 82.2 p -151.86 169.76 8.96 Favored Pre-proline 0 CA--C 1.506 -0.723 0 CA-C-O 121.82 0.819 . . . . 33.84 111.107 -179.657 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PRO . . . . . 0.492 ' HD2' ' HB2' ' A' ' 23' ' ' SER . 42.9 Cg_endo -70.72 146.32 53.96 Favored 'Trans proline' 0 CA--C 1.551 1.371 0 N-CA-C 107.036 -1.948 . . . . 26.68 107.036 178.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.09 107.94 18.66 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 103.395 -2.817 . . . . 18.37 103.395 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 35.1 mt -91.82 143.83 10.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 113.82 -1.536 . . . . 31.16 112.919 -176.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 62.76 32.37 16.06 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 117.249 2.314 . . . . 54.76 117.249 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 93.5 t -86.47 128.22 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 N-CA-C 106.966 -1.494 . . . . 21.97 106.966 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.36 137.14 42.59 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 108.46 -0.941 . . . . 17.69 108.46 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 64.0 t -132.55 131.74 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 107.446 -1.316 . . . . 17.36 107.446 177.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.2 m-70 -124.79 131.11 53.48 Favored 'General case' 0 C--O 1.209 -1.056 0 N-CA-C 105.993 -1.854 . . . . 27.62 105.993 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 47.8 t -111.41 136.18 48.32 Favored 'Isoleucine or valine' 0 C--O 1.261 1.661 0 N-CA-C 108.322 -0.992 . . . . 19.08 108.322 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -126.36 155.37 42.18 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.449 -0.945 . . . . 21.43 108.449 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 76.3 ttt-85 -125.74 135.28 51.89 Favored 'General case' 0 C--O 1.25 1.108 0 N-CA-C 107.527 -1.286 . . . . 46.28 107.527 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 tttp -69.21 121.96 17.86 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.701 -0.852 . . . . 52.26 108.701 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . 0.672 ' HB2' ' HG2' ' A' ' 42' ' ' GLU . . . -79.41 162.96 25.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.055 -1.429 . . . . 39.74 109.826 -178.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.31 -34.78 58.8 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 114.296 -1.32 . . . . 55.94 111.072 179.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -91.73 29.13 1.6 Allowed 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.216 0.531 . . . . 71.93 111.66 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.74 19.97 4.77 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.703 2.483 . . . . 74.84 117.703 -179.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.5 p -101.21 157.38 16.82 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.464 -0.939 . . . . 52.84 108.464 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -87.87 110.78 20.78 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.343 -0.543 . . . . 38.36 111.457 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . 0.672 ' HG2' ' HB2' ' A' ' 36' ' ' ALA . 4.8 mm-40 -87.07 139.29 32.47 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 108.987 -0.746 . . . . 73.9 108.987 176.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -61.44 134.73 53.22 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 123.998 3.132 . . . . 31.96 105.199 178.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . 0.469 ' CZ ' HG21 ' A' ' 59' ' ' THR . 89.0 t80 -121.35 -44.16 2.38 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 118.196 -1.401 . . . . 22.36 111.076 -177.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -163.82 159.96 21.79 Favored 'General case' 0 C--O 1.254 1.303 0 N-CA-C 106.751 -1.574 . . . . 19.6 106.751 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 99.7 p -159.32 161.51 35.84 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.532 0.682 . . . . 20.37 109.949 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.47 -172.13 43.27 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.776 -1.33 . . . . 21.96 109.776 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -127.86 142.97 51.13 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.386 -1.339 . . . . 44.56 107.386 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 67.7 p -66.79 151.48 47.4 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 122.066 0.936 . . . . 20.77 109.422 177.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 97.2 p -86.45 -172.49 4.06 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.819 -0.628 . . . . 32.73 109.494 -179.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -64.29 -17.84 64.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.459 0.704 . . . . 74.24 110.2 179.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 80.7 p -95.45 8.33 43.58 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 119.985 -0.686 . . . . 33.46 111.299 178.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.69 12.35 80.63 Favored Glycine 0 C--O 1.222 -0.631 0 O-C-N 123.621 0.576 . . . . 18.58 114.126 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -109.23 147.27 32.85 Favored 'General case' 0 CA--C 1.485 -1.521 0 N-CA-C 116.262 1.949 . . . . 49.02 116.262 -178.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.8 tp -126.47 112.4 15.54 Favored 'General case' 0 C--O 1.2 -1.524 0 N-CA-C 107.883 -1.155 . . . . 19.4 107.883 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -114.13 168.3 9.94 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.834 -0.621 . . . . 40.35 111.458 178.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 65.74 31.63 80.47 Favored Glycine 0 C--O 1.213 -1.215 0 N-CA-C 117.496 1.758 . . . . 29.04 117.496 175.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.8 mt -69.06 -40.47 78.5 Favored 'General case' 0 N--CA 1.442 -0.852 0 O-C-N 124.061 0.506 . . . . 28.83 110.299 178.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . 0.469 HG21 ' CZ ' ' A' ' 44' ' ' PHE 0.278 0.0 OUTLIER -145.88 -174.04 4.31 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.111 0.564 . . . . 32.24 111.847 -178.213 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.3 p -126.64 162.19 26.32 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 103.305 -2.85 . . . . 28.42 103.305 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . 0.402 ' HG2' ' NH1' ' A' ' 104' ' ' ARG . 1.0 OUTLIER -66.93 -27.32 67.38 Favored 'General case' 0 CA--C 1.497 -1.068 0 C-N-CA 117.244 -1.782 . . . . 67.22 109.938 -179.085 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.44 -45.35 93.99 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 124.076 0.86 . . . . 72.32 111.048 -179.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . 0.454 ' CD ' HG22 ' A' ' 59' ' ' THR . 9.2 tt0 -84.24 -21.18 31.25 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 115.669 1.729 . . . . 65.36 115.669 -177.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -87.78 78.43 8.4 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.899 -0.591 . . . . 25.24 109.699 -177.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -89.72 170.0 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 124.091 0.957 . . . . 20.33 111.415 -178.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 98' ' ' ASN . 97.3 mt-10 -56.37 144.27 31.32 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 107.992 -1.114 . . . . 56.46 107.992 177.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 167.86 -179.74 40.98 Favored Glycine 0 CA--C 1.499 -0.948 0 N-CA-C 106.846 -2.501 . . . . 21.6 106.846 177.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 97.1 mt -106.69 125.93 62.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 N-CA-C 101.275 -3.602 . . . . 22.74 101.275 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -115.87 149.66 38.29 Favored 'General case' 0 CA--C 1.506 -0.714 0 O-C-N 124.954 1.409 . . . . 19.65 111.685 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.2 ttpp -126.67 120.5 29.62 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 107.816 -1.179 . . . . 39.46 107.816 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 62.5 t -103.0 120.71 53.22 Favored 'Isoleucine or valine' 0 C--O 1.242 0.684 0 N-CA-C 106.927 -1.508 . . . . 17.78 106.927 176.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . 0.484 ' HG3' ' OE1' ' A' ' 92' ' ' GLU . 33.6 tt0 -112.97 125.14 54.08 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.394 -0.965 . . . . 46.48 108.394 -178.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 97.9 mt -109.81 118.98 58.09 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.922 0 N-CA-C 106.876 -1.527 . . . . 19.39 106.876 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASP . . . . . 0.946 ' HB2' ' O ' ' A' ' 128' ' ' HOH . 29.6 t0 -75.72 74.26 2.69 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 112.897 0.703 . . . . 58.7 112.897 -178.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 72.9 p -67.3 -35.79 80.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.339 -1.301 . . . . 24.91 112.662 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . 0.48 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 18.4 tttp -58.53 -46.9 85.82 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.514 0.931 . . . . 51.74 113.514 -179.327 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 66.0 m -60.53 -44.41 96.09 Favored 'General case' 0 CA--C 1.491 -1.32 0 C-N-CA 120.804 -0.359 . . . . 41.63 111.303 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -52.94 -57.52 10.01 Favored 'General case' 0 C--O 1.248 0.99 0 O-C-N 124.62 1.2 . . . . 30.28 112.281 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 73.2 m95 -64.93 -36.08 83.23 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 113.105 0.78 . . . . 29.68 113.105 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . 0.501 ' NZ ' ' HD2' ' A' ' 86' ' ' PRO . 66.1 mmtt -56.64 -44.83 81.67 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 109.882 -0.414 . . . . 72.81 109.882 179.345 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.0 -28.76 69.79 Favored 'General case' 0 CA--C 1.505 -0.786 0 O-C-N 123.843 0.714 . . . . 47.23 109.987 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 14.5 mt -86.81 6.89 29.41 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.42 0.628 . . . . 44.41 110.482 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 69.3 23.02 76.47 Favored Glycine 0 CA--C 1.497 -1.04 0 CA-C-N 116.243 -0.435 . . . . 44.98 112.066 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 97.7 mt -108.78 146.2 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 N-CA-C 108.378 -0.971 . . . . 42.56 108.378 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 t -101.37 101.26 16.27 Favored Pre-proline 0 N--CA 1.472 0.669 0 N-CA-C 109.261 -0.644 . . . . 54.34 109.261 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PRO . . . . . 0.501 ' HD2' ' NZ ' ' A' ' 80' ' ' LYS . 17.6 Cg_endo -73.74 159.78 44.88 Favored 'Trans proline' 0 C--O 1.21 -0.915 0 C-N-CA 124.728 3.619 . . . . 35.41 114.687 -179.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -87.18 -45.45 10.65 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 120.634 0.254 . . . . 27.77 110.365 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 49.7 m80 -80.94 146.75 30.61 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 116.913 2.19 . . . . 27.81 116.913 -177.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -71.02 -42.18 69.9 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 106.568 -1.641 . . . . 36.12 106.568 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' CD2' ' CD ' ' A' ' 92' ' ' GLU . 3.7 p-80 -171.92 172.12 4.88 Favored 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 107.961 -1.125 . . . . 31.44 107.961 177.962 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -107.57 130.91 54.83 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.979 -1.859 . . . . 23.5 105.979 177.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . 0.484 ' OE1' ' HG3' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -115.84 143.27 45.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.685 0.755 . . . . 66.55 110.343 179.02 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.9 t -130.42 113.85 26.8 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 N-CA-C 103.332 -2.84 . . . . 29.18 103.332 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 26.9 t -111.42 125.58 68.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 O-C-N 123.737 0.648 . . . . 18.03 109.908 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -153.49 156.97 39.14 Favored 'General case' 0 C--O 1.205 -1.277 0 N-CA-C 112.939 0.718 . . . . 19.34 112.939 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 85.1 m -88.12 131.91 34.51 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 104.425 -2.435 . . . . 24.41 104.425 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -118.1 151.02 38.37 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.054 -0.404 . . . . 27.11 111.282 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . 0.547 ' OD1' ' HA ' ' A' ' 102' ' ' PRO . 23.2 m-20 50.42 16.33 0.27 Allowed 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 119.405 3.113 . . . . 42.12 119.405 178.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -56.59 -30.78 63.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.838 0.29 . . . . 70.62 110.829 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.5 m -112.3 35.04 3.95 Favored 'General case' 0 C--O 1.214 -0.796 0 N-CA-C 109.94 -0.393 . . . . 75.62 109.94 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 100.3 162.82 28.43 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 108.975 -1.65 . . . . 61.13 108.975 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PRO . . . . . 0.547 ' HA ' ' OD1' ' A' ' 98' ' ' ASN . 90.8 Cg_endo -69.16 136.28 34.16 Favored 'Trans proline' 0 CA--C 1.511 -0.629 0 C-N-CA 123.488 2.792 . . . . 60.11 114.651 -179.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 52.9 mmt-85 -131.0 171.16 13.54 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 104.109 -2.552 . . . . 59.46 104.109 179.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ARG . . . . . 0.544 ' HD3' ' HA ' ' A' ' 11' ' ' PRO . 0.3 OUTLIER -104.92 129.2 53.34 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 100.904 -3.739 . . . . 85.44 100.904 176.422 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -115.99 125.15 52.11 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 123.781 0.833 . . . . 26.65 111.091 -178.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 77.2 m -116.15 116.76 28.42 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 104.503 -2.406 . . . . 22.59 104.503 174.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 40.0 mm -102.3 120.06 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 103.587 -2.746 . . . . 25.73 103.587 -179.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -112.07 141.22 46.0 Favored 'General case' 0 C--O 1.253 1.239 0 N-CA-C 107.997 -1.112 . . . . 25.01 107.997 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -129.85 136.25 49.34 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 109.145 -0.687 . . . . 19.23 109.145 177.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 49.2 tp -115.78 122.55 45.79 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 103.903 -2.629 . . . . 21.53 103.903 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 15.4 mt -111.69 139.26 47.29 Favored 'General case' 0 N--CA 1.475 0.803 1 N-CA-C 122.474 4.249 . . . . 19.68 122.474 -174.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 70.2 m -138.3 159.99 65.74 Favored Pre-proline 0 N--CA 1.477 0.879 0 N-CA-C 104.071 -2.566 . . . . 22.2 104.071 175.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -53.15 -41.73 70.02 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 122.408 2.072 . . . . 19.3 115.42 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -114.31 15.56 18.04 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 116.47 2.026 . . . . 40.37 116.47 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . 0.533 ' HB2' ' HB ' ' B' ' 119' ' ' THR . 41.1 t -159.39 151.43 20.8 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 112.46 0.541 . . . . 23.03 112.46 -179.464 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -152.79 152.97 32.24 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 107.811 -1.181 . . . . 29.4 107.811 173.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 95.6 p -130.54 153.52 48.77 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 104.169 -2.53 . . . . 31.59 104.169 176.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.9 t -142.53 134.84 27.65 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 106.238 -1.764 . . . . 22.53 106.238 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' THR . . . . . 0.583 HG23 ' O ' ' A' ' 157' ' ' HOH . 0.1 OUTLIER -130.78 152.69 49.84 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 118.432 -1.307 . . . . 32.54 109.338 176.755 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -114.79 128.41 56.28 Favored 'General case' 0 CA--C 1.505 -0.775 0 O-C-N 124.857 1.348 . . . . 18.99 110.845 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 61.4 t -110.69 113.42 44.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 105.106 -2.183 . . . . 22.81 105.106 175.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 70.9 t -108.82 124.26 65.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 O-C-N 121.477 -0.764 . . . . 27.31 110.125 -176.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 63.7 p . . . . . 0 C--N 1.322 -0.608 0 N-CA-C 107.557 -1.275 . . . . 45.78 107.557 179.433 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.502 2.157 0 N-CA-C 105.483 -2.043 . . . . 53.15 105.483 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' PRO . . . . . 0.683 ' HA ' ' HD3' ' B' ' 104' ' ' ARG . 33.4 Cg_endo -85.31 -8.27 8.72 Favored 'Trans proline' 0 C--N 1.322 -0.846 0 C-N-CA 116.401 -1.933 . . . . 31.11 113.152 179.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 50.1 tp -138.94 116.6 11.41 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.386 0.994 . . . . 31.87 109.238 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -128.73 143.67 50.98 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.396 0.617 . . . . 65.62 110.305 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 92.4 t -122.91 138.06 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 N-CA-C 107.941 -1.133 . . . . 20.95 107.941 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -130.36 128.95 42.49 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 108.712 -0.847 . . . . 53.88 108.712 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 15.5 t -125.86 126.92 70.75 Favored 'Isoleucine or valine' 0 C--O 1.254 1.31 0 N-CA-C 112.125 0.417 . . . . 19.14 112.125 -178.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 94.5 mt -115.42 151.92 33.83 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-O 121.329 0.585 . . . . 20.92 112.359 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -107.01 114.12 28.01 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 105.709 -1.96 . . . . 18.25 105.709 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.07 -11.74 60.0 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 124.708 1.203 . . . . 19.22 113.89 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 87.0 t -88.02 -39.51 12.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-O 120.832 0.349 . . . . 20.74 110.805 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ARG . . . . . 0.559 ' NH2' ' O ' ' B' ' 135' ' ' HOH . 31.9 mtm180 -101.83 -11.12 19.3 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 113.057 0.762 . . . . 62.09 113.057 -178.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.61 47.44 61.99 Favored Glycine 0 C--N 1.344 0.977 0 CA-C-O 122.516 1.065 . . . . 19.82 111.714 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' SER . . . . . 0.519 ' HB2' ' HD2' ' B' ' 24' ' ' PRO . 88.9 p -152.8 170.66 7.78 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 121.83 -0.806 . . . . 33.58 111.721 -178.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PRO . . . . . 0.519 ' HD2' ' HB2' ' B' ' 23' ' ' SER . 56.0 Cg_endo -72.45 146.21 44.15 Favored 'Trans proline' 0 C--O 1.243 0.742 0 N-CA-C 107.405 -1.806 . . . . 25.08 107.405 179.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.18 104.88 15.46 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 106.446 -1.687 . . . . 22.1 106.446 177.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 34.4 mt -90.47 142.75 12.48 Favored 'Isoleucine or valine' 0 C--O 1.251 1.15 0 CA-C-N 115.002 -0.999 . . . . 33.97 113.243 -176.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 63.23 34.8 13.09 Favored 'General case' 0 CA--C 1.476 -1.897 0 N-CA-C 115.395 1.628 . . . . 52.69 115.395 177.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' B' ' 48' ' ' LYS . 96.7 t -87.95 131.69 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 105.88 -1.896 . . . . 26.66 105.88 179.093 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.37 134.23 36.59 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.607 0.718 . . . . 20.56 109.686 178.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 98.8 t -129.04 134.7 63.65 Favored 'Isoleucine or valine' 0 C--O 1.249 1.04 0 N-CA-C 107.271 -1.381 . . . . 22.53 107.271 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -125.12 128.48 48.48 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 108.752 -0.833 . . . . 29.66 108.752 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 65.3 t -107.88 135.65 45.84 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 108.709 -0.848 . . . . 24.73 108.709 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -123.98 152.14 42.88 Favored 'General case' 0 C--O 1.25 1.093 0 C-N-CA 123.35 0.66 . . . . 26.19 109.366 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ARG . . . . . . . . . . . . . 73.0 ttt-85 -119.28 137.67 53.52 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 107.351 -1.352 . . . . 53.69 107.351 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -72.94 124.42 25.41 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 107.499 -1.297 . . . . 49.08 107.499 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ALA . . . . . 0.717 ' HB2' ' HG2' ' B' ' 42' ' ' GLU . . . -81.48 157.03 25.03 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 125.736 1.614 . . . . 42.45 110.822 -179.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -49.03 -37.97 22.29 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 114.872 -1.058 . . . . 57.59 109.733 -178.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -89.06 28.59 1.17 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.804 -1.089 . . . . 73.47 111.571 -178.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.97 19.24 4.45 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 118.235 2.679 . . . . 77.42 118.235 179.904 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.9 p -100.93 159.2 15.41 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 106.809 -1.552 . . . . 55.64 106.809 178.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -88.85 108.51 19.56 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 112.681 0.623 . . . . 38.79 112.681 178.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLU . . . . . 0.717 ' HG2' ' HB2' ' B' ' 36' ' ' ALA . 5.4 mm-40 -84.53 135.62 40.72 Favored Pre-proline 0 C--N 1.315 -0.926 0 N-CA-C 109.528 -0.545 . . . . 74.53 109.528 178.664 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -60.34 141.12 94.97 Favored 'Trans proline' 0 C--N 1.333 -0.245 0 N-CA-C 104.609 -2.881 . . . . 34.57 104.609 178.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' PHE . . . . . 0.448 ' CZ ' HG21 ' B' ' 59' ' ' THR . 92.6 t80 -127.86 -43.58 1.52 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 119.02 -1.072 . . . . 22.96 113.318 -175.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -162.99 157.97 21.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.663 -1.236 . . . . 21.96 107.663 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 81.7 p -158.27 161.6 37.72 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 120.773 0.32 . . . . 25.71 111.455 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 179.42 -169.31 40.36 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 118.994 -1.574 . . . . 24.3 110.174 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LYS . . . . . 0.433 ' HA ' ' O ' ' B' ' 28' ' ' VAL . 49.0 mttm -131.0 139.16 49.95 Favored 'General case' 0 C--O 1.252 1.19 0 N-CA-C 109.165 -0.68 . . . . 45.57 109.165 178.937 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 75.9 p -64.87 145.38 56.37 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-O 122.147 0.975 . . . . 26.09 108.673 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 96.2 p -80.19 -171.98 3.24 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.076 -1.42 . . . . 31.7 110.061 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -65.97 -15.94 63.44 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.648 0.592 . . . . 74.89 110.445 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 56.4 p -100.58 11.25 39.9 Favored 'General case' 0 C--O 1.217 -0.628 0 C-N-CA 119.86 -0.736 . . . . 37.73 109.726 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.19 11.7 79.41 Favored Glycine 0 C--O 1.224 -0.483 0 CA-C-O 121.732 0.629 . . . . 20.43 114.517 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -108.02 154.64 21.37 Favored 'General case' 0 C--O 1.253 1.268 0 N-CA-C 114.725 1.38 . . . . 50.77 114.725 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 11.0 tp -132.7 110.73 10.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.474 -1.306 . . . . 23.08 107.474 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -113.34 168.07 10.04 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 114.96 -1.018 . . . . 41.63 111.979 -178.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.41 34.37 89.76 Favored Glycine 0 C--O 1.213 -1.191 0 CA-C-N 114.869 -1.06 . . . . 31.4 115.284 176.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 28.0 mt -71.07 -36.17 72.18 Favored 'General case' 0 CA--C 1.552 1.056 0 CA-C-N 117.272 0.536 . . . . 30.84 111.764 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' THR . . . . . 0.519 HG22 ' CD ' ' B' ' 63' ' ' GLU 0.306 0.0 OUTLIER -147.83 -170.9 3.69 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.597 0.759 . . . . 35.73 110.708 -179.451 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 51.2 p -128.73 159.82 34.44 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 104.314 -2.476 . . . . 29.98 104.314 177.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.15 -26.22 68.08 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 117.459 -1.696 . . . . 67.33 109.918 -179.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.66 -47.13 86.81 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.605 0.717 . . . . 69.16 111.308 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLU . . . . . 0.519 ' CD ' HG22 ' B' ' 59' ' ' THR . 19.8 tt0 -81.81 -24.38 35.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.546 -1.206 . . . . 67.87 114.249 -176.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -84.04 77.19 9.98 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.884 -0.598 . . . . 31.95 111.917 -177.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.6 m -89.22 169.76 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-O 121.886 0.851 . . . . 25.89 112.853 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' B' ' 98' ' ' ASN . 97.9 mt-10 -59.35 144.28 47.08 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 106.305 -1.739 . . . . 55.12 106.305 178.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 170.69 -178.27 43.34 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 106.02 -2.832 . . . . 26.82 106.02 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 67.9 mt -106.51 130.75 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.052 0 N-CA-C 100.439 -3.912 . . . . 26.99 100.439 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -122.8 151.8 41.29 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.248 -0.887 . . . . 24.03 110.434 -178.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.0 ttpp -129.84 120.67 25.34 Favored 'General case' 0 C--O 1.247 0.941 0 CA-C-N 114.412 -1.267 . . . . 39.03 108.215 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 58.2 t -102.75 124.16 56.58 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.814 0 N-CA-C 104.971 -2.233 . . . . 21.96 104.971 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' GLU . . . . . 0.492 ' HG3' ' OE1' ' B' ' 92' ' ' GLU . 38.2 tt0 -116.45 119.72 36.51 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 109.115 -0.698 . . . . 51.36 109.115 -179.414 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 76.3 mt -104.09 117.88 50.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-N 115.378 -0.828 . . . . 24.55 109.206 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -77.41 77.89 3.94 Favored 'General case' 0 CA--C 1.494 -1.181 0 C-N-CA 118.679 -1.208 . . . . 58.51 112.353 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 47.4 p -70.18 -35.58 74.05 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 124.892 1.37 . . . . 28.11 112.576 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LYS . . . . . 0.525 ' O ' ' HG2' ' B' ' 80' ' ' LYS . 15.4 tttp -57.82 -45.89 85.49 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.479 0.918 . . . . 53.22 113.479 -178.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 58.1 m -59.87 -44.88 93.93 Favored 'General case' 0 CA--C 1.499 -1.007 0 O-C-N 123.388 0.43 . . . . 39.4 110.434 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -52.03 -59.12 4.72 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 125.13 1.519 . . . . 31.38 112.797 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 80.7 m95 -61.98 -39.29 91.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.592 0.96 . . . . 30.82 113.592 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LYS . . . . . 0.547 ' NZ ' ' HD2' ' B' ' 86' ' ' PRO . 66.3 mmtt -57.35 -43.09 83.16 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.001 -1.111 . . . . 72.57 108.001 -179.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.8 -33.13 72.52 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.507 0.67 . . . . 45.06 109.903 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.6 mt -85.64 12.32 9.01 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 119.931 -0.708 . . . . 42.91 110.591 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 65.43 23.95 70.53 Favored Glycine 0 N--CA 1.441 -0.991 0 C-N-CA 120.21 -0.995 . . . . 46.43 112.074 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 72.9 mt -110.7 148.75 13.9 Favored 'Isoleucine or valine' 0 C--O 1.248 0.988 0 CA-C-N 118.69 1.245 . . . . 47.58 110.704 179.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 7.0 t -96.29 104.67 18.19 Favored Pre-proline 0 C--O 1.233 0.225 0 C-N-CA 120.715 -0.394 . . . . 55.75 110.611 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' PRO . . . . . 0.547 ' HD2' ' NZ ' ' B' ' 80' ' ' LYS . 11.9 Cg_endo -80.6 158.81 22.08 Favored 'Trans proline' 0 C--O 1.245 0.871 0 C-N-CA 120.995 1.13 . . . . 35.76 114.048 -179.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -84.83 -45.93 11.84 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 121.476 0.655 . . . . 27.72 111.905 176.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -81.45 146.0 30.48 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 116.939 2.2 . . . . 26.13 116.939 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -70.89 -37.39 73.01 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 106.071 -1.826 . . . . 35.13 106.071 175.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -176.8 175.32 1.66 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 107.181 -1.415 . . . . 33.76 107.181 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.37 135.86 49.73 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 105.891 -1.892 . . . . 25.52 105.891 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLU . . . . . 0.492 ' OE1' ' HG3' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -123.18 139.95 53.52 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.736 -1.209 . . . . 65.13 107.736 179.787 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 58.1 t -126.23 116.63 46.21 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 N-CA-C 102.865 -3.013 . . . . 26.72 102.865 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 45.7 t -113.04 128.74 69.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.824 -0.806 . . . . 18.06 108.824 179.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -155.48 158.25 38.23 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 120.334 -0.546 . . . . 23.4 111.286 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 33.0 m -93.55 131.46 38.79 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 104.002 -2.592 . . . . 24.8 104.002 177.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' B' ' 99' ' ' ASP . . . -110.7 162.0 15.2 Favored 'General case' 0 N--CA 1.428 -1.565 0 C-N-CA 119.462 -0.895 . . . . 33.24 110.028 -178.258 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . 0.718 ' OD1' ' HA ' ' B' ' 102' ' ' PRO . 32.9 m-20 38.58 13.41 0.0 OUTLIER 'General case' 0 C--O 1.256 1.442 0 N-CA-C 119.14 3.015 . . . . 55.93 119.14 175.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' B' ' 99' ' ' ASP . 17.4 p-10 -50.84 -29.4 11.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 120.109 -0.636 . . . . 71.04 109.484 -179.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' SER . . . . . 0.427 ' O ' ' NH2' ' B' ' 103' ' ' ARG . 17.9 m -113.37 38.1 2.99 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.904 0.859 . . . . 77.54 110.246 178.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLY . . . . . 0.482 ' O ' ' HA ' ' B' ' 98' ' ' ASN . . . 94.93 163.52 35.03 Favored Glycine 0 C--O 1.248 0.991 0 N-CA-C 107.245 -2.342 . . . . 65.31 107.245 -179.298 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' PRO . . . . . 0.718 ' HA ' ' OD1' ' B' ' 98' ' ' ASN . 78.7 Cg_endo -72.48 140.15 32.69 Favored 'Trans proline' 0 CA--C 1.498 -1.292 0 C-N-CA 124.465 3.444 . . . . 66.19 113.957 179.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ARG . . . . . 0.427 ' NH2' ' O ' ' B' ' 100' ' ' SER . 46.2 mmt-85 -129.46 -178.18 4.57 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 103.319 -2.845 . . . . 65.14 103.319 178.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ARG . . . . . 0.683 ' HD3' ' HA ' ' B' ' 11' ' ' PRO . 0.0 OUTLIER -108.89 125.81 52.4 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 103.016 -2.957 . . . . 85.83 103.016 173.044 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -113.47 128.08 56.32 Favored 'General case' 0 CA--C 1.483 -1.616 0 CA-C-N 116.439 -0.346 . . . . 33.21 110.323 -177.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 99.6 m -116.35 124.67 50.67 Favored 'General case' 0 C--O 1.252 1.23 0 N-CA-C 101.756 -3.424 . . . . 22.92 101.756 173.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 44.4 mm -107.29 122.04 60.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 103.731 -2.692 . . . . 26.61 103.731 176.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -113.73 144.41 43.0 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.234 -1.395 . . . . 22.47 107.234 178.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -132.61 137.95 47.22 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 106.483 -1.673 . . . . 21.06 106.483 178.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 59.0 tp -117.86 122.81 44.32 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 103.261 -2.866 . . . . 24.35 103.261 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 13.9 mt -111.6 142.83 43.41 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 119.027 2.973 . . . . 19.25 119.027 -174.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 35.9 m -138.99 160.79 61.29 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 104.551 -2.388 . . . . 23.39 104.551 174.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -53.74 -43.72 55.4 Favored 'Trans proline' 0 C--O 1.243 0.747 0 N-CA-C 116.18 1.569 . . . . 19.5 116.18 -179.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -111.05 17.05 20.8 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 115.484 1.661 . . . . 36.62 115.484 -178.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 48.1 t -161.94 153.96 19.21 Favored 'General case' 0 CA--C 1.492 -1.258 0 C-N-CA 118.745 -1.182 . . . . 22.24 111.94 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 29.6 p90 -153.7 151.87 30.14 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-O 121.98 0.895 . . . . 31.24 111.655 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 84.0 p -129.69 150.74 50.87 Favored 'General case' 0 N--CA 1.424 -1.759 0 N-CA-C 105.001 -2.222 . . . . 33.69 105.001 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 5.8 t -140.04 138.39 35.36 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 106.466 -1.679 . . . . 20.08 106.466 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' THR . . . . . 0.637 HG23 ' O ' ' B' ' 149' ' ' HOH . 0.1 OUTLIER -135.78 148.86 48.93 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 121.169 0.509 . . . . 33.01 109.976 178.2 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -109.36 125.18 52.08 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.012 -0.995 . . . . 24.63 111.008 -178.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 48.5 t -108.13 109.99 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 105.246 -2.131 . . . . 26.31 105.246 175.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 85.2 t -104.38 127.29 58.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.169 -0.612 . . . . 32.99 111.266 -179.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 58.2 p . . . . . 0 C--O 1.25 1.092 0 N-CA-C 109.287 -0.635 . . . . 51.81 109.287 178.991 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . 0.946 ' O ' ' HB2' ' A' ' 74' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . 0.485 ' O ' ' NH2' ' A' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . 0.583 ' O ' HG23 ' A' ' 119' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 135' ' ' HOH . . . . . 0.559 ' O ' ' NH2' ' B' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 149' ' ' HOH . . . . . 0.637 ' O ' HG23 ' B' ' 119' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 107.974 -1.121 . . . . 50.79 107.974 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.544 ' HA ' ' HD3' ' A' ' 104' ' ' ARG . 68.3 Cg_endo -81.98 -9.78 11.75 Favored 'Trans proline' 0 C--O 1.201 -1.359 0 C-N-CA 116.631 -1.78 . . . . 29.7 115.129 -179.744 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.2 tp -141.17 117.57 10.79 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.309 -0.626 . . . . 27.87 109.309 -178.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 6.6 tmm? -129.6 144.61 51.35 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 124.262 0.976 . . . . 63.31 109.24 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.3 t -126.42 135.76 62.83 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.653 0 N-CA-C 107.738 -1.208 . . . . 17.92 107.738 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -130.79 130.49 43.76 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.082 -1.081 . . . . 54.51 108.082 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.8 t -126.41 131.33 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-O 121.424 0.631 . . . . 18.55 112.626 -177.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.5 mt -120.49 152.16 38.39 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 122.743 1.259 . . . . 18.33 112.285 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.5 t0 -104.44 116.7 32.57 Favored 'General case' 0 CA--C 1.559 1.323 0 N-CA-C 107.132 -1.433 . . . . 22.17 107.132 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.58 -10.28 58.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.799 1.24 . . . . 20.1 112.663 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.1 t -90.78 -35.72 7.5 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.446 0 N-CA-C 109.874 -0.417 . . . . 20.63 109.874 178.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.485 ' NH2' ' O ' ' A' ' 142' ' ' HOH . 31.6 mtm180 -104.17 -12.38 16.73 Favored 'General case' 0 C--O 1.206 -1.207 0 N-CA-C 113.632 0.975 . . . . 62.23 113.632 -178.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.66 46.2 70.43 Favored Glycine 0 C--O 1.256 1.474 0 CA-C-O 122.567 1.093 . . . . 18.12 110.835 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . 0.492 ' HB2' ' HD2' ' A' ' 24' ' ' PRO . 82.2 p -151.86 169.76 8.96 Favored Pre-proline 0 CA--C 1.506 -0.723 0 CA-C-O 121.82 0.819 . . . . 33.84 111.107 -179.657 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.492 ' HD2' ' HB2' ' A' ' 23' ' ' SER . 42.9 Cg_endo -70.72 146.32 53.96 Favored 'Trans proline' 0 CA--C 1.551 1.371 0 N-CA-C 107.036 -1.948 . . . . 26.68 107.036 178.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.09 107.94 18.66 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 103.395 -2.817 . . . . 18.37 103.395 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 35.1 mt -91.82 143.83 10.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 113.82 -1.536 . . . . 31.16 112.919 -176.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.5 m120 62.76 32.37 16.06 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 117.249 2.314 . . . . 54.76 117.249 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 93.5 t -86.47 128.22 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 N-CA-C 106.966 -1.494 . . . . 21.97 106.966 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.36 137.14 42.59 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 108.46 -0.941 . . . . 17.69 108.46 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 64.0 t -132.55 131.74 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 107.446 -1.316 . . . . 17.36 107.446 177.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.667 ' HD2' ' O ' ' A' ' 147' ' ' HOH . 70.3 m80 -124.79 131.11 53.48 Favored 'General case' 0 C--O 1.209 -1.056 0 N-CA-C 105.993 -1.854 . . . . 27.62 105.993 178.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 47.8 t -111.41 136.18 48.32 Favored 'Isoleucine or valine' 0 C--O 1.261 1.661 0 N-CA-C 108.322 -0.992 . . . . 19.08 108.322 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -126.36 155.37 42.18 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.449 -0.945 . . . . 21.43 108.449 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 76.3 ttt-85 -125.74 135.28 51.89 Favored 'General case' 0 C--O 1.25 1.108 0 N-CA-C 107.527 -1.286 . . . . 46.28 107.527 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 tttp -69.21 121.96 17.86 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.701 -0.852 . . . . 52.26 108.701 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.672 ' HB2' ' HG2' ' A' ' 42' ' ' GLU . . . -79.41 162.96 25.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.055 -1.429 . . . . 39.74 109.826 -178.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.31 -34.78 58.8 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 114.296 -1.32 . . . . 55.94 111.072 179.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -91.73 29.13 1.6 Allowed 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.216 0.531 . . . . 71.93 111.66 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.74 19.97 4.77 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.703 2.483 . . . . 74.84 117.703 -179.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.5 p -101.21 157.38 16.82 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.464 -0.939 . . . . 52.84 108.464 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -87.87 110.78 20.78 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.343 -0.543 . . . . 38.36 111.457 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.672 ' HG2' ' HB2' ' A' ' 36' ' ' ALA . 4.8 mm-40 -87.07 139.29 32.47 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 108.987 -0.746 . . . . 73.9 108.987 176.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -61.44 134.73 53.22 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 123.998 3.132 . . . . 31.96 105.199 178.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.469 ' CZ ' HG21 ' A' ' 59' ' ' THR . 89.0 t80 -121.35 -44.16 2.38 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 118.196 -1.401 . . . . 22.36 111.076 -177.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -163.82 159.96 21.79 Favored 'General case' 0 C--O 1.254 1.303 0 N-CA-C 106.751 -1.574 . . . . 19.6 106.751 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 99.7 p -159.32 161.51 35.84 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.532 0.682 . . . . 20.37 109.949 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.47 -172.13 43.27 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.776 -1.33 . . . . 21.96 109.776 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.8 mttm -127.86 142.97 51.13 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.386 -1.339 . . . . 44.56 107.386 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 67.7 p -66.79 151.48 47.4 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 122.066 0.936 . . . . 20.77 109.422 177.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 97.2 p -86.45 -172.49 4.06 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.819 -0.628 . . . . 32.73 109.494 -179.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -64.29 -17.84 64.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.459 0.704 . . . . 74.24 110.2 179.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 80.7 p -95.45 8.33 43.58 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 119.985 -0.686 . . . . 33.46 111.299 178.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.69 12.35 80.63 Favored Glycine 0 C--O 1.222 -0.631 0 O-C-N 123.621 0.576 . . . . 18.58 114.126 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -109.23 147.27 32.85 Favored 'General case' 0 CA--C 1.485 -1.521 0 N-CA-C 116.262 1.949 . . . . 49.02 116.262 -178.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.8 tp -126.47 112.4 15.54 Favored 'General case' 0 C--O 1.2 -1.524 0 N-CA-C 107.883 -1.155 . . . . 19.4 107.883 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -114.13 168.3 9.94 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.834 -0.621 . . . . 40.35 111.458 178.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 65.74 31.63 80.47 Favored Glycine 0 C--O 1.213 -1.215 0 N-CA-C 117.496 1.758 . . . . 29.04 117.496 175.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.8 mt -69.06 -40.47 78.5 Favored 'General case' 0 N--CA 1.442 -0.852 0 O-C-N 124.061 0.506 . . . . 28.83 110.299 178.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . 0.469 HG21 ' CZ ' ' A' ' 44' ' ' PHE 0.278 0.0 OUTLIER -145.88 -174.04 4.31 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.111 0.564 . . . . 32.24 111.847 -178.213 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.3 p -126.64 162.19 26.32 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 103.305 -2.85 . . . . 28.42 103.305 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.402 ' HG2' ' NH1' ' A' ' 104' ' ' ARG . 1.0 OUTLIER -66.93 -27.32 67.38 Favored 'General case' 0 CA--C 1.497 -1.068 0 C-N-CA 117.244 -1.782 . . . . 67.22 109.938 -179.085 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.44 -45.35 93.99 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 124.076 0.86 . . . . 72.32 111.048 -179.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.454 ' CD ' HG22 ' A' ' 59' ' ' THR . 9.2 tt0 -84.24 -21.18 31.25 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 115.669 1.729 . . . . 65.36 115.669 -177.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -87.78 78.43 8.4 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.899 -0.591 . . . . 25.24 109.699 -177.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -89.72 170.0 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 124.091 0.957 . . . . 20.33 111.415 -178.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 98' ' ' ASN . 97.3 mt-10 -56.37 144.27 31.32 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 107.992 -1.114 . . . . 56.46 107.992 177.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 167.86 -179.74 40.98 Favored Glycine 0 CA--C 1.499 -0.948 0 N-CA-C 106.846 -2.501 . . . . 21.6 106.846 177.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 97.1 mt -106.69 125.93 62.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 N-CA-C 101.275 -3.602 . . . . 22.74 101.275 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -115.87 149.66 38.29 Favored 'General case' 0 CA--C 1.506 -0.714 0 O-C-N 124.954 1.409 . . . . 19.65 111.685 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.2 ttpp -126.67 120.5 29.62 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 107.816 -1.179 . . . . 39.46 107.816 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 62.5 t -103.0 120.71 53.22 Favored 'Isoleucine or valine' 0 C--O 1.242 0.684 0 N-CA-C 106.927 -1.508 . . . . 17.78 106.927 176.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.484 ' HG3' ' OE1' ' A' ' 92' ' ' GLU . 33.6 tt0 -112.97 125.14 54.08 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.394 -0.965 . . . . 46.48 108.394 -178.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 97.9 mt -109.81 118.98 58.09 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.922 0 N-CA-C 106.876 -1.527 . . . . 19.39 106.876 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.946 ' HB2' ' O ' ' A' ' 128' ' ' HOH . 29.6 t0 -75.72 74.26 2.69 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 112.897 0.703 . . . . 58.7 112.897 -178.55 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 72.9 p -67.3 -35.79 80.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.339 -1.301 . . . . 24.91 112.662 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.48 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 18.4 tttp -58.53 -46.9 85.82 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.514 0.931 . . . . 51.74 113.514 -179.327 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 66.0 m -60.53 -44.41 96.09 Favored 'General case' 0 CA--C 1.491 -1.32 0 C-N-CA 120.804 -0.359 . . . . 41.63 111.303 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -52.94 -57.52 10.01 Favored 'General case' 0 C--O 1.248 0.99 0 O-C-N 124.62 1.2 . . . . 30.28 112.281 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 73.2 m95 -64.93 -36.08 83.23 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 113.105 0.78 . . . . 29.68 113.105 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.501 ' NZ ' ' HD2' ' A' ' 86' ' ' PRO . 66.1 mmtt -56.64 -44.83 81.67 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 109.882 -0.414 . . . . 72.81 109.882 179.345 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.0 -28.76 69.79 Favored 'General case' 0 CA--C 1.505 -0.786 0 O-C-N 123.843 0.714 . . . . 47.23 109.987 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 14.5 mt -86.81 6.89 29.41 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.42 0.628 . . . . 44.41 110.482 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 69.3 23.02 76.47 Favored Glycine 0 CA--C 1.497 -1.04 0 CA-C-N 116.243 -0.435 . . . . 44.98 112.066 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 97.7 mt -108.78 146.2 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 N-CA-C 108.378 -0.971 . . . . 42.56 108.378 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 t -101.37 101.26 16.27 Favored Pre-proline 0 N--CA 1.472 0.669 0 N-CA-C 109.261 -0.644 . . . . 54.34 109.261 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.501 ' HD2' ' NZ ' ' A' ' 80' ' ' LYS . 17.6 Cg_endo -73.74 159.78 44.88 Favored 'Trans proline' 0 C--O 1.21 -0.915 0 C-N-CA 124.728 3.619 . . . . 35.41 114.687 -179.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -87.18 -45.45 10.65 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 120.634 0.254 . . . . 27.77 110.365 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 49.7 m80 -80.94 146.75 30.61 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 116.913 2.19 . . . . 27.81 116.913 -177.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -71.02 -42.18 69.9 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 106.568 -1.641 . . . . 36.12 106.568 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' CD2' ' CD ' ' A' ' 92' ' ' GLU . 3.7 p-80 -171.92 172.12 4.88 Favored 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 107.961 -1.125 . . . . 31.44 107.961 177.962 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -107.57 130.91 54.83 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.979 -1.859 . . . . 23.5 105.979 177.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.484 ' OE1' ' HG3' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -115.84 143.27 45.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.685 0.755 . . . . 66.55 110.343 179.02 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.9 t -130.42 113.85 26.8 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 N-CA-C 103.332 -2.84 . . . . 29.18 103.332 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 26.9 t -111.42 125.58 68.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 O-C-N 123.737 0.648 . . . . 18.03 109.908 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -153.49 156.97 39.14 Favored 'General case' 0 C--O 1.205 -1.277 0 N-CA-C 112.939 0.718 . . . . 19.34 112.939 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 85.1 m -88.12 131.91 34.51 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 104.425 -2.435 . . . . 24.41 104.425 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -118.1 151.02 38.37 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.054 -0.404 . . . . 27.11 111.282 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.72 HD22 ' HA ' ' A' ' 102' ' ' PRO . 10.8 m120 50.42 16.33 0.27 Allowed 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 119.405 3.113 . . . . 42.12 119.405 178.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -56.59 -30.78 63.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.838 0.29 . . . . 70.62 110.829 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.5 m -112.3 35.04 3.95 Favored 'General case' 0 C--O 1.214 -0.796 0 N-CA-C 109.94 -0.393 . . . . 75.62 109.94 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 100.3 162.82 28.43 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 108.975 -1.65 . . . . 61.13 108.975 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.72 ' HA ' HD22 ' A' ' 98' ' ' ASN . 90.8 Cg_endo -69.16 136.28 34.16 Favored 'Trans proline' 0 CA--C 1.511 -0.629 0 C-N-CA 123.488 2.792 . . . . 60.11 114.651 -179.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 52.9 mmt-85 -131.0 171.16 13.54 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 104.109 -2.552 . . . . 59.46 104.109 179.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.544 ' HD3' ' HA ' ' A' ' 11' ' ' PRO . 0.3 OUTLIER -104.92 129.2 53.34 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 100.904 -3.739 . . . . 85.44 100.904 176.422 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -115.99 125.15 52.11 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 123.781 0.833 . . . . 26.65 111.091 -178.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 77.2 m -116.15 116.76 28.42 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 104.503 -2.406 . . . . 22.59 104.503 174.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 40.0 mm -102.3 120.06 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 103.587 -2.746 . . . . 25.73 103.587 -179.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -112.07 141.22 46.0 Favored 'General case' 0 C--O 1.253 1.239 0 N-CA-C 107.997 -1.112 . . . . 25.01 107.997 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -129.85 136.25 49.34 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 109.145 -0.687 . . . . 19.23 109.145 177.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 49.2 tp -115.78 122.55 45.79 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 103.903 -2.629 . . . . 21.53 103.903 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 15.4 mt -111.69 139.26 47.29 Favored 'General case' 0 N--CA 1.475 0.803 1 N-CA-C 122.474 4.249 . . . . 19.68 122.474 -174.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 70.2 m -138.3 159.99 65.74 Favored Pre-proline 0 N--CA 1.477 0.879 0 N-CA-C 104.071 -2.566 . . . . 22.2 104.071 175.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -53.15 -41.73 70.02 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 122.408 2.072 . . . . 19.3 115.42 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -114.31 15.56 18.04 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 116.47 2.026 . . . . 40.37 116.47 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . 0.533 ' HB2' ' HB ' ' B' ' 119' ' ' THR . 41.1 t -159.39 151.43 20.8 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 112.46 0.541 . . . . 23.03 112.46 -179.464 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -152.79 152.97 32.24 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 107.811 -1.181 . . . . 29.4 107.811 173.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 95.6 p -130.54 153.52 48.77 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 104.169 -2.53 . . . . 31.59 104.169 176.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.9 t -142.53 134.84 27.65 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 106.238 -1.764 . . . . 22.53 106.238 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' THR . . . . . 0.583 HG23 ' O ' ' A' ' 157' ' ' HOH . 0.1 OUTLIER -130.78 152.69 49.84 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 118.432 -1.307 . . . . 32.54 109.338 176.755 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -114.79 128.41 56.28 Favored 'General case' 0 CA--C 1.505 -0.775 0 O-C-N 124.857 1.348 . . . . 18.99 110.845 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 61.4 t -110.69 113.42 44.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 105.106 -2.183 . . . . 22.81 105.106 175.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 70.9 t -108.82 124.26 65.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 O-C-N 121.477 -0.764 . . . . 27.31 110.125 -176.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 63.7 p . . . . . 0 C--N 1.322 -0.608 0 N-CA-C 107.557 -1.275 . . . . 45.78 107.557 179.433 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.502 2.157 0 N-CA-C 105.483 -2.043 . . . . 53.15 105.483 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' PRO . . . . . 0.683 ' HA ' ' HD3' ' B' ' 104' ' ' ARG . 33.4 Cg_endo -85.31 -8.27 8.72 Favored 'Trans proline' 0 C--N 1.322 -0.846 0 C-N-CA 116.401 -1.933 . . . . 31.11 113.152 179.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 50.1 tp -138.94 116.6 11.41 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.386 0.994 . . . . 31.87 109.238 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -128.73 143.67 50.98 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.396 0.617 . . . . 65.62 110.305 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 92.4 t -122.91 138.06 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 N-CA-C 107.941 -1.133 . . . . 20.95 107.941 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -130.36 128.95 42.49 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 108.712 -0.847 . . . . 53.88 108.712 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 15.5 t -125.86 126.92 70.75 Favored 'Isoleucine or valine' 0 C--O 1.254 1.31 0 N-CA-C 112.125 0.417 . . . . 19.14 112.125 -178.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 94.5 mt -115.42 151.92 33.83 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-O 121.329 0.585 . . . . 20.92 112.359 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -107.01 114.12 28.01 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 105.709 -1.96 . . . . 18.25 105.709 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.07 -11.74 60.0 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 124.708 1.203 . . . . 19.22 113.89 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 87.0 t -88.02 -39.51 12.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-O 120.832 0.349 . . . . 20.74 110.805 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.559 ' NH2' ' O ' ' B' ' 135' ' ' HOH . 31.9 mtm180 -101.83 -11.12 19.3 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 113.057 0.762 . . . . 62.09 113.057 -178.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.61 47.44 61.99 Favored Glycine 0 C--N 1.344 0.977 0 CA-C-O 122.516 1.065 . . . . 19.82 111.714 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' SER . . . . . 0.519 ' HB2' ' HD2' ' B' ' 24' ' ' PRO . 88.9 p -152.8 170.66 7.78 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 121.83 -0.806 . . . . 33.58 111.721 -178.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PRO . . . . . 0.519 ' HD2' ' HB2' ' B' ' 23' ' ' SER . 56.0 Cg_endo -72.45 146.21 44.15 Favored 'Trans proline' 0 C--O 1.243 0.742 0 N-CA-C 107.405 -1.806 . . . . 25.08 107.405 179.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.18 104.88 15.46 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 106.446 -1.687 . . . . 22.1 106.446 177.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 34.4 mt -90.47 142.75 12.48 Favored 'Isoleucine or valine' 0 C--O 1.251 1.15 0 CA-C-N 115.002 -0.999 . . . . 33.97 113.243 -176.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.23 34.8 13.09 Favored 'General case' 0 CA--C 1.476 -1.897 0 N-CA-C 115.395 1.628 . . . . 52.69 115.395 177.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' B' ' 48' ' ' LYS . 96.7 t -87.95 131.69 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 105.88 -1.896 . . . . 26.66 105.88 179.093 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.37 134.23 36.59 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.607 0.718 . . . . 20.56 109.686 178.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 98.8 t -129.04 134.7 63.65 Favored 'Isoleucine or valine' 0 C--O 1.249 1.04 0 N-CA-C 107.271 -1.381 . . . . 22.53 107.271 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -125.12 128.48 48.48 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 108.752 -0.833 . . . . 29.66 108.752 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 65.3 t -107.88 135.65 45.84 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 108.709 -0.848 . . . . 24.73 108.709 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -123.98 152.14 42.88 Favored 'General case' 0 C--O 1.25 1.093 0 C-N-CA 123.35 0.66 . . . . 26.19 109.366 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ARG . . . . . . . . . . . . . 73.0 ttt-85 -119.28 137.67 53.52 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 107.351 -1.352 . . . . 53.69 107.351 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -72.94 124.42 25.41 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 107.499 -1.297 . . . . 49.08 107.499 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ALA . . . . . 0.717 ' HB2' ' HG2' ' B' ' 42' ' ' GLU . . . -81.48 157.03 25.03 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 125.736 1.614 . . . . 42.45 110.822 -179.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -49.03 -37.97 22.29 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 114.872 -1.058 . . . . 57.59 109.733 -178.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -89.06 28.59 1.17 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.804 -1.089 . . . . 73.47 111.571 -178.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.97 19.24 4.45 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 118.235 2.679 . . . . 77.42 118.235 179.904 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.9 p -100.93 159.2 15.41 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 106.809 -1.552 . . . . 55.64 106.809 178.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -88.85 108.51 19.56 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 112.681 0.623 . . . . 38.79 112.681 178.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.717 ' HG2' ' HB2' ' B' ' 36' ' ' ALA . 5.4 mm-40 -84.53 135.62 40.72 Favored Pre-proline 0 C--N 1.315 -0.926 0 N-CA-C 109.528 -0.545 . . . . 74.53 109.528 178.664 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -60.34 141.12 94.97 Favored 'Trans proline' 0 C--N 1.333 -0.245 0 N-CA-C 104.609 -2.881 . . . . 34.57 104.609 178.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' PHE . . . . . 0.448 ' CZ ' HG21 ' B' ' 59' ' ' THR . 92.6 t80 -127.86 -43.58 1.52 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 119.02 -1.072 . . . . 22.96 113.318 -175.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -162.99 157.97 21.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.663 -1.236 . . . . 21.96 107.663 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 81.7 p -158.27 161.6 37.72 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 120.773 0.32 . . . . 25.71 111.455 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 179.42 -169.31 40.36 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 118.994 -1.574 . . . . 24.3 110.174 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.433 ' HA ' ' O ' ' B' ' 28' ' ' VAL . 49.0 mttm -131.0 139.16 49.95 Favored 'General case' 0 C--O 1.252 1.19 0 N-CA-C 109.165 -0.68 . . . . 45.57 109.165 178.937 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 75.9 p -64.87 145.38 56.37 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-O 122.147 0.975 . . . . 26.09 108.673 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 96.2 p -80.19 -171.98 3.24 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.076 -1.42 . . . . 31.7 110.061 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -65.97 -15.94 63.44 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.648 0.592 . . . . 74.89 110.445 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 56.4 p -100.58 11.25 39.9 Favored 'General case' 0 C--O 1.217 -0.628 0 C-N-CA 119.86 -0.736 . . . . 37.73 109.726 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.19 11.7 79.41 Favored Glycine 0 C--O 1.224 -0.483 0 CA-C-O 121.732 0.629 . . . . 20.43 114.517 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -108.02 154.64 21.37 Favored 'General case' 0 C--O 1.253 1.268 0 N-CA-C 114.725 1.38 . . . . 50.77 114.725 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 11.0 tp -132.7 110.73 10.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.474 -1.306 . . . . 23.08 107.474 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' HIS . . . . . . . . . . . . . 78.9 m80 -113.34 168.07 10.04 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 114.96 -1.018 . . . . 41.63 111.979 -178.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.41 34.37 89.76 Favored Glycine 0 C--O 1.213 -1.191 0 CA-C-N 114.869 -1.06 . . . . 31.4 115.284 176.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 28.0 mt -71.07 -36.17 72.18 Favored 'General case' 0 CA--C 1.552 1.056 0 CA-C-N 117.272 0.536 . . . . 30.84 111.764 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' THR . . . . . 0.519 HG22 ' CD ' ' B' ' 63' ' ' GLU 0.306 0.0 OUTLIER -147.83 -170.9 3.69 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.597 0.759 . . . . 35.73 110.708 -179.451 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 51.2 p -128.73 159.82 34.44 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 104.314 -2.476 . . . . 29.98 104.314 177.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.15 -26.22 68.08 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 117.459 -1.696 . . . . 67.33 109.918 -179.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.66 -47.13 86.81 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.605 0.717 . . . . 69.16 111.308 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLU . . . . . 0.519 ' CD ' HG22 ' B' ' 59' ' ' THR . 19.8 tt0 -81.81 -24.38 35.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.546 -1.206 . . . . 67.87 114.249 -176.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -84.04 77.19 9.98 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.884 -0.598 . . . . 31.95 111.917 -177.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.6 m -89.22 169.76 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-O 121.886 0.851 . . . . 25.89 112.853 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' B' ' 98' ' ' ASN . 97.9 mt-10 -59.35 144.28 47.08 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 106.305 -1.739 . . . . 55.12 106.305 178.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 170.69 -178.27 43.34 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 106.02 -2.832 . . . . 26.82 106.02 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 67.9 mt -106.51 130.75 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.052 0 N-CA-C 100.439 -3.912 . . . . 26.99 100.439 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -122.8 151.8 41.29 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.248 -0.887 . . . . 24.03 110.434 -178.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.0 ttpp -129.84 120.67 25.34 Favored 'General case' 0 C--O 1.247 0.941 0 CA-C-N 114.412 -1.267 . . . . 39.03 108.215 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 58.2 t -102.75 124.16 56.58 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.814 0 N-CA-C 104.971 -2.233 . . . . 21.96 104.971 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.492 ' HG3' ' OE1' ' B' ' 92' ' ' GLU . 38.2 tt0 -116.45 119.72 36.51 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 109.115 -0.698 . . . . 51.36 109.115 -179.414 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 76.3 mt -104.09 117.88 50.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-N 115.378 -0.828 . . . . 24.55 109.206 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -77.41 77.89 3.94 Favored 'General case' 0 CA--C 1.494 -1.181 0 C-N-CA 118.679 -1.208 . . . . 58.51 112.353 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 47.4 p -70.18 -35.58 74.05 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 124.892 1.37 . . . . 28.11 112.576 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LYS . . . . . 0.525 ' O ' ' HG2' ' B' ' 80' ' ' LYS . 15.4 tttp -57.82 -45.89 85.49 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.479 0.918 . . . . 53.22 113.479 -178.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 58.1 m -59.87 -44.88 93.93 Favored 'General case' 0 CA--C 1.499 -1.007 0 O-C-N 123.388 0.43 . . . . 39.4 110.434 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -52.03 -59.12 4.72 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 125.13 1.519 . . . . 31.38 112.797 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 80.7 m95 -61.98 -39.29 91.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.592 0.96 . . . . 30.82 113.592 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LYS . . . . . 0.547 ' NZ ' ' HD2' ' B' ' 86' ' ' PRO . 66.3 mmtt -57.35 -43.09 83.16 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.001 -1.111 . . . . 72.57 108.001 -179.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.8 -33.13 72.52 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.507 0.67 . . . . 45.06 109.903 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.6 mt -85.64 12.32 9.01 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 119.931 -0.708 . . . . 42.91 110.591 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 65.43 23.95 70.53 Favored Glycine 0 N--CA 1.441 -0.991 0 C-N-CA 120.21 -0.995 . . . . 46.43 112.074 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 72.9 mt -110.7 148.75 13.9 Favored 'Isoleucine or valine' 0 C--O 1.248 0.988 0 CA-C-N 118.69 1.245 . . . . 47.58 110.704 179.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 7.0 t -96.29 104.67 18.19 Favored Pre-proline 0 C--O 1.233 0.225 0 C-N-CA 120.715 -0.394 . . . . 55.75 110.611 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.547 ' HD2' ' NZ ' ' B' ' 80' ' ' LYS . 11.9 Cg_endo -80.6 158.81 22.08 Favored 'Trans proline' 0 C--O 1.245 0.871 0 C-N-CA 120.995 1.13 . . . . 35.76 114.048 -179.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -84.83 -45.93 11.84 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 121.476 0.655 . . . . 27.72 111.905 176.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -81.45 146.0 30.48 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 116.939 2.2 . . . . 26.13 116.939 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -70.89 -37.39 73.01 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 106.071 -1.826 . . . . 35.13 106.071 175.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -176.8 175.32 1.66 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 107.181 -1.415 . . . . 33.76 107.181 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.37 135.86 49.73 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 105.891 -1.892 . . . . 25.52 105.891 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLU . . . . . 0.492 ' OE1' ' HG3' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -123.18 139.95 53.52 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.736 -1.209 . . . . 65.13 107.736 179.787 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 58.1 t -126.23 116.63 46.21 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 N-CA-C 102.865 -3.013 . . . . 26.72 102.865 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 45.7 t -113.04 128.74 69.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.824 -0.806 . . . . 18.06 108.824 179.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -155.48 158.25 38.23 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 120.334 -0.546 . . . . 23.4 111.286 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 33.0 m -93.55 131.46 38.79 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 104.002 -2.592 . . . . 24.8 104.002 177.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' B' ' 99' ' ' ASP . . . -110.7 162.0 15.2 Favored 'General case' 0 N--CA 1.428 -1.565 0 C-N-CA 119.462 -0.895 . . . . 33.24 110.028 -178.258 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . 0.868 ' ND2' ' HA ' ' B' ' 102' ' ' PRO . 9.5 m120 38.58 13.41 0.0 OUTLIER 'General case' 0 C--O 1.256 1.442 0 N-CA-C 119.14 3.015 . . . . 55.93 119.14 175.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' B' ' 99' ' ' ASP . 17.4 p-10 -50.84 -29.4 11.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 120.109 -0.636 . . . . 71.04 109.484 -179.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' SER . . . . . 0.427 ' O ' ' NH2' ' B' ' 103' ' ' ARG . 17.9 m -113.37 38.1 2.99 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.904 0.859 . . . . 77.54 110.246 178.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLY . . . . . 0.482 ' O ' ' HA ' ' B' ' 98' ' ' ASN . . . 94.93 163.52 35.03 Favored Glycine 0 C--O 1.248 0.991 0 N-CA-C 107.245 -2.342 . . . . 65.31 107.245 -179.298 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' PRO . . . . . 0.868 ' HA ' ' ND2' ' B' ' 98' ' ' ASN . 78.7 Cg_endo -72.48 140.15 32.69 Favored 'Trans proline' 0 CA--C 1.498 -1.292 0 C-N-CA 124.465 3.444 . . . . 66.19 113.957 179.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.427 ' NH2' ' O ' ' B' ' 100' ' ' SER . 46.2 mmt-85 -129.46 -178.18 4.57 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 103.319 -2.845 . . . . 65.14 103.319 178.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.683 ' HD3' ' HA ' ' B' ' 11' ' ' PRO . 0.0 OUTLIER -108.89 125.81 52.4 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 103.016 -2.957 . . . . 85.83 103.016 173.044 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -113.47 128.08 56.32 Favored 'General case' 0 CA--C 1.483 -1.616 0 CA-C-N 116.439 -0.346 . . . . 33.21 110.323 -177.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 99.6 m -116.35 124.67 50.67 Favored 'General case' 0 C--O 1.252 1.23 0 N-CA-C 101.756 -3.424 . . . . 22.92 101.756 173.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 44.4 mm -107.29 122.04 60.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 103.731 -2.692 . . . . 26.61 103.731 176.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -113.73 144.41 43.0 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.234 -1.395 . . . . 22.47 107.234 178.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -132.61 137.95 47.22 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 106.483 -1.673 . . . . 21.06 106.483 178.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 59.0 tp -117.86 122.81 44.32 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 103.261 -2.866 . . . . 24.35 103.261 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 13.9 mt -111.6 142.83 43.41 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 119.027 2.973 . . . . 19.25 119.027 -174.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 35.9 m -138.99 160.79 61.29 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 104.551 -2.388 . . . . 23.39 104.551 174.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -53.74 -43.72 55.4 Favored 'Trans proline' 0 C--O 1.243 0.747 0 N-CA-C 116.18 1.569 . . . . 19.5 116.18 -179.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -111.05 17.05 20.8 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 115.484 1.661 . . . . 36.62 115.484 -178.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 48.1 t -161.94 153.96 19.21 Favored 'General case' 0 CA--C 1.492 -1.258 0 C-N-CA 118.745 -1.182 . . . . 22.24 111.94 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 29.6 p90 -153.7 151.87 30.14 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-O 121.98 0.895 . . . . 31.24 111.655 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 84.0 p -129.69 150.74 50.87 Favored 'General case' 0 N--CA 1.424 -1.759 0 N-CA-C 105.001 -2.222 . . . . 33.69 105.001 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 5.8 t -140.04 138.39 35.36 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 106.466 -1.679 . . . . 20.08 106.466 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' THR . . . . . 0.637 HG23 ' O ' ' B' ' 149' ' ' HOH . 0.1 OUTLIER -135.78 148.86 48.93 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 121.169 0.509 . . . . 33.01 109.976 178.2 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -109.36 125.18 52.08 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.012 -0.995 . . . . 24.63 111.008 -178.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 48.5 t -108.13 109.99 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 105.246 -2.131 . . . . 26.31 105.246 175.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 85.2 t -104.38 127.29 58.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.169 -0.612 . . . . 32.99 111.266 -179.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 58.2 p . . . . . 0 C--O 1.25 1.092 0 N-CA-C 109.287 -0.635 . . . . 51.81 109.287 178.991 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . 0.946 ' O ' ' HB2' ' A' ' 74' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . 0.485 ' O ' ' NH2' ' A' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . 0.667 ' O ' ' HD2' ' A' ' 31' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . 0.583 ' O ' HG23 ' A' ' 119' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' HOH . . . . . 0.559 ' O ' ' NH2' ' B' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' HOH . . . . . 0.637 ' O ' HG23 ' B' ' 119' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_