data_1bmg_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 1bmg _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.5 mt . . . . . 0 N--CA 1.499 2.024 0 N-CA-C 107.69 -1.226 . . . . 51.15 107.69 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 38.22 82.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 114.539 1.311 . . . . 57.83 114.539 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -123.13 129.78 24.82 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 105.152 -2.166 . . . . 48.32 105.152 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -74.26 152.47 44.74 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.195 2.596 . . . . 20.59 110.975 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -80.61 147.26 17.43 Favored 'Trans proline' 0 C--O 1.242 0.709 0 C-N-CA 117.994 -0.871 . . . . 25.29 112.798 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -103.73 136.51 43.28 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 100.802 -3.777 . . . . 53.5 100.802 176.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 5.1 mt -125.19 148.26 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 115.036 1.495 . . . . 26.94 115.036 -176.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -138.75 111.85 7.94 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.865 -0.791 . . . . 38.96 108.865 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 21.9 t -102.78 123.47 56.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 N-CA-C 107.085 -1.45 . . . . 23.67 107.085 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -158.26 166.44 32.34 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.095 -0.642 . . . . 22.04 110.237 -176.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.9 p -105.87 148.72 27.26 Favored 'General case' 0 C--O 1.239 0.501 0 O-C-N 123.925 0.766 . . . . 22.74 111.13 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ARG . . . . . 0.794 HH21 ' H1 ' ' A' ' 212' ' ' HOH . 43.7 ttm180 -56.72 -44.71 81.86 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 114.036 1.124 . . . . 22.46 114.036 179.421 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HIS . . . . . 0.763 ' H ' HD21 ' A' ' 21' ' ' ASN . 97.1 m-70 -126.15 155.17 74.03 Favored Pre-proline 0 CA--C 1.502 -0.867 0 N-CA-C 108.546 -0.909 . . . . 35.38 108.546 -177.523 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -57.59 125.58 19.18 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 N-CA-C 104.733 -2.833 . . . . 43.63 104.733 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -72.25 145.7 44.17 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 123.284 2.656 . . . . 48.47 118.793 -179.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -142.68 132.73 24.43 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 104.596 -2.372 . . . . 79.79 104.596 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -56.76 113.94 1.86 Allowed 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.82 -0.808 . . . . 69.39 108.82 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 124.0 -60.28 0.6 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.523 -0.846 . . . . 51.18 114.152 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -64.54 128.23 93.19 Favored Pre-proline 0 C--O 1.235 0.302 0 N-CA-C 112.047 0.388 . . . . 76.84 112.047 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -63.62 127.14 19.04 Favored 'Trans proline' 0 CA--C 1.517 -0.342 0 C-N-CA 122.131 1.887 . . . . 40.88 110.464 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . 0.763 HD21 ' H ' ' A' ' 13' ' ' HIS . 0.1 OUTLIER -116.37 -149.11 0.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 33.3 110.11 -179.781 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TYR . . . . . 0.728 ' N ' HD22 ' A' ' 21' ' ' ASN . 4.2 m-85 -158.75 130.12 6.39 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 105.241 -2.133 . . . . 34.27 105.241 -179.124 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 tp -109.06 123.29 48.93 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 107.783 -1.192 . . . . 25.56 107.783 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.8 m120 -113.73 146.36 39.98 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.873 -0.603 . . . . 25.05 109.642 -178.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.7 t -126.09 105.01 8.56 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 106.41 -1.7 . . . . 20.39 106.41 176.838 175.823 163.438 -83.291 104.157 2.033 104.0 169.389 -176.195 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -93.53 121.23 34.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.407 0.622 . . . . 20.98 111.903 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.6 t -123.45 131.14 73.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.029 -0.73 . . . . 21.29 109.029 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.2 p90 -153.72 -176.31 5.77 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 114.355 1.243 . . . . 20.98 114.355 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.08 27.16 62.09 Favored Glycine 0 C--N 1.331 0.287 0 N-CA-C 117.216 1.646 . . . . 19.2 117.216 178.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -112.94 166.17 11.65 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.551 0.945 . . . . 13.97 113.551 -178.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -170.42 137.75 1.3 Allowed Pre-proline 0 C--O 1.217 -0.629 0 CA-C-N 115.349 -0.841 . . . . 17.34 109.163 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -64.25 160.46 66.74 Favored 'Cis proline' 0 CA--C 1.541 0.873 0 C-N-CA 130.454 1.439 . . . . 18.45 112.561 0.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -57.47 -32.34 93.84 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 124.795 3.663 . . . . 26.73 119.913 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -59.82 121.37 11.54 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 108.687 -0.857 . . . . 24.7 108.687 179.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 15.5 tt -154.2 144.58 13.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 108.278 -1.008 . . . . 19.19 108.278 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -116.36 136.85 52.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.265 -0.643 . . . . 53.34 109.265 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 39.2 mt -131.33 117.09 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.626 -0.261 . . . . 20.97 111.431 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -113.17 140.97 47.48 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.267 -0.642 . . . . 42.47 109.267 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 92.7 mt -99.06 137.67 37.26 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 103.767 -2.679 . . . . 32.24 103.767 178.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.1 mt -123.37 141.72 51.7 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 115.461 1.652 . . . . 26.46 115.461 -177.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -121.05 115.36 22.99 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 103.691 -2.707 . . . . 42.37 103.691 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 53.82 32.26 14.66 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 121.154 -0.218 . . . . 26.46 111.438 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.41 -23.34 36.63 Favored Glycine 0 C--O 1.222 -0.608 0 N-CA-C 119.266 2.466 . . . . 28.08 119.266 178.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -101.39 153.79 19.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 118.944 1.372 . . . . 46.0 107.652 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -81.6 162.08 23.25 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 116.494 2.035 . . . . 62.5 116.494 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.4 pt -130.15 -129.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.649 0 N-CA-C 118.675 2.843 . . . . 45.65 118.675 -177.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . 0.483 ' HZ2' ' H ' ' A' ' 68' ' ' GLU . 40.0 mtpt -69.69 106.85 3.22 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 116.729 2.122 . . . . 52.28 116.729 -178.765 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.9 m -78.88 40.6 0.4 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 115.543 1.682 . . . . 54.47 115.543 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -71.49 94.18 1.26 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 119.723 -0.791 . . . . 58.51 109.315 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -106.42 144.45 33.08 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.782 1.401 . . . . 46.05 114.782 -177.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 93.2 p -80.84 -179.51 7.33 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.222 -0.658 . . . . 36.61 109.222 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -91.71 141.78 28.32 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.441 -0.578 . . . . 44.89 109.441 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.28 126.08 25.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.432 -0.804 . . . . 27.68 111.002 -179.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.8 m -127.23 161.05 29.46 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.809 0.693 . . . . 53.4 110.647 179.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -136.17 148.29 48.08 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.241 0.543 . . . . 28.56 111.179 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.0 t -151.43 149.53 29.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.759 -0.655 . . . . 37.88 111.246 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -55.45 -40.54 71.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.452 -0.794 . . . . 60.44 110.878 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -83.94 -18.27 37.88 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 120.796 3.628 . . . . 41.06 120.796 -177.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -139.72 28.23 2.19 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.41 0.55 . . . . 35.84 111.958 178.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m 43.7 -128.96 0.84 Allowed 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.012 0.525 . . . . 36.48 110.16 -179.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -89.74 146.95 24.13 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 108.07 -1.085 . . . . 25.38 108.07 178.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -149.18 154.14 38.7 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.246 -0.434 . . . . 20.47 111.726 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.9 mt -142.33 164.35 30.37 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.015 -0.539 . . . . 19.21 110.032 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.5 tp -143.02 118.24 10.17 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.03 -1.1 . . . . 22.99 108.03 178.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.7 t -110.94 140.4 45.46 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 103.732 -2.692 . . . . 26.23 103.732 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.2 p-80 -153.14 155.44 36.74 Favored 'General case' 0 CA--C 1.508 -0.657 0 C-N-CA 120.237 -0.585 . . . . 34.3 111.835 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -148.94 151.93 35.48 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.274 -1.01 . . . . 14.75 108.274 -179.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . 0.483 ' H ' ' HZ2' ' A' ' 47' ' ' LYS . 9.8 pt-20 -84.21 138.48 32.94 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 103.396 -2.816 . . . . 43.95 103.396 177.756 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -152.91 155.12 36.41 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.636 -0.426 . . . . 34.31 110.311 -179.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 58.2 m -115.12 117.49 41.35 Favored Pre-proline 0 N--CA 1.441 -0.877 0 CA-C-O 121.311 0.577 . . . . 37.75 109.91 179.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -62.88 142.36 88.14 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 124.019 3.146 . . . . 41.27 113.409 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -145.88 157.16 43.92 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 103.129 -2.915 . . . . 62.72 103.129 179.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.4 p -78.89 0.22 28.12 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.817 0.303 . . . . 54.03 111.817 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -113.95 -25.18 8.7 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 116.436 2.013 . . . . 68.62 116.436 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -92.5 132.84 36.47 Favored 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 119.915 -0.714 . . . . 48.98 109.41 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -119.19 143.13 47.42 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 123.505 0.503 . . . . 49.5 110.242 177.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -121.28 167.35 12.83 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 112.708 0.633 . . . . 32.5 112.708 -178.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 96.7 p -168.14 162.51 13.03 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.451 -0.795 . . . . 23.32 109.84 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.1 t -111.07 132.29 54.37 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.918 -0.771 . . . . 27.87 108.918 179.673 -176.195 169.389 -83.291 104.0 2.033 104.157 163.438 175.823 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 37.2 ttp180 -112.96 124.12 51.89 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 108.859 -0.793 . . . . 41.3 108.859 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 94.3 t -119.92 135.27 60.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 115.794 -0.639 . . . . 18.29 110.433 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -122.08 112.75 18.62 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 110.261 -0.274 . . . . 56.87 110.261 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -136.95 148.44 46.96 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 123.412 0.685 . . . . 22.11 109.904 -178.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 19.5 m -55.91 -7.24 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 115.398 1.629 . . . . 34.08 115.398 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.0 p -95.18 -10.51 30.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.086 0.47 . . . . 36.58 109.796 -179.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 47.2 mt -108.57 114.81 28.94 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.342 -1.355 . . . . 29.62 107.342 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -59.48 -35.28 73.8 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.471 0.653 . . . . 76.17 110.302 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -134.35 135.19 23.48 Favored Pre-proline 0 C--N 1.33 -0.248 0 N-CA-C 105.181 -2.155 . . . . 70.56 105.181 179.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -47.34 117.94 2.59 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 124.215 3.277 . . . . 34.82 113.143 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 40.6 ttt180 -73.54 137.25 44.25 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.166 0.432 . . . . 46.13 112.166 -179.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.0 mt -125.01 118.58 53.48 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.329 0 C-N-CA 122.889 0.476 . . . . 21.08 112.073 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.1 m -111.63 127.67 68.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 106.647 -1.612 . . . . 26.19 106.647 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -86.16 148.75 25.53 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.347 -0.842 . . . . 62.83 112.464 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -80.11 106.62 12.27 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.835 -0.802 . . . . 28.27 108.835 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -93.56 126.14 38.55 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 104.234 -2.506 . . . . 54.82 104.234 177.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -103.06 35.28 2.58 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 115.146 1.536 . . . . 64.72 115.146 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -134.55 6.68 3.52 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.49 -0.929 . . . . 72.44 108.49 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 95.7 mt . . . . . 0 C--O 1.246 0.881 0 CA-C-N 114.69 -1.141 . . . . 66.56 108.873 -179.199 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . 0.638 ' H1 ' HH11 ' A' ' 12' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . 0.794 ' H1 ' HH21 ' A' ' 12' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ILE . . . . . 0.608 HG22 ' H ' ' A' ' 2' ' ' GLN . 1.5 mt . . . . . 0 N--CA 1.499 2.024 0 N-CA-C 107.69 -1.226 . . . . 51.15 107.69 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLN . . . . . 0.608 ' H ' HG22 ' A' ' 1' ' ' ILE . 41.0 mm-40 38.22 82.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 114.539 1.311 . . . . 57.83 114.539 179.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -123.13 129.78 24.82 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 105.152 -2.166 . . . . 48.32 105.152 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -74.26 152.47 44.74 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.195 2.596 . . . . 20.59 110.975 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -80.61 147.26 17.43 Favored 'Trans proline' 0 C--O 1.242 0.709 0 C-N-CA 117.994 -0.871 . . . . 25.29 112.798 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -103.73 136.51 43.28 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 100.802 -3.777 . . . . 53.5 100.802 176.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . 0.45 HG21 HG21 ' A' ' 92' ' ' VAL . 5.1 mt -125.19 148.26 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 115.036 1.495 . . . . 26.94 115.036 -176.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -138.75 111.85 7.94 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.865 -0.791 . . . . 38.96 108.865 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . 0.626 HG21 HG23 ' A' ' 92' ' ' VAL . 21.9 t -102.78 123.47 56.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 N-CA-C 107.085 -1.45 . . . . 23.67 107.085 178.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -158.26 166.44 32.34 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.095 -0.642 . . . . 22.04 110.237 -176.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.9 p -105.87 148.72 27.26 Favored 'General case' 0 C--O 1.239 0.501 0 O-C-N 123.925 0.766 . . . . 22.74 111.13 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -56.72 -44.71 81.86 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 114.036 1.124 . . . . 22.46 114.036 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -126.15 155.17 74.03 Favored Pre-proline 0 CA--C 1.502 -0.867 0 N-CA-C 108.546 -0.909 . . . . 35.38 108.546 -177.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -57.59 125.58 19.18 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 N-CA-C 104.733 -2.833 . . . . 43.63 104.733 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PRO . . . . . 0.407 ' HA ' ' O ' ' A' ' 202' ' ' HOH . 26.2 Cg_endo -72.25 145.7 44.17 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 123.284 2.656 . . . . 48.47 118.793 -179.062 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -142.68 132.73 24.43 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 104.596 -2.372 . . . . 79.79 104.596 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -56.76 113.94 1.86 Allowed 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.82 -0.808 . . . . 69.39 108.82 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 124.0 -60.28 0.6 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.523 -0.846 . . . . 51.18 114.152 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -64.54 128.23 93.19 Favored Pre-proline 0 C--O 1.235 0.302 0 N-CA-C 112.047 0.388 . . . . 76.84 112.047 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -63.62 127.14 19.04 Favored 'Trans proline' 0 CA--C 1.517 -0.342 0 C-N-CA 122.131 1.887 . . . . 40.88 110.464 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . 0.6 ' HB3' ' CE1' ' A' ' 69' ' ' PHE . 4.2 t-20 -116.37 -149.11 0.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 33.3 110.11 -179.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -158.75 130.12 6.39 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 105.241 -2.133 . . . . 34.27 105.241 -179.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 tp -109.06 123.29 48.93 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 107.783 -1.192 . . . . 25.56 107.783 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASN . . . . . 0.701 ' HB3' HD11 ' A' ' 64' ' ' LEU . 30.4 m-80 -113.73 146.36 39.98 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.873 -0.603 . . . . 25.05 109.642 -178.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.7 t -126.09 105.01 8.56 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 106.41 -1.7 . . . . 20.39 106.41 176.838 175.823 163.438 -83.291 104.157 2.033 104.0 169.389 -176.195 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -93.53 121.23 34.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.407 0.622 . . . . 20.98 111.903 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.6 t -123.45 131.14 73.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.029 -0.73 . . . . 21.29 109.029 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.2 p90 -153.72 -176.31 5.77 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 114.355 1.243 . . . . 20.98 114.355 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.08 27.16 62.09 Favored Glycine 0 C--N 1.331 0.287 0 N-CA-C 117.216 1.646 . . . . 19.2 117.216 178.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -112.94 166.17 11.65 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.551 0.945 . . . . 13.97 113.551 -178.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -170.42 137.75 1.3 Allowed Pre-proline 0 C--O 1.217 -0.629 0 CA-C-N 115.349 -0.841 . . . . 17.34 109.163 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -64.25 160.46 66.74 Favored 'Cis proline' 0 CA--C 1.541 0.873 0 C-N-CA 130.454 1.439 . . . . 18.45 112.561 0.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -57.47 -32.34 93.84 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 124.795 3.663 . . . . 26.73 119.913 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -59.82 121.37 11.54 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 108.687 -0.857 . . . . 24.7 108.687 179.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 15.5 tt -154.2 144.58 13.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 108.278 -1.008 . . . . 19.19 108.278 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -116.36 136.85 52.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.265 -0.643 . . . . 53.34 109.265 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 39.2 mt -131.33 117.09 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.626 -0.261 . . . . 20.97 111.431 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -113.17 140.97 47.48 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.267 -0.642 . . . . 42.47 109.267 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 45' ' ' LYS . 92.7 mt -99.06 137.67 37.26 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 103.767 -2.679 . . . . 32.24 103.767 178.096 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . 0.476 HD21 ' NH1' ' A' ' 80' ' ' ARG . 47.1 mt -123.37 141.72 51.7 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 115.461 1.652 . . . . 26.46 115.461 -177.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -121.05 115.36 22.99 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 103.691 -2.707 . . . . 42.37 103.691 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 53.82 32.26 14.66 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 121.154 -0.218 . . . . 26.46 111.438 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.41 -23.34 36.63 Favored Glycine 0 C--O 1.222 -0.608 0 N-CA-C 119.266 2.466 . . . . 28.08 119.266 178.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -101.39 153.79 19.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 118.944 1.372 . . . . 46.0 107.652 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 39' ' ' LEU . 56.4 pttt -81.6 162.08 23.25 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 116.494 2.035 . . . . 62.5 116.494 -178.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.4 pt -130.15 -129.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.649 0 N-CA-C 118.675 2.843 . . . . 45.65 118.675 -177.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . 0.457 ' HB2' ' HB1' ' A' ' 67' ' ' ALA . 40.0 mtpt -69.69 106.85 3.22 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 116.729 2.122 . . . . 52.28 116.729 -178.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' SER . . . . . 0.542 ' HA ' ' O ' ' A' ' 215' ' ' HOH . 50.9 m -78.88 40.6 0.4 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 115.543 1.682 . . . . 54.47 115.543 -179.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -71.49 94.18 1.26 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 119.723 -0.791 . . . . 58.51 109.315 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -106.42 144.45 33.08 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.782 1.401 . . . . 46.05 114.782 -177.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 93.2 p -80.84 -179.51 7.33 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.222 -0.658 . . . . 36.61 109.222 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -91.71 141.78 28.32 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.441 -0.578 . . . . 44.89 109.441 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.28 126.08 25.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.432 -0.804 . . . . 27.68 111.002 -179.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.8 m -127.23 161.05 29.46 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.809 0.693 . . . . 53.4 110.647 179.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -136.17 148.29 48.08 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.241 0.543 . . . . 28.56 111.179 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.0 t -151.43 149.53 29.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.759 -0.655 . . . . 37.88 111.246 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -55.45 -40.54 71.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.452 -0.794 . . . . 60.44 110.878 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -83.94 -18.27 37.88 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 120.796 3.628 . . . . 41.06 120.796 -177.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -139.72 28.23 2.19 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.41 0.55 . . . . 35.84 111.958 178.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m 43.7 -128.96 0.84 Allowed 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.012 0.525 . . . . 36.48 110.16 -179.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -89.74 146.95 24.13 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 108.07 -1.085 . . . . 25.38 108.07 178.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -149.18 154.14 38.7 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.246 -0.434 . . . . 20.47 111.726 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.9 mt -142.33 164.35 30.37 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.015 -0.539 . . . . 19.21 110.032 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . 0.701 HD11 ' HB3' ' A' ' 24' ' ' ASN . 1.5 tp -143.02 118.24 10.17 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.03 -1.1 . . . . 22.99 108.03 178.181 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.7 t -110.94 140.4 45.46 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 103.732 -2.692 . . . . 26.23 103.732 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.2 p-80 -153.14 155.44 36.74 Favored 'General case' 0 CA--C 1.508 -0.657 0 C-N-CA 120.237 -0.585 . . . . 34.3 111.835 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . 0.457 ' HB1' ' HB2' ' A' ' 47' ' ' LYS . . . -148.94 151.93 35.48 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.274 -1.01 . . . . 14.75 108.274 -179.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -84.21 138.48 32.94 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 103.396 -2.816 . . . . 43.95 103.396 177.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' PHE . . . . . 0.6 ' CE1' ' HB3' ' A' ' 21' ' ' ASN . 1.4 p90 -152.91 155.12 36.41 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.636 -0.426 . . . . 34.31 110.311 -179.023 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 58.2 m -115.12 117.49 41.35 Favored Pre-proline 0 N--CA 1.441 -0.877 0 CA-C-O 121.311 0.577 . . . . 37.75 109.91 179.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -62.88 142.36 88.14 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 124.019 3.146 . . . . 41.27 113.409 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -145.88 157.16 43.92 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 103.129 -2.915 . . . . 62.72 103.129 179.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.4 p -78.89 0.22 28.12 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.817 0.303 . . . . 54.03 111.817 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -113.95 -25.18 8.7 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 116.436 2.013 . . . . 68.62 116.436 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -92.5 132.84 36.47 Favored 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 119.915 -0.714 . . . . 48.98 109.41 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -119.19 143.13 47.42 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 123.505 0.503 . . . . 49.5 110.242 177.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -121.28 167.35 12.83 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 112.708 0.633 . . . . 32.5 112.708 -178.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 96.7 p -168.14 162.51 13.03 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.451 -0.795 . . . . 23.32 109.84 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.1 t -111.07 132.29 54.37 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.918 -0.771 . . . . 27.87 108.918 179.673 -176.195 169.389 -83.291 104.0 2.033 104.157 163.438 175.823 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . 0.476 ' NH1' HD21 ' A' ' 40' ' ' LEU . 37.2 ttp180 -112.96 124.12 51.89 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 108.859 -0.793 . . . . 41.3 108.859 179.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 94.3 t -119.92 135.27 60.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 115.794 -0.639 . . . . 18.29 110.433 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -122.08 112.75 18.62 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 110.261 -0.274 . . . . 56.87 110.261 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -136.95 148.44 46.96 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 123.412 0.685 . . . . 22.11 109.904 -178.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 19.5 m -55.91 -7.24 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 115.398 1.629 . . . . 34.08 115.398 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' THR . . . . . 0.48 HG22 ' OE1' ' A' ' 2' ' ' GLN . 42.0 p -95.18 -10.51 30.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.086 0.47 . . . . 36.58 109.796 -179.452 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 47.2 mt -108.57 114.81 28.94 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.342 -1.355 . . . . 29.62 107.342 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -59.48 -35.28 73.8 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.471 0.653 . . . . 76.17 110.302 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -134.35 135.19 23.48 Favored Pre-proline 0 C--N 1.33 -0.248 0 N-CA-C 105.181 -2.155 . . . . 70.56 105.181 179.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -47.34 117.94 2.59 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 124.215 3.277 . . . . 34.82 113.143 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 40.6 ttt180 -73.54 137.25 44.25 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.166 0.432 . . . . 46.13 112.166 -179.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.0 mt -125.01 118.58 53.48 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.329 0 C-N-CA 122.889 0.476 . . . . 21.08 112.073 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . 0.626 HG23 HG21 ' A' ' 9' ' ' VAL . 18.1 m -111.63 127.67 68.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 106.647 -1.612 . . . . 26.19 106.647 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -86.16 148.75 25.53 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.347 -0.842 . . . . 62.83 112.464 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -80.11 106.62 12.27 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.835 -0.802 . . . . 28.27 108.835 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . 0.431 ' HB3' HD12 ' A' ' 98' ' ' LEU . 27.7 t0 -93.56 126.14 38.55 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 104.234 -2.506 . . . . 54.82 104.234 177.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -103.06 35.28 2.58 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 115.146 1.536 . . . . 64.72 115.146 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -134.55 6.68 3.52 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.49 -0.929 . . . . 72.44 108.49 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 95' ' ' ASP . 95.7 mt . . . . . 0 C--O 1.246 0.881 0 CA-C-N 114.69 -1.141 . . . . 66.56 108.873 -179.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . 0.407 ' O ' ' HA ' ' A' ' 15' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . 0.542 ' O ' ' HA ' ' A' ' 48' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.608 HG22 ' H ' ' A' ' 2' ' ' GLN . 1.5 mt . . . . . 0 N--CA 1.499 2.024 0 N-CA-C 107.69 -1.226 . . . . 51.15 107.69 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.627 ' NE2' HG22 ' A' ' 85' ' ' THR . 2.7 mm100 38.22 82.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 114.539 1.311 . . . . 57.83 114.539 179.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -123.13 129.78 24.82 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 105.152 -2.166 . . . . 48.32 105.152 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -74.26 152.47 44.74 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.195 2.596 . . . . 20.59 110.975 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -80.61 147.26 17.43 Favored 'Trans proline' 0 C--O 1.242 0.709 0 C-N-CA 117.994 -0.871 . . . . 25.29 112.798 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -103.73 136.51 43.28 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 100.802 -3.777 . . . . 53.5 100.802 176.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.45 HG21 HG21 ' A' ' 92' ' ' VAL . 5.1 mt -125.19 148.26 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 115.036 1.495 . . . . 26.94 115.036 -176.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -138.75 111.85 7.94 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.865 -0.791 . . . . 38.96 108.865 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.626 HG21 HG23 ' A' ' 92' ' ' VAL . 21.9 t -102.78 123.47 56.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 N-CA-C 107.085 -1.45 . . . . 23.67 107.085 178.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -158.26 166.44 32.34 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.095 -0.642 . . . . 22.04 110.237 -176.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.9 p -105.87 148.72 27.26 Favored 'General case' 0 C--O 1.239 0.501 0 O-C-N 123.925 0.766 . . . . 22.74 111.13 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -56.72 -44.71 81.86 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 114.036 1.124 . . . . 22.46 114.036 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.636 ' H ' HD21 ' A' ' 21' ' ' ASN . 97.1 m-70 -126.15 155.17 74.03 Favored Pre-proline 0 CA--C 1.502 -0.867 0 N-CA-C 108.546 -0.909 . . . . 35.38 108.546 -177.523 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -57.59 125.58 19.18 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 N-CA-C 104.733 -2.833 . . . . 43.63 104.733 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.407 ' HA ' ' O ' ' A' ' 202' ' ' HOH . 26.2 Cg_endo -72.25 145.7 44.17 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 123.284 2.656 . . . . 48.47 118.793 -179.062 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -142.68 132.73 24.43 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 104.596 -2.372 . . . . 79.79 104.596 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -56.76 113.94 1.86 Allowed 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.82 -0.808 . . . . 69.39 108.82 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 124.0 -60.28 0.6 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.523 -0.846 . . . . 51.18 114.152 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -64.54 128.23 93.19 Favored Pre-proline 0 C--O 1.235 0.302 0 N-CA-C 112.047 0.388 . . . . 76.84 112.047 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -63.62 127.14 19.04 Favored 'Trans proline' 0 CA--C 1.517 -0.342 0 C-N-CA 122.131 1.887 . . . . 40.88 110.464 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.762 HD22 ' H ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -116.37 -149.11 0.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 33.3 110.11 -179.781 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.762 ' H ' HD22 ' A' ' 21' ' ' ASN . 4.2 m-85 -158.75 130.12 6.39 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 105.241 -2.133 . . . . 34.27 105.241 -179.124 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 tp -109.06 123.29 48.93 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 107.783 -1.192 . . . . 25.56 107.783 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.701 ' HB3' HD11 ' A' ' 64' ' ' LEU . 20.8 m120 -113.73 146.36 39.98 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.873 -0.603 . . . . 25.05 109.642 -178.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.7 t -126.09 105.01 8.56 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 106.41 -1.7 . . . . 20.39 106.41 176.838 175.823 163.438 -83.291 104.157 2.033 104.0 169.389 -176.195 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -93.53 121.23 34.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.407 0.622 . . . . 20.98 111.903 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.6 t -123.45 131.14 73.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.029 -0.73 . . . . 21.29 109.029 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.2 p90 -153.72 -176.31 5.77 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 114.355 1.243 . . . . 20.98 114.355 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.08 27.16 62.09 Favored Glycine 0 C--N 1.331 0.287 0 N-CA-C 117.216 1.646 . . . . 19.2 117.216 178.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -112.94 166.17 11.65 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.551 0.945 . . . . 13.97 113.551 -178.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -170.42 137.75 1.3 Allowed Pre-proline 0 C--O 1.217 -0.629 0 CA-C-N 115.349 -0.841 . . . . 17.34 109.163 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -64.25 160.46 66.74 Favored 'Cis proline' 0 CA--C 1.541 0.873 0 C-N-CA 130.454 1.439 . . . . 18.45 112.561 0.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -57.47 -32.34 93.84 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 124.795 3.663 . . . . 26.73 119.913 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -59.82 121.37 11.54 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 108.687 -0.857 . . . . 24.7 108.687 179.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 15.5 tt -154.2 144.58 13.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 108.278 -1.008 . . . . 19.19 108.278 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -116.36 136.85 52.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.265 -0.643 . . . . 53.34 109.265 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 39.2 mt -131.33 117.09 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.626 -0.261 . . . . 20.97 111.431 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -113.17 140.97 47.48 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.267 -0.642 . . . . 42.47 109.267 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 45' ' ' LYS . 92.7 mt -99.06 137.67 37.26 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 103.767 -2.679 . . . . 32.24 103.767 178.096 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.476 HD21 ' NH1' ' A' ' 80' ' ' ARG . 47.1 mt -123.37 141.72 51.7 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 115.461 1.652 . . . . 26.46 115.461 -177.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -121.05 115.36 22.99 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 103.691 -2.707 . . . . 42.37 103.691 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 53.82 32.26 14.66 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 121.154 -0.218 . . . . 26.46 111.438 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.41 -23.34 36.63 Favored Glycine 0 C--O 1.222 -0.608 0 N-CA-C 119.266 2.466 . . . . 28.08 119.266 178.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -101.39 153.79 19.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 118.944 1.372 . . . . 46.0 107.652 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 39' ' ' LEU . 56.4 pttt -81.6 162.08 23.25 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 116.494 2.035 . . . . 62.5 116.494 -178.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.4 pt -130.15 -129.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.649 0 N-CA-C 118.675 2.843 . . . . 45.65 118.675 -177.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.457 ' HB2' ' HB1' ' A' ' 67' ' ' ALA . 40.0 mtpt -69.69 106.85 3.22 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 116.729 2.122 . . . . 52.28 116.729 -178.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' SER . . . . . 0.542 ' HA ' ' O ' ' A' ' 215' ' ' HOH . 50.9 m -78.88 40.6 0.4 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 115.543 1.682 . . . . 54.47 115.543 -179.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -71.49 94.18 1.26 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 119.723 -0.791 . . . . 58.51 109.315 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -106.42 144.45 33.08 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.782 1.401 . . . . 46.05 114.782 -177.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 93.2 p -80.84 -179.51 7.33 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.222 -0.658 . . . . 36.61 109.222 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -91.71 141.78 28.32 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.441 -0.578 . . . . 44.89 109.441 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.28 126.08 25.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.432 -0.804 . . . . 27.68 111.002 -179.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.8 m -127.23 161.05 29.46 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.809 0.693 . . . . 53.4 110.647 179.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -136.17 148.29 48.08 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.241 0.543 . . . . 28.56 111.179 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.0 t -151.43 149.53 29.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.759 -0.655 . . . . 37.88 111.246 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -55.45 -40.54 71.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.452 -0.794 . . . . 60.44 110.878 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -83.94 -18.27 37.88 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 120.796 3.628 . . . . 41.06 120.796 -177.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -139.72 28.23 2.19 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.41 0.55 . . . . 35.84 111.958 178.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m 43.7 -128.96 0.84 Allowed 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.012 0.525 . . . . 36.48 110.16 -179.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -89.74 146.95 24.13 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 108.07 -1.085 . . . . 25.38 108.07 178.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -149.18 154.14 38.7 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.246 -0.434 . . . . 20.47 111.726 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.9 mt -142.33 164.35 30.37 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 116.015 -0.539 . . . . 19.21 110.032 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.701 HD11 ' HB3' ' A' ' 24' ' ' ASN . 1.5 tp -143.02 118.24 10.17 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.03 -1.1 . . . . 22.99 108.03 178.181 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.7 t -110.94 140.4 45.46 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 103.732 -2.692 . . . . 26.23 103.732 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.542 ' HB3' HD22 ' A' ' 24' ' ' ASN . 52.2 p-80 -153.14 155.44 36.74 Favored 'General case' 0 CA--C 1.508 -0.657 0 C-N-CA 120.237 -0.585 . . . . 34.3 111.835 -179.347 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.457 ' HB1' ' HB2' ' A' ' 47' ' ' LYS . . . -148.94 151.93 35.48 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.274 -1.01 . . . . 14.75 108.274 -179.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -84.21 138.48 32.94 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 103.396 -2.816 . . . . 43.95 103.396 177.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.6 ' CE1' ' HB3' ' A' ' 21' ' ' ASN . 1.4 p90 -152.91 155.12 36.41 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.636 -0.426 . . . . 34.31 110.311 -179.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 58.2 m -115.12 117.49 41.35 Favored Pre-proline 0 N--CA 1.441 -0.877 0 CA-C-O 121.311 0.577 . . . . 37.75 109.91 179.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -62.88 142.36 88.14 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 124.019 3.146 . . . . 41.27 113.409 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -145.88 157.16 43.92 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 103.129 -2.915 . . . . 62.72 103.129 179.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.4 p -78.89 0.22 28.12 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.817 0.303 . . . . 54.03 111.817 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -113.95 -25.18 8.7 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 116.436 2.013 . . . . 68.62 116.436 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -92.5 132.84 36.47 Favored 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 119.915 -0.714 . . . . 48.98 109.41 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -119.19 143.13 47.42 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 123.505 0.503 . . . . 49.5 110.242 177.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -121.28 167.35 12.83 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 112.708 0.633 . . . . 32.5 112.708 -178.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 96.7 p -168.14 162.51 13.03 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.451 -0.795 . . . . 23.32 109.84 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.1 t -111.07 132.29 54.37 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.918 -0.771 . . . . 27.87 108.918 179.673 -176.195 169.389 -83.291 104.0 2.033 104.157 163.438 175.823 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.476 ' NH1' HD21 ' A' ' 40' ' ' LEU . 37.2 ttp180 -112.96 124.12 51.89 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 108.859 -0.793 . . . . 41.3 108.859 179.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 94.3 t -119.92 135.27 60.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 115.794 -0.639 . . . . 18.29 110.433 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -122.08 112.75 18.62 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 110.261 -0.274 . . . . 56.87 110.261 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -136.95 148.44 46.96 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 123.412 0.685 . . . . 22.11 109.904 -178.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 19.5 m -55.91 -7.24 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 115.398 1.629 . . . . 34.08 115.398 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' THR . . . . . 0.627 HG22 ' NE2' ' A' ' 2' ' ' GLN . 42.0 p -95.18 -10.51 30.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.086 0.47 . . . . 36.58 109.796 -179.452 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 47.2 mt -108.57 114.81 28.94 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.342 -1.355 . . . . 29.62 107.342 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -59.48 -35.28 73.8 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.471 0.653 . . . . 76.17 110.302 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -134.35 135.19 23.48 Favored Pre-proline 0 C--N 1.33 -0.248 0 N-CA-C 105.181 -2.155 . . . . 70.56 105.181 179.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -47.34 117.94 2.59 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 124.215 3.277 . . . . 34.82 113.143 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 40.6 ttt180 -73.54 137.25 44.25 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.166 0.432 . . . . 46.13 112.166 -179.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.0 mt -125.01 118.58 53.48 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.329 0 C-N-CA 122.889 0.476 . . . . 21.08 112.073 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.626 HG23 HG21 ' A' ' 9' ' ' VAL . 18.1 m -111.63 127.67 68.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 106.647 -1.612 . . . . 26.19 106.647 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -86.16 148.75 25.53 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.347 -0.842 . . . . 62.83 112.464 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -80.11 106.62 12.27 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.835 -0.802 . . . . 28.27 108.835 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.431 ' HB3' HD12 ' A' ' 98' ' ' LEU . 27.7 t0 -93.56 126.14 38.55 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 104.234 -2.506 . . . . 54.82 104.234 177.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -103.06 35.28 2.58 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 115.146 1.536 . . . . 64.72 115.146 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -134.55 6.68 3.52 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.49 -0.929 . . . . 72.44 108.49 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 95' ' ' ASP . 95.7 mt . . . . . 0 C--O 1.246 0.881 0 CA-C-N 114.69 -1.141 . . . . 66.56 108.873 -179.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . 0.407 ' O ' ' HA ' ' A' ' 15' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . 0.542 ' O ' ' HA ' ' A' ' 48' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_