data_1a3v_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 1a3v _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 ' 7' ' ' LEU . . . . . . . . . . . . . 44.5 mt . . . . . 0 N--CA 1.494 1.77 0 N-CA-C 108.346 -0.983 . . . . 49.81 108.346 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -126.48 132.68 51.37 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.238 -0.282 . . . . 65.02 110.238 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.0 mttm -85.99 153.14 22.37 Favored 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 120.382 -0.527 . . . . 37.58 110.776 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -139.63 147.1 50.61 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 108.343 -0.984 . . . . 52.93 108.343 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -69.38 158.39 57.64 Favored 'Trans proline' 0 CA--C 1.513 -0.543 0 C-N-CA 120.669 0.913 . . . . 32.71 112.231 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.39 165.3 33.53 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 106.049 -1.834 . . . . 33.46 106.049 177.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.5 m -129.57 134.4 47.72 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 108.605 -0.887 . . . . 27.65 108.605 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.0 130.93 42.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.401 0.62 . . . . 25.69 112.448 -179.539 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 47.1 mt -105.35 -54.56 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 106.021 -1.844 . . . . 26.37 106.021 176.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -161.28 129.53 4.37 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 114.617 1.34 . . . . 45.9 114.617 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -83.75 129.56 34.95 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.023 -1.473 . . . . 30.54 107.023 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 93.9 mt -96.11 -56.57 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 112.128 0.418 . . . . 31.54 112.128 -178.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -150.93 -169.95 3.53 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 106.026 -1.842 . . . . 35.92 106.026 177.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . 0.503 ' H ' ' H2 ' ' A' ' 204' ' ' HOH . . . -50.78 -31.28 23.31 Favored Glycine 0 C--O 1.221 -0.718 0 N-CA-C 118.421 2.128 . . . . 23.34 118.421 -178.777 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 45.5 p30 -128.91 9.21 5.78 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 117.211 2.3 . . . . 21.76 117.211 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 43.3 m -135.57 138.73 43.27 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 118.31 0.505 . . . . 19.62 110.013 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' C5C . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.47 123.77 48.59 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.823 -1.547 . . . . 52.32 106.823 179.115 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 84.8 mt -126.57 157.19 39.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.567 -0.742 . . . . 26.58 110.849 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' MET . . . . . 0.916 ' CE ' ' SD ' ' A' ' 26' ' ' MET . 0.9 OUTLIER -98.78 115.82 29.62 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 102.657 -3.09 . . . . 54.09 102.657 175.84 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -126.34 122.59 35.86 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 107.559 -1.274 . . . . 33.87 107.559 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm 58.42 46.58 14.99 Favored 'General case' 0 C--O 1.158 -3.725 0 CA-C-N 116.289 -0.414 . . . . 48.49 109.982 -177.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 55.61 12.94 5.29 Favored Glycine 1 N--CA 1.522 4.398 0 CA-C-N 111.208 -2.724 . . . . 45.61 108.787 -177.632 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . 0.305 0.1 OUTLIER -116.77 137.41 23.7 Favored Pre-proline 0 CA--C 1.592 2.579 0 CA-C-N 120.094 1.947 . . . . 63.82 111.609 178.158 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PRO . . . . . 0.432 ' N ' ' SD ' ' A' ' 26' ' ' MET . 38.3 Cg_endo -72.45 137.44 28.03 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.435 2.09 . . . . 36.6 110.954 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 32.4 mtp -152.33 147.22 26.06 Favored 'General case' 0 N--CA 1.44 -0.935 0 O-C-N 124.291 0.994 . . . . 40.54 110.772 -179.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.99 134.46 38.97 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 103.079 -2.934 . . . . 29.21 103.079 175.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -117.41 154.58 31.11 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.273 -0.64 . . . . 22.99 109.273 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 39.5 tpt85 -130.73 131.32 44.7 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 105.333 -2.099 . . . . 20.87 105.333 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.55 138.37 58.48 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 112.935 0.717 . . . . 25.83 112.935 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.7 mt -78.97 147.33 32.99 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 116.065 -0.516 . . . . 24.6 110.041 177.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . 0.727 ' H ' ' H2 ' ' A' ' 202' ' ' HOH . 25.4 mt 57.0 18.53 4.01 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 120.741 3.608 . . . . 25.25 120.741 176.358 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 25.1 m -141.02 163.76 21.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 120.092 -0.643 . . . . 24.8 111.654 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -148.1 110.84 4.75 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.207 -1.035 . . . . 37.96 108.207 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.5 p -89.43 154.41 48.69 Favored Pre-proline 0 C--O 1.238 0.472 0 N-CA-C 104.468 -2.419 . . . . 29.12 104.468 176.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -63.9 150.02 89.33 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 N-CA-C 114.475 0.914 . . . . 38.83 114.475 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -69.77 147.18 50.79 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 116.09 1.885 . . . . 42.98 116.09 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.6 p -135.31 -12.19 2.13 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 113.911 -1.495 . . . . 46.24 108.609 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -108.65 -74.73 0.65 Allowed 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 118.88 2.918 . . . . 56.97 118.88 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HIS . . . . . 0.474 ' HD1' ' N ' ' A' ' 48' ' ' LYS . 44.3 t-80 -44.86 115.94 2.61 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 115.198 1.555 . . . . 58.09 115.198 -177.555 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -55.07 -42.75 65.95 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 125.252 3.968 . . . . 63.19 114.13 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . 0.474 ' N ' ' HD1' ' A' ' 46' ' ' HIS . 30.2 mttp -83.81 54.84 3.02 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.222 -1.399 . . . . 81.47 107.222 179.834 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -173.36 -42.55 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 104.997 -2.223 . . . . 77.29 104.997 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 77.75 -177.14 53.3 Favored Glycine 0 C--N 1.332 0.349 0 CA-C-N 115.186 -0.915 . . . . 66.07 115.129 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 73.8 t -90.68 94.32 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 107.246 -1.39 . . . . 57.35 107.246 178.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -73.7 151.95 40.57 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.25 -0.886 . . . . 56.93 113.081 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -60.36 142.55 54.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.547 0.689 . . . . 61.62 110.36 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 76.6 -2.64 2.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.111 -0.95 . . . . 40.43 112.499 -179.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -65.46 -54.3 27.13 Favored Glycine 0 CA--C 1.508 -0.367 0 N-CA-C 109.062 -1.615 . . . . 32.14 109.062 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -62.56 -30.17 79.11 Favored 'Trans proline' 0 N--CA 1.475 0.426 0 C-N-CA 122.881 2.387 . . . . 31.18 111.629 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -71.05 -50.68 31.25 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.5 -0.555 . . . . 44.24 109.5 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.76 -37.75 74.19 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.596 -0.52 . . . . 25.69 109.596 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 m -64.0 -42.16 97.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.752 0.649 . . . . 26.18 112.752 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.39 -36.62 68.73 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.075 0.398 . . . . 28.8 112.075 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -61.66 -50.89 70.68 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 107.112 -1.44 . . . . 30.68 107.112 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 50.3 m -61.07 -48.07 83.42 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.272 -0.876 . . . . 28.35 112.317 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . 0.489 ' CD ' ' H1 ' ' A' ' 230' ' ' HOH . 61.0 tttm -56.7 -47.56 79.62 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 122.437 0.295 . . . . 45.34 110.722 -179.069 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -47.01 87.91 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 121.402 0.62 . . . . 53.87 111.442 179.852 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 26.2 ttt -61.43 -49.42 76.91 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 113.464 0.913 . . . . 42.44 113.464 -178.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.7 m -77.29 -32.53 19.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 115.054 1.502 . . . . 30.81 115.054 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -76.02 -23.48 55.19 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 114.618 1.34 . . . . 45.11 114.618 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.0 m120 -98.41 9.85 42.16 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.917 0.71 . . . . 42.24 112.917 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.48 145.51 27.38 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 121.921 0.867 . . . . 34.22 113.274 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -84.58 -33.92 23.29 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.305 -1.369 . . . . 31.55 107.305 177.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -136.23 136.41 39.87 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 113.859 1.059 . . . . 31.65 113.859 -178.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 53.4 mt -124.77 131.89 72.05 Favored 'Isoleucine or valine' 0 C--O 1.245 0.817 0 N-CA-C 107.188 -1.412 . . . . 29.0 107.188 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -131.44 144.68 51.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.978 -0.556 . . . . 33.72 110.215 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.0 m -111.95 136.6 47.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.791 0.805 . . . . 26.89 110.743 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -126.6 107.12 9.92 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.061 -0.972 . . . . 36.51 109.087 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PHE . . . . . 0.715 ' H ' ' H2 ' ' A' ' 207' ' ' HOH . 62.4 m-85 -77.94 152.39 33.23 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 106.892 -1.521 . . . . 28.1 106.892 -179.989 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . 0.791 ' H ' ' H2 ' ' A' ' 201' ' ' HOH . 7.9 t0 -88.59 -164.0 1.06 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 118.902 -1.119 . . . . 26.47 108.271 178.324 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.2 pttt -86.66 -2.75 58.77 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 117.792 2.515 . . . . 52.13 117.792 -177.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.82 -144.36 11.24 Favored Glycine 0 CA--C 1.521 0.413 0 N-CA-C 110.935 -0.866 . . . . 28.04 110.935 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -68.59 144.13 54.63 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.729 0.775 . . . . 42.3 112.166 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -94.86 -7.7 39.43 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 118.344 2.72 . . . . 48.95 118.344 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 74.0 p -135.13 150.64 50.22 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.628 -0.878 . . . . 27.73 108.628 178.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.6 p30 -93.78 -178.88 4.82 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 109.27 -0.641 . . . . 25.05 109.27 176.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . 0.471 ' HZ1' ' H2 ' ' A' ' 237' ' ' HOH . 30.0 pttt -58.46 -22.94 56.36 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 115.057 1.503 . . . . 42.26 115.057 -178.428 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -90.2 8.32 33.62 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.085 0.554 . . . . 31.71 112.291 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 74.81 16.33 80.42 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.176 -1.011 . . . . 26.81 114.317 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -85.97 137.87 32.4 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 117.357 0.579 . . . . 25.71 111.928 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -68.37 140.1 34.9 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 108.473 -1.851 . . . . 24.22 108.473 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 94.1 mt -113.08 110.23 20.11 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 122.267 -0.549 . . . . 21.97 109.59 -179.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.66 175.05 13.23 Favored 'General case' 0 C--O 1.254 1.307 0 N-CA-C 115.953 1.834 . . . . 21.57 115.953 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -100.96 126.14 47.59 Favored 'General case' 0 C--O 1.237 0.447 1 N-CA-C 99.577 -4.231 . . . . 23.93 99.577 174.665 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.9 mt -114.57 132.45 63.67 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 C-N-CA 119.552 -0.859 . . . . 20.55 111.855 -176.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -113.87 132.59 55.85 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.333 -0.848 . . . . 23.96 111.776 -177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -112.47 111.65 22.64 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 104.811 -2.292 . . . . 23.08 104.811 178.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 51.2 43.14 29.36 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 121.591 0.71 . . . . 33.69 110.209 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.41 -2.02 79.25 Favored Glycine 0 C--O 1.216 -0.976 0 N-CA-C 116.759 1.463 . . . . 27.66 116.759 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -99.61 123.26 43.71 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.003 0.902 . . . . 58.22 110.311 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 19.2 ttm -69.77 118.67 12.92 Favored 'General case' 0 C--O 1.222 -0.343 0 N-CA-C 109.361 -0.607 . . . . 26.4 109.361 179.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.11 -38.91 82.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 123.074 0.55 . . . . 23.57 112.473 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.23 -46.67 85.49 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.108 0.41 . . . . 22.22 112.108 -179.862 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -68.69 -45.7 70.96 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 116.423 -0.353 . . . . 40.0 111.432 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.4 -44.83 65.6 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.588 -0.278 . . . . 22.24 111.748 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.3 mt -63.66 -42.04 98.14 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 122.196 0.998 . . . . 22.14 111.406 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 10.0 t -66.6 -48.59 79.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 115.103 -0.953 . . . . 27.78 109.083 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 51.4 tpt85 -57.03 -35.15 68.94 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 112.036 0.384 . . . . 32.33 112.036 179.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -83.51 -1.39 53.58 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 114.259 1.207 . . . . 38.01 114.259 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.85 29.71 68.97 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 120.02 -1.086 . . . . 28.29 111.101 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -107.26 8.78 30.06 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.606 0.965 . . . . 27.7 113.606 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -163.22 154.46 17.02 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.524 -1.287 . . . . 29.18 107.524 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -112.54 153.09 28.05 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 106.363 -1.718 . . . . 56.86 106.363 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 39.4 t -72.14 115.05 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 105.809 -1.923 . . . . 29.19 105.809 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -140.3 171.5 14.06 Favored 'General case' 0 CA--C 1.505 -0.751 0 O-C-N 121.776 -0.577 . . . . 28.49 111.009 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' TYR . . . . . 0.825 ' HH ' ' H2 ' ' A' ' 216' ' ' HOH . 59.8 m-85 53.14 57.19 6.53 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.73 1.381 . . . . 27.96 114.73 178.19 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' VAL . . . . . 0.529 ' CG1' ' HZ1' ' A' ' 116' ' ' LYS . 21.2 t -90.78 86.22 2.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 113.202 0.816 . . . . 37.1 113.202 -179.484 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -100.83 113.31 26.12 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.148 -0.686 . . . . 43.89 109.148 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . 0.529 ' HZ1' ' CG1' ' A' ' 114' ' ' VAL . 13.0 mmtt -68.06 154.63 93.55 Favored Pre-proline 0 C--O 1.241 0.64 0 N-CA-C 104.566 -2.383 . . . . 65.12 104.566 178.061 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -86.69 15.34 42.25 Favored 'Cis proline' 0 C--N 1.353 0.77 0 N-CA-C 113.695 0.613 . . . . 39.52 113.695 0.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -85.78 61.31 6.77 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 120.925 -0.31 . . . . 31.56 110.266 179.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 36.8 p-10 -147.92 30.4 0.88 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 113.735 1.013 . . . . 46.8 113.735 -178.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 64.2 m -54.78 -39.84 68.83 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.553 0.946 . . . . 31.81 113.553 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -97.54 14.8 25.26 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 113.827 1.047 . . . . 31.57 113.827 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -51.52 -53.27 39.43 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 114.222 1.193 . . . . 42.69 114.222 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -61.28 -44.88 96.5 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 114.74 1.385 . . . . 62.68 114.74 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -54.59 -49.01 71.43 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.729 1.252 . . . . 52.18 109.386 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.18 -42.36 98.43 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.046 -1.434 . . . . 40.75 113.59 179.735 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . 0.473 ' CG ' HH11 ' A' ' 126' ' ' ARG . 13.7 mtt-85 -64.97 -36.09 83.27 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.985 -0.552 . . . . 44.0 109.818 179.482 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.2 pttt -63.84 -43.04 97.35 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.386 -0.968 . . . . 49.58 108.386 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 74.7 m -66.14 -35.86 81.61 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.471 -0.786 . . . . 36.79 111.28 -179.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -69.54 -38.41 77.49 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 120.258 -0.577 . . . . 36.22 112.371 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.24 -35.56 80.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.752 -0.658 . . . . 33.21 109.728 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -67.97 -40.87 83.09 Favored 'General case' 0 C--N 1.333 -0.14 0 O-C-N 123.126 0.266 . . . . 37.78 111.483 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.28 -35.86 80.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 122.924 0.49 . . . . 31.08 110.485 178.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -65.17 -50.75 64.74 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.763 0.425 . . . . 50.26 110.875 179.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -63.85 -29.3 70.5 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.799 -0.637 . . . . 53.49 110.278 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -86.56 -1.19 57.43 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 120.091 -0.644 . . . . 33.31 110.273 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm 54.42 44.93 28.11 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.19 0.441 . . . . 60.29 112.19 178.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 37.3 mt -83.26 134.65 34.93 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.412 1.264 . . . . 32.35 114.412 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ASN . . . . . 0.795 HD21 ' H2 ' ' A' ' 246' ' ' HOH . 71.4 m-80 35.09 -102.65 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 115.732 1.753 . . . . 32.49 115.732 177.303 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 53.3 mt -50.71 -27.24 4.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 123.2 0.6 . . . . 37.93 111.669 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' TRP . . . . . 0.729 ' HE1' ' H2 ' ' A' ' 203' ' ' HOH . 69.9 m95 -94.6 14.46 20.91 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.569 1.322 . . . . 51.46 114.569 -178.544 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.3 p . . . . . 0 C--O 1.261 1.682 0 N-CA-C 107.875 -1.158 . . . . 58.89 107.875 178.987 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' THP . . . . . 0.915 ' H3 ' ' H2 ' ' A' ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.791 ' H2 ' ' H ' ' A' ' 77' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . 0.727 ' H2 ' ' H ' ' A' ' 38' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 0.729 ' H2 ' ' HE1' ' A' ' 140' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.503 ' H2 ' ' H ' ' A' ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . 0.715 ' H2 ' ' H ' ' A' ' 76' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . 0.915 ' H2 ' ' H3 ' ' A' ' 151' ' ' THP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 ' 216' ' ' HOH . . . . . 0.825 ' H2 ' ' HH ' ' A' ' 113' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' 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 ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . 0.489 ' H1 ' ' CD ' ' A' ' 63' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . 0.471 ' H2 ' ' HZ1' ' A' ' 84' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . 0.795 ' H2 ' HD21 ' A' ' 138' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 44.5 mt . . . . . 0 N--CA 1.494 1.77 0 N-CA-C 108.346 -0.983 . . . . 49.81 108.346 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -126.48 132.68 51.37 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.238 -0.282 . . . . 65.02 110.238 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.0 mttm -85.99 153.14 22.37 Favored 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 120.382 -0.527 . . . . 37.58 110.776 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -139.63 147.1 50.61 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 108.343 -0.984 . . . . 52.93 108.343 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -69.38 158.39 57.64 Favored 'Trans proline' 0 CA--C 1.513 -0.543 0 C-N-CA 120.669 0.913 . . . . 32.71 112.231 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.39 165.3 33.53 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 106.049 -1.834 . . . . 33.46 106.049 177.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.5 m -129.57 134.4 47.72 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 108.605 -0.887 . . . . 27.65 108.605 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.0 130.93 42.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.401 0.62 . . . . 25.69 112.448 -179.539 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 47.1 mt -105.35 -54.56 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 106.021 -1.844 . . . . 26.37 106.021 176.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -161.28 129.53 4.37 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 114.617 1.34 . . . . 45.9 114.617 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -83.75 129.56 34.95 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.023 -1.473 . . . . 30.54 107.023 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 93.9 mt -96.11 -56.57 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 112.128 0.418 . . . . 31.54 112.128 -178.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -150.93 -169.95 3.53 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 106.026 -1.842 . . . . 35.92 106.026 177.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -50.78 -31.28 23.31 Favored Glycine 0 C--O 1.221 -0.718 0 N-CA-C 118.421 2.128 . . . . 23.34 118.421 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 45.5 p30 -128.91 9.21 5.78 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 117.211 2.3 . . . . 21.76 117.211 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 43.3 m -135.57 138.73 43.27 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 118.31 0.505 . . . . 19.62 110.013 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' C5C . . . . . 0.736 ' H51' HD21 ' A' ' 36' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -106.47 123.77 48.59 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.823 -1.547 . . . . 52.32 106.823 179.115 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 84.8 mt -126.57 157.19 39.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.567 -0.742 . . . . 26.58 110.849 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' MET . . . . . 0.916 ' SD ' ' CE ' ' A' ' 26' ' ' MET . 0.9 OUTLIER -98.78 115.82 29.62 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 102.657 -3.09 . . . . 54.09 102.657 175.84 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -126.34 122.59 35.86 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 107.559 -1.274 . . . . 33.87 107.559 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm 58.42 46.58 14.99 Favored 'General case' 0 C--O 1.158 -3.725 0 CA-C-N 116.289 -0.414 . . . . 48.49 109.982 -177.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 55.61 12.94 5.29 Favored Glycine 1 N--CA 1.522 4.398 0 CA-C-N 111.208 -2.724 . . . . 45.61 108.787 -177.632 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . 0.305 0.1 OUTLIER -116.77 137.41 23.7 Favored Pre-proline 0 CA--C 1.592 2.579 0 CA-C-N 120.094 1.947 . . . . 63.82 111.609 178.158 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PRO . . . . . 0.759 ' HB3' ' CE ' ' A' ' 26' ' ' MET . 38.3 Cg_endo -72.45 137.44 28.03 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.435 2.09 . . . . 36.6 110.954 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 32.4 mtp -152.33 147.22 26.06 Favored 'General case' 0 N--CA 1.44 -0.935 0 O-C-N 124.291 0.994 . . . . 40.54 110.772 -179.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.99 134.46 38.97 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 103.079 -2.934 . . . . 29.21 103.079 175.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -117.41 154.58 31.11 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.273 -0.64 . . . . 22.99 109.273 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 39.5 tpt85 -130.73 131.32 44.7 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 105.333 -2.099 . . . . 20.87 105.333 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . 0.736 HD21 ' H51' ' A' ' 23' ' ' C5C . 89.4 mt -63.55 138.37 58.48 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 112.935 0.717 . . . . 25.83 112.935 -179.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.7 mt -78.97 147.33 32.99 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 116.065 -0.516 . . . . 24.6 110.041 177.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.4 mt 57.0 18.53 4.01 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 120.741 3.608 . . . . 25.25 120.741 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 25.1 m -141.02 163.76 21.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 120.092 -0.643 . . . . 24.8 111.654 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -148.1 110.84 4.75 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.207 -1.035 . . . . 37.96 108.207 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.5 p -89.43 154.41 48.69 Favored Pre-proline 0 C--O 1.238 0.472 0 N-CA-C 104.468 -2.419 . . . . 29.12 104.468 176.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . 0.63 ' HG2' ' HA2' ' A' ' 55' ' ' GLY . 17.9 Cg_endo -63.9 150.02 89.33 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 N-CA-C 114.475 0.914 . . . . 38.83 114.475 179.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -69.77 147.18 50.79 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 116.09 1.885 . . . . 42.98 116.09 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.6 p -135.31 -12.19 2.13 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 113.911 -1.495 . . . . 46.24 108.609 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -108.65 -74.73 0.65 Allowed 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 118.88 2.918 . . . . 56.97 118.88 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HIS . . . . . 0.527 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 44.3 t-80 -44.86 115.94 2.61 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 115.198 1.555 . . . . 58.09 115.198 -177.555 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -55.07 -42.75 65.95 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 125.252 3.968 . . . . 63.19 114.13 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 46' ' ' HIS . 30.2 mttp -83.81 54.84 3.02 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.222 -1.399 . . . . 81.47 107.222 179.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -173.36 -42.55 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 104.997 -2.223 . . . . 77.29 104.997 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 77.75 -177.14 53.3 Favored Glycine 0 C--N 1.332 0.349 0 CA-C-N 115.186 -0.915 . . . . 66.07 115.129 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 73.8 t -90.68 94.32 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 107.246 -1.39 . . . . 57.35 107.246 178.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -73.7 151.95 40.57 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.25 -0.886 . . . . 56.93 113.081 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 54' ' ' TYR . 3.8 tmtt? -60.36 142.55 54.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.547 0.689 . . . . 61.62 110.36 179.138 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TYR . . . . . 0.422 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 60.1 m-85 76.6 -2.64 2.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.111 -0.95 . . . . 40.43 112.499 -179.175 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . 0.63 ' HA2' ' HG2' ' A' ' 42' ' ' PRO . . . -65.46 -54.3 27.13 Favored Glycine 0 CA--C 1.508 -0.367 0 N-CA-C 109.062 -1.615 . . . . 32.14 109.062 178.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -62.56 -30.17 79.11 Favored 'Trans proline' 0 N--CA 1.475 0.426 0 C-N-CA 122.881 2.387 . . . . 31.18 111.629 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -71.05 -50.68 31.25 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.5 -0.555 . . . . 44.24 109.5 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.76 -37.75 74.19 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.596 -0.52 . . . . 25.69 109.596 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 m -64.0 -42.16 97.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.752 0.649 . . . . 26.18 112.752 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.39 -36.62 68.73 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.075 0.398 . . . . 28.8 112.075 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -61.66 -50.89 70.68 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 107.112 -1.44 . . . . 30.68 107.112 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 50.3 m -61.07 -48.07 83.42 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.272 -0.876 . . . . 28.35 112.317 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -56.7 -47.56 79.62 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 122.437 0.295 . . . . 45.34 110.722 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -47.01 87.91 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 121.402 0.62 . . . . 53.87 111.442 179.852 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 26.2 ttt -61.43 -49.42 76.91 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 113.464 0.913 . . . . 42.44 113.464 -178.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.7 m -77.29 -32.53 19.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 115.054 1.502 . . . . 30.81 115.054 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -76.02 -23.48 55.19 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 114.618 1.34 . . . . 45.11 114.618 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.0 m120 -98.41 9.85 42.16 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.917 0.71 . . . . 42.24 112.917 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.48 145.51 27.38 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 121.921 0.867 . . . . 34.22 113.274 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -84.58 -33.92 23.29 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.305 -1.369 . . . . 31.55 107.305 177.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -136.23 136.41 39.87 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 113.859 1.059 . . . . 31.65 113.859 -178.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 53.4 mt -124.77 131.89 72.05 Favored 'Isoleucine or valine' 0 C--O 1.245 0.817 0 N-CA-C 107.188 -1.412 . . . . 29.0 107.188 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -131.44 144.68 51.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.978 -0.556 . . . . 33.72 110.215 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.0 m -111.95 136.6 47.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.791 0.805 . . . . 26.89 110.743 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -126.6 107.12 9.92 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.061 -0.972 . . . . 36.51 109.087 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -77.94 152.39 33.23 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 106.892 -1.521 . . . . 28.1 106.892 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -88.59 -164.0 1.06 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 118.902 -1.119 . . . . 26.47 108.271 178.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.2 pttt -86.66 -2.75 58.77 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 117.792 2.515 . . . . 52.13 117.792 -177.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.82 -144.36 11.24 Favored Glycine 0 CA--C 1.521 0.413 0 N-CA-C 110.935 -0.866 . . . . 28.04 110.935 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -68.59 144.13 54.63 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.729 0.775 . . . . 42.3 112.166 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -94.86 -7.7 39.43 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 118.344 2.72 . . . . 48.95 118.344 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 87' ' ' ARG . 74.0 p -135.13 150.64 50.22 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.628 -0.878 . . . . 27.73 108.628 178.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.6 p30 -93.78 -178.88 4.82 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 109.27 -0.641 . . . . 25.05 109.27 176.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -58.46 -22.94 56.36 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 115.057 1.503 . . . . 42.26 115.057 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -90.2 8.32 33.62 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.085 0.554 . . . . 31.71 112.291 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 74.81 16.33 80.42 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.176 -1.011 . . . . 26.81 114.317 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . 0.463 ' O ' ' HA ' ' A' ' 82' ' ' THR . 74.6 mtm180 -85.97 137.87 32.4 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 117.357 0.579 . . . . 25.71 111.928 179.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -68.37 140.1 34.9 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 108.473 -1.851 . . . . 24.22 108.473 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 94.1 mt -113.08 110.23 20.11 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 122.267 -0.549 . . . . 21.97 109.59 -179.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.66 175.05 13.23 Favored 'General case' 0 C--O 1.254 1.307 0 N-CA-C 115.953 1.834 . . . . 21.57 115.953 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -100.96 126.14 47.59 Favored 'General case' 0 C--O 1.237 0.447 1 N-CA-C 99.577 -4.231 . . . . 23.93 99.577 174.665 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.9 mt -114.57 132.45 63.67 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 C-N-CA 119.552 -0.859 . . . . 20.55 111.855 -176.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -113.87 132.59 55.85 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.333 -0.848 . . . . 23.96 111.776 -177.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -112.47 111.65 22.64 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 104.811 -2.292 . . . . 23.08 104.811 178.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 51.2 43.14 29.36 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 121.591 0.71 . . . . 33.69 110.209 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.41 -2.02 79.25 Favored Glycine 0 C--O 1.216 -0.976 0 N-CA-C 116.759 1.463 . . . . 27.66 116.759 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . 0.441 ' N ' ' HD3' ' A' ' 97' ' ' LYS . 3.4 mppt? -99.61 123.26 43.71 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.003 0.902 . . . . 58.22 110.311 177.653 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 19.2 ttm -69.77 118.67 12.92 Favored 'General case' 0 C--O 1.222 -0.343 0 N-CA-C 109.361 -0.607 . . . . 26.4 109.361 179.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.11 -38.91 82.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 123.074 0.55 . . . . 23.57 112.473 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.23 -46.67 85.49 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.108 0.41 . . . . 22.22 112.108 -179.862 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . 0.603 ' HG3' ' NE2' ' A' ' 124' ' ' HIS . 12.9 tm-20 -68.69 -45.7 70.96 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 116.423 -0.353 . . . . 40.0 111.432 -179.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.4 -44.83 65.6 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.588 -0.278 . . . . 22.24 111.748 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.3 mt -63.66 -42.04 98.14 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 122.196 0.998 . . . . 22.14 111.406 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 10.0 t -66.6 -48.59 79.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 115.103 -0.953 . . . . 27.78 109.083 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 51.4 tpt85 -57.03 -35.15 68.94 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 112.036 0.384 . . . . 32.33 112.036 179.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -83.51 -1.39 53.58 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 114.259 1.207 . . . . 38.01 114.259 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.85 29.71 68.97 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 120.02 -1.086 . . . . 28.29 111.101 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -107.26 8.78 30.06 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.606 0.965 . . . . 27.7 113.606 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -163.22 154.46 17.02 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.524 -1.287 . . . . 29.18 107.524 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -112.54 153.09 28.05 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 106.363 -1.718 . . . . 56.86 106.363 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 39.4 t -72.14 115.05 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 105.809 -1.923 . . . . 29.19 105.809 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -140.3 171.5 14.06 Favored 'General case' 0 CA--C 1.505 -0.751 0 O-C-N 121.776 -0.577 . . . . 28.49 111.009 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 53.14 57.19 6.53 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.73 1.381 . . . . 27.96 114.73 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 21.2 t -90.78 86.22 2.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 113.202 0.816 . . . . 37.1 113.202 -179.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -100.83 113.31 26.12 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.148 -0.686 . . . . 43.89 109.148 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . 0.521 ' HD2' ' ND2' ' A' ' 119' ' ' ASN . 13.0 mmtt -68.06 154.63 93.55 Favored Pre-proline 0 C--O 1.241 0.64 0 N-CA-C 104.566 -2.383 . . . . 65.12 104.566 178.061 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -86.69 15.34 42.25 Favored 'Cis proline' 0 C--N 1.353 0.77 0 N-CA-C 113.695 0.613 . . . . 39.52 113.695 0.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -85.78 61.31 6.77 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 120.925 -0.31 . . . . 31.56 110.266 179.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASN . . . . . 0.521 ' ND2' ' HD2' ' A' ' 116' ' ' LYS . 36.8 p-10 -147.92 30.4 0.88 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 113.735 1.013 . . . . 46.8 113.735 -178.646 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 64.2 m -54.78 -39.84 68.83 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.553 0.946 . . . . 31.81 113.553 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -97.54 14.8 25.26 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 113.827 1.047 . . . . 31.57 113.827 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -51.52 -53.27 39.43 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 114.222 1.193 . . . . 42.69 114.222 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -61.28 -44.88 96.5 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 114.74 1.385 . . . . 62.68 114.74 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HIS . . . . . 0.603 ' NE2' ' HG3' ' A' ' 101' ' ' GLU . 77.2 t60 -54.59 -49.01 71.43 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.729 1.252 . . . . 52.18 109.386 179.262 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.18 -42.36 98.43 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.046 -1.434 . . . . 40.75 113.59 179.735 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . 0.554 ' HG2' HH11 ' A' ' 126' ' ' ARG . 13.7 mtt-85 -64.97 -36.09 83.27 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.985 -0.552 . . . . 44.0 109.818 179.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 124' ' ' HIS . 26.2 pttt -63.84 -43.04 97.35 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.386 -0.968 . . . . 49.58 108.386 178.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 74.7 m -66.14 -35.86 81.61 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.471 -0.786 . . . . 36.79 111.28 -179.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -69.54 -38.41 77.49 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 120.258 -0.577 . . . . 36.22 112.371 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . 0.737 ' HA ' ' HE3' ' A' ' 133' ' ' LYS . . . -63.24 -35.56 80.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.752 -0.658 . . . . 33.21 109.728 178.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -67.97 -40.87 83.09 Favored 'General case' 0 C--N 1.333 -0.14 0 O-C-N 123.126 0.266 . . . . 37.78 111.483 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.28 -35.86 80.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 122.924 0.49 . . . . 31.08 110.485 178.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . 0.737 ' HE3' ' HA ' ' A' ' 130' ' ' ALA . 40.6 mtmt -65.17 -50.75 64.74 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.763 0.425 . . . . 50.26 110.875 179.047 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -63.85 -29.3 70.5 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.799 -0.637 . . . . 53.49 110.278 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -86.56 -1.19 57.43 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 120.091 -0.644 . . . . 33.31 110.273 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 141' ' ' SER . 41.6 mmtm 54.42 44.93 28.11 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.19 0.441 . . . . 60.29 112.19 178.504 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 37.3 mt -83.26 134.65 34.93 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.412 1.264 . . . . 32.35 114.412 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 35.09 -102.65 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 115.732 1.753 . . . . 32.49 115.732 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 53.3 mt -50.71 -27.24 4.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 123.2 0.6 . . . . 37.93 111.669 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -94.6 14.46 20.91 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.569 1.322 . . . . 51.46 114.569 -178.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' SER . . . . . 0.458 ' HB3' ' O ' ' A' ' 136' ' ' LYS . 35.3 p . . . . . 0 C--O 1.261 1.682 0 N-CA-C 107.875 -1.158 . . . . 58.89 107.875 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' THP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 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 ' 209' ' ' 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 ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' 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 ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 44.5 mt . . . . . 0 N--CA 1.494 1.77 0 N-CA-C 108.346 -0.983 . . . . 49.81 108.346 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -126.48 132.68 51.37 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.238 -0.282 . . . . 65.02 110.238 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.0 mttm -85.99 153.14 22.37 Favored 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 120.382 -0.527 . . . . 37.58 110.776 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -139.63 147.1 50.61 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 108.343 -0.984 . . . . 52.93 108.343 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -69.38 158.39 57.64 Favored 'Trans proline' 0 CA--C 1.513 -0.543 0 C-N-CA 120.669 0.913 . . . . 32.71 112.231 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.39 165.3 33.53 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 106.049 -1.834 . . . . 33.46 106.049 177.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.5 m -129.57 134.4 47.72 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 108.605 -0.887 . . . . 27.65 108.605 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.0 130.93 42.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.401 0.62 . . . . 25.69 112.448 -179.539 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 47.1 mt -105.35 -54.56 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 106.021 -1.844 . . . . 26.37 106.021 176.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -161.28 129.53 4.37 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 114.617 1.34 . . . . 45.9 114.617 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -83.75 129.56 34.95 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.023 -1.473 . . . . 30.54 107.023 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 93.9 mt -96.11 -56.57 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 112.128 0.418 . . . . 31.54 112.128 -178.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -150.93 -169.95 3.53 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 106.026 -1.842 . . . . 35.92 106.026 177.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -50.78 -31.28 23.31 Favored Glycine 0 C--O 1.221 -0.718 0 N-CA-C 118.421 2.128 . . . . 23.34 118.421 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 45.5 p30 -128.91 9.21 5.78 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 117.211 2.3 . . . . 21.76 117.211 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 43.3 m -135.57 138.73 43.27 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 118.31 0.505 . . . . 19.62 110.013 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' C5C . . . . . 0.736 ' H51' HD21 ' A' ' 36' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -106.47 123.77 48.59 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.823 -1.547 . . . . 52.32 106.823 179.115 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 84.8 mt -126.57 157.19 39.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.567 -0.742 . . . . 26.58 110.849 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' MET . . . . . 0.916 ' SD ' ' CE ' ' A' ' 26' ' ' MET . 0.9 OUTLIER -98.78 115.82 29.62 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 102.657 -3.09 . . . . 54.09 102.657 175.84 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -126.34 122.59 35.86 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 107.559 -1.274 . . . . 33.87 107.559 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm 58.42 46.58 14.99 Favored 'General case' 0 C--O 1.158 -3.725 0 CA-C-N 116.289 -0.414 . . . . 48.49 109.982 -177.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 55.61 12.94 5.29 Favored Glycine 1 N--CA 1.522 4.398 0 CA-C-N 111.208 -2.724 . . . . 45.61 108.787 -177.632 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . 0.305 0.1 OUTLIER -116.77 137.41 23.7 Favored Pre-proline 0 CA--C 1.592 2.579 0 CA-C-N 120.094 1.947 . . . . 63.82 111.609 178.158 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.759 ' HB3' ' CE ' ' A' ' 26' ' ' MET . 38.3 Cg_endo -72.45 137.44 28.03 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.435 2.09 . . . . 36.6 110.954 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 32.4 mtp -152.33 147.22 26.06 Favored 'General case' 0 N--CA 1.44 -0.935 0 O-C-N 124.291 0.994 . . . . 40.54 110.772 -179.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.99 134.46 38.97 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 103.079 -2.934 . . . . 29.21 103.079 175.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -117.41 154.58 31.11 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.273 -0.64 . . . . 22.99 109.273 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 39.5 tpt85 -130.73 131.32 44.7 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 105.333 -2.099 . . . . 20.87 105.333 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.736 HD21 ' H51' ' A' ' 23' ' ' C5C . 89.4 mt -63.55 138.37 58.48 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 112.935 0.717 . . . . 25.83 112.935 -179.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.7 mt -78.97 147.33 32.99 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 116.065 -0.516 . . . . 24.6 110.041 177.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.4 mt 57.0 18.53 4.01 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 120.741 3.608 . . . . 25.25 120.741 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 25.1 m -141.02 163.76 21.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 120.092 -0.643 . . . . 24.8 111.654 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -148.1 110.84 4.75 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.207 -1.035 . . . . 37.96 108.207 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.5 p -89.43 154.41 48.69 Favored Pre-proline 0 C--O 1.238 0.472 0 N-CA-C 104.468 -2.419 . . . . 29.12 104.468 176.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.63 ' HG2' ' HA2' ' A' ' 55' ' ' GLY . 17.9 Cg_endo -63.9 150.02 89.33 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 N-CA-C 114.475 0.914 . . . . 38.83 114.475 179.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -69.77 147.18 50.79 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 116.09 1.885 . . . . 42.98 116.09 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.6 p -135.31 -12.19 2.13 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 113.911 -1.495 . . . . 46.24 108.609 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -108.65 -74.73 0.65 Allowed 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 118.88 2.918 . . . . 56.97 118.88 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.527 ' CE1' ' HB2' ' A' ' 48' ' ' LYS . 44.3 t-80 -44.86 115.94 2.61 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 115.198 1.555 . . . . 58.09 115.198 -177.555 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -55.07 -42.75 65.95 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 125.252 3.968 . . . . 63.19 114.13 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 46' ' ' HIS . 30.2 mttp -83.81 54.84 3.02 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.222 -1.399 . . . . 81.47 107.222 179.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -173.36 -42.55 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 104.997 -2.223 . . . . 77.29 104.997 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 77.75 -177.14 53.3 Favored Glycine 0 C--N 1.332 0.349 0 CA-C-N 115.186 -0.915 . . . . 66.07 115.129 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 73.8 t -90.68 94.32 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 107.246 -1.39 . . . . 57.35 107.246 178.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -73.7 151.95 40.57 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.25 -0.886 . . . . 56.93 113.081 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 54' ' ' TYR . 3.8 tmtt? -60.36 142.55 54.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.547 0.689 . . . . 61.62 110.36 179.138 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.422 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 60.1 m-85 76.6 -2.64 2.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.111 -0.95 . . . . 40.43 112.499 -179.175 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.63 ' HA2' ' HG2' ' A' ' 42' ' ' PRO . . . -65.46 -54.3 27.13 Favored Glycine 0 CA--C 1.508 -0.367 0 N-CA-C 109.062 -1.615 . . . . 32.14 109.062 178.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -62.56 -30.17 79.11 Favored 'Trans proline' 0 N--CA 1.475 0.426 0 C-N-CA 122.881 2.387 . . . . 31.18 111.629 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -71.05 -50.68 31.25 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.5 -0.555 . . . . 44.24 109.5 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.76 -37.75 74.19 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.596 -0.52 . . . . 25.69 109.596 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 m -64.0 -42.16 97.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.752 0.649 . . . . 26.18 112.752 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.39 -36.62 68.73 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.075 0.398 . . . . 28.8 112.075 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -61.66 -50.89 70.68 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 107.112 -1.44 . . . . 30.68 107.112 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 50.3 m -61.07 -48.07 83.42 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.272 -0.876 . . . . 28.35 112.317 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -56.7 -47.56 79.62 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 122.437 0.295 . . . . 45.34 110.722 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -47.01 87.91 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 121.402 0.62 . . . . 53.87 111.442 179.852 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 26.2 ttt -61.43 -49.42 76.91 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 113.464 0.913 . . . . 42.44 113.464 -178.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.7 m -77.29 -32.53 19.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 115.054 1.502 . . . . 30.81 115.054 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -76.02 -23.48 55.19 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 114.618 1.34 . . . . 45.11 114.618 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.0 m120 -98.41 9.85 42.16 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.917 0.71 . . . . 42.24 112.917 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.48 145.51 27.38 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 121.921 0.867 . . . . 34.22 113.274 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -84.58 -33.92 23.29 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.305 -1.369 . . . . 31.55 107.305 177.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -136.23 136.41 39.87 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 113.859 1.059 . . . . 31.65 113.859 -178.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 53.4 mt -124.77 131.89 72.05 Favored 'Isoleucine or valine' 0 C--O 1.245 0.817 0 N-CA-C 107.188 -1.412 . . . . 29.0 107.188 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -131.44 144.68 51.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.978 -0.556 . . . . 33.72 110.215 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.0 m -111.95 136.6 47.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.791 0.805 . . . . 26.89 110.743 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -126.6 107.12 9.92 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.061 -0.972 . . . . 36.51 109.087 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -77.94 152.39 33.23 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 106.892 -1.521 . . . . 28.1 106.892 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -88.59 -164.0 1.06 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 118.902 -1.119 . . . . 26.47 108.271 178.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.2 pttt -86.66 -2.75 58.77 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 117.792 2.515 . . . . 52.13 117.792 -177.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.82 -144.36 11.24 Favored Glycine 0 CA--C 1.521 0.413 0 N-CA-C 110.935 -0.866 . . . . 28.04 110.935 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -68.59 144.13 54.63 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.729 0.775 . . . . 42.3 112.166 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -94.86 -7.7 39.43 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 118.344 2.72 . . . . 48.95 118.344 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 87' ' ' ARG . 74.0 p -135.13 150.64 50.22 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.628 -0.878 . . . . 27.73 108.628 178.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.6 p30 -93.78 -178.88 4.82 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 109.27 -0.641 . . . . 25.05 109.27 176.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -58.46 -22.94 56.36 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 115.057 1.503 . . . . 42.26 115.057 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -90.2 8.32 33.62 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.085 0.554 . . . . 31.71 112.291 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 74.81 16.33 80.42 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.176 -1.011 . . . . 26.81 114.317 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.463 ' O ' ' HA ' ' A' ' 82' ' ' THR . 74.6 mtm180 -85.97 137.87 32.4 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 117.357 0.579 . . . . 25.71 111.928 179.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -68.37 140.1 34.9 Favored Glycine 0 CA--C 1.528 0.866 0 N-CA-C 108.473 -1.851 . . . . 24.22 108.473 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 94.1 mt -113.08 110.23 20.11 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 122.267 -0.549 . . . . 21.97 109.59 -179.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.66 175.05 13.23 Favored 'General case' 0 C--O 1.254 1.307 0 N-CA-C 115.953 1.834 . . . . 21.57 115.953 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -100.96 126.14 47.59 Favored 'General case' 0 C--O 1.237 0.447 1 N-CA-C 99.577 -4.231 . . . . 23.93 99.577 174.665 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.9 mt -114.57 132.45 63.67 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 C-N-CA 119.552 -0.859 . . . . 20.55 111.855 -176.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -113.87 132.59 55.85 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.333 -0.848 . . . . 23.96 111.776 -177.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -112.47 111.65 22.64 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 104.811 -2.292 . . . . 23.08 104.811 178.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 51.2 43.14 29.36 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 121.591 0.71 . . . . 33.69 110.209 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.41 -2.02 79.25 Favored Glycine 0 C--O 1.216 -0.976 0 N-CA-C 116.759 1.463 . . . . 27.66 116.759 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.441 ' N ' ' HD3' ' A' ' 97' ' ' LYS . 3.4 mppt? -99.61 123.26 43.71 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.003 0.902 . . . . 58.22 110.311 177.653 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 19.2 ttm -69.77 118.67 12.92 Favored 'General case' 0 C--O 1.222 -0.343 0 N-CA-C 109.361 -0.607 . . . . 26.4 109.361 179.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.11 -38.91 82.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 123.074 0.55 . . . . 23.57 112.473 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.23 -46.67 85.49 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.108 0.41 . . . . 22.22 112.108 -179.862 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.603 ' HG3' ' NE2' ' A' ' 124' ' ' HIS . 12.9 tm-20 -68.69 -45.7 70.96 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 116.423 -0.353 . . . . 40.0 111.432 -179.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.4 -44.83 65.6 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.588 -0.278 . . . . 22.24 111.748 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.3 mt -63.66 -42.04 98.14 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 122.196 0.998 . . . . 22.14 111.406 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 10.0 t -66.6 -48.59 79.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 115.103 -0.953 . . . . 27.78 109.083 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 51.4 tpt85 -57.03 -35.15 68.94 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 112.036 0.384 . . . . 32.33 112.036 179.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -83.51 -1.39 53.58 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 114.259 1.207 . . . . 38.01 114.259 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.85 29.71 68.97 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 120.02 -1.086 . . . . 28.29 111.101 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -107.26 8.78 30.06 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.606 0.965 . . . . 27.7 113.606 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -163.22 154.46 17.02 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.524 -1.287 . . . . 29.18 107.524 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -112.54 153.09 28.05 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 106.363 -1.718 . . . . 56.86 106.363 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 39.4 t -72.14 115.05 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 105.809 -1.923 . . . . 29.19 105.809 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -140.3 171.5 14.06 Favored 'General case' 0 CA--C 1.505 -0.751 0 O-C-N 121.776 -0.577 . . . . 28.49 111.009 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 53.14 57.19 6.53 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.73 1.381 . . . . 27.96 114.73 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 21.2 t -90.78 86.22 2.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 113.202 0.816 . . . . 37.1 113.202 -179.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -100.83 113.31 26.12 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.148 -0.686 . . . . 43.89 109.148 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.521 ' HD2' ' ND2' ' A' ' 119' ' ' ASN . 13.0 mmtt -68.06 154.63 93.55 Favored Pre-proline 0 C--O 1.241 0.64 0 N-CA-C 104.566 -2.383 . . . . 65.12 104.566 178.061 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -86.69 15.34 42.25 Favored 'Cis proline' 0 C--N 1.353 0.77 0 N-CA-C 113.695 0.613 . . . . 39.52 113.695 0.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -85.78 61.31 6.77 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 120.925 -0.31 . . . . 31.56 110.266 179.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.521 ' ND2' ' HD2' ' A' ' 116' ' ' LYS . 36.8 p-10 -147.92 30.4 0.88 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 113.735 1.013 . . . . 46.8 113.735 -178.646 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 64.2 m -54.78 -39.84 68.83 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.553 0.946 . . . . 31.81 113.553 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -97.54 14.8 25.26 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 113.827 1.047 . . . . 31.57 113.827 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -51.52 -53.27 39.43 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 114.222 1.193 . . . . 42.69 114.222 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -61.28 -44.88 96.5 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 114.74 1.385 . . . . 62.68 114.74 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HIS . . . . . 0.603 ' NE2' ' HG3' ' A' ' 101' ' ' GLU . 77.2 t60 -54.59 -49.01 71.43 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.729 1.252 . . . . 52.18 109.386 179.262 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.18 -42.36 98.43 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.046 -1.434 . . . . 40.75 113.59 179.735 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.554 ' HG2' HH11 ' A' ' 126' ' ' ARG . 13.7 mtt-85 -64.97 -36.09 83.27 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.985 -0.552 . . . . 44.0 109.818 179.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 124' ' ' HIS . 26.2 pttt -63.84 -43.04 97.35 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.386 -0.968 . . . . 49.58 108.386 178.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 74.7 m -66.14 -35.86 81.61 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.471 -0.786 . . . . 36.79 111.28 -179.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -69.54 -38.41 77.49 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 120.258 -0.577 . . . . 36.22 112.371 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.737 ' HA ' ' HE3' ' A' ' 133' ' ' LYS . . . -63.24 -35.56 80.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.752 -0.658 . . . . 33.21 109.728 178.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -67.97 -40.87 83.09 Favored 'General case' 0 C--N 1.333 -0.14 0 O-C-N 123.126 0.266 . . . . 37.78 111.483 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.28 -35.86 80.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 122.924 0.49 . . . . 31.08 110.485 178.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.737 ' HE3' ' HA ' ' A' ' 130' ' ' ALA . 40.6 mtmt -65.17 -50.75 64.74 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.763 0.425 . . . . 50.26 110.875 179.047 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -63.85 -29.3 70.5 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.799 -0.637 . . . . 53.49 110.278 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -86.56 -1.19 57.43 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 120.091 -0.644 . . . . 33.31 110.273 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 141' ' ' SER . 41.6 mmtm 54.42 44.93 28.11 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.19 0.441 . . . . 60.29 112.19 178.504 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 37.3 mt -83.26 134.65 34.93 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.412 1.264 . . . . 32.35 114.412 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 35.09 -102.65 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 115.732 1.753 . . . . 32.49 115.732 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 53.3 mt -50.71 -27.24 4.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 123.2 0.6 . . . . 37.93 111.669 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -94.6 14.46 20.91 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.569 1.322 . . . . 51.46 114.569 -178.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' SER . . . . . 0.458 ' HB3' ' O ' ' A' ' 136' ' ' LYS . 35.3 p . . . . . 0 C--O 1.261 1.682 0 N-CA-C 107.875 -1.158 . . . . 58.89 107.875 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' THP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 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 ' 209' ' ' 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 ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' 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 ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_