data_1cm9_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 1cm9 _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' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 120.825 0.345 . . . . 100.25 110.784 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . . . -39.19 92.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 115.395 1.628 . . . . 98.57 115.395 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -139.68 19.04 2.51 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 104.187 -2.523 . . . . 96.6 104.187 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . . . -21.77 144.04 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.25 0 N-CA-C 117.254 2.316 . . . . 77.24 117.254 -179.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -71.95 153.18 58.09 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.261 2.641 . . . . 64.64 109.208 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . . . -105.11 156.58 17.95 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.667 0.988 . . . . 56.32 113.667 -178.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -84.9 122.62 29.44 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.194 -1.039 . . . . 67.81 108.194 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.8 m -129.36 157.15 42.74 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.116 -0.698 . . . . 54.9 109.116 179.537 -73.035 -55.791 -83.437 106.329 2.046 104.762 -70.764 -75.647 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.8 m -102.1 107.07 18.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.82 0.674 . . . . 49.84 112.82 -179.76 -70.866 -63.052 -85.2 102.108 2.039 102.374 -82.558 -85.126 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.3 mt -87.21 -25.61 23.94 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.042 -0.663 . . . . 61.85 110.748 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -131.75 165.25 23.43 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 109.273 -1.531 . . . . 54.36 109.273 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' TYR . . . . . 0.417 ' OH ' ' O ' ' A' ' 41' ' ' PRO . 43.7 m-85 -123.45 145.55 48.73 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 113.036 0.754 . . . . 48.94 113.036 -179.462 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLN . . . . . 1.073 ' OE1' ' NE ' ' A' ' 21' ' ' ARG . 3.0 tp-100 -69.55 121.96 18.11 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.273 -1.751 . . . . 67.44 106.273 175.267 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.86 -64.83 1.1 Allowed 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.193 0.521 . . . . 74.7 112.367 -176.51 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . 1.073 ' NE ' ' OE1' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -58.12 133.25 84.16 Favored Pre-proline 0 N--CA 1.477 0.915 0 CA-C-O 122.25 1.024 . . . . 79.96 110.872 -179.059 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -57.36 155.44 30.2 Favored 'Trans proline' 0 C--O 1.27 2.077 1 O-C-N 113.308 -4.101 . . . . 57.2 111.936 173.082 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.1 mt -103.6 135.51 19.36 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 124.718 1.261 . . . . 52.09 111.073 -178.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -75.93 121.63 6.33 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 121.102 1.201 . . . . 49.58 109.674 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -50.18 -34.24 21.87 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 115.669 1.729 . . . . 59.28 115.669 -178.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.9 m -61.06 -11.83 4.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.217 0.821 . . . . 58.97 113.217 -179.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.7 mp -100.49 -7.73 23.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.233 0.827 . . . . 52.97 113.233 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -104.6 153.26 21.43 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 113.764 1.024 . . . . 50.28 113.764 -177.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.4 t -108.16 -47.82 3.48 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.144 -0.934 . . . . 46.7 111.816 -179.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.4 p -164.33 -165.31 0.95 Allowed 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 109.026 -0.731 . . . . 43.6 109.026 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 36.2 p-90 -159.73 168.52 25.74 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.747 0.784 . . . . 45.09 110.386 179.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 48.5 p90 -155.63 142.88 13.77 Favored Pre-proline 0 N--CA 1.443 -0.808 0 CA-C-N 115.014 -0.994 . . . . 63.87 108.612 177.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.8 160.04 41.25 Favored 'Trans proline' 0 C--N 1.33 -0.396 0 N-CA-C 109.542 -0.984 . . . . 42.02 109.542 179.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 72.9 p -100.62 167.12 10.54 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 104.312 -2.477 . . . . 49.6 104.312 177.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 76' ' ' HOH . 32.0 t -56.97 152.73 12.44 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 119.995 -0.682 . . . . 52.33 111.377 179.67 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -76.05 -21.23 57.01 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.919 -0.771 . . . . 82.91 108.919 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.8 mt -75.11 -3.95 35.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.73 -0.668 . . . . 60.39 111.709 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 54.7 m -70.36 159.29 34.41 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.916 -0.713 . . . . 59.35 110.655 179.415 -75.647 -70.764 -83.437 104.762 2.046 106.329 -55.791 -73.035 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 39.9 t -47.15 -62.59 1.34 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.188 -0.914 . . . . 64.62 110.454 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.9 mtmp? -118.52 152.83 51.62 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 77.32 111.291 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PRO . . . . . 0.417 ' O ' ' OH ' ' A' ' 18' ' ' TYR . 55.3 Cg_endo -67.71 146.14 71.88 Favored 'Trans proline' 0 C--O 1.224 -0.211 0 N-CA-C 107.652 -1.711 . . . . 54.74 107.652 179.721 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.91 161.43 32.65 Favored Glycine 0 C--O 1.244 0.74 0 C-N-CA 119.814 -1.184 . . . . 42.69 114.79 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.4 m -127.13 155.27 38.09 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.804 0 N-CA-C 104.724 -2.325 . . . . 44.53 104.724 178.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 82.4 mt -117.77 130.64 72.34 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 N-CA-C 107.092 -1.447 . . . . 41.25 107.092 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -101.75 137.41 40.09 Favored 'General case' 0 CA--C 1.508 -0.636 0 O-C-N 124.103 0.877 . . . . 36.58 108.979 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.0 mt -104.8 119.59 39.36 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 107.158 -1.423 . . . . 45.92 107.158 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.1 p -81.06 162.13 23.89 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.119 -1.808 . . . . 42.29 106.119 179.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -63.5 -21.92 66.59 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 110.044 -0.354 . . . . 52.82 110.044 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -81.35 -13.42 58.38 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.135 -0.32 . . . . 94.5 110.135 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 101.05 9.74 44.42 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 117.097 1.599 . . . . 54.86 117.097 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -86.89 148.19 25.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 117.393 0.596 . . . . 83.36 109.655 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -102.3 130.22 48.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 107.846 -1.168 . . . . 54.68 107.846 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 41.4 t -128.75 126.25 64.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 113.186 0.81 . . . . 41.48 113.186 -178.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 6.7 m -80.75 135.36 35.97 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 115.143 1.534 . . . . 49.11 115.143 179.868 -85.126 -82.558 -85.2 102.374 2.039 102.108 -63.052 -70.866 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -142.0 148.6 38.79 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 113.766 1.024 . . . . 39.31 113.766 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -79.94 107.84 13.05 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.031 1.332 . . . . 43.16 111.121 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -63.92 -0.29 1.06 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.004 1.112 . . . . 58.9 114.004 -178.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 83.2 p -87.89 -23.74 23.86 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 119.785 -0.766 . . . . 55.09 111.082 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -72.96 139.72 46.92 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.481 0.658 . . . . 66.97 112.475 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -61.26 -41.66 97.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.72 -0.673 . . . . 68.84 112.26 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 48.0 p-90 -63.17 -25.91 68.56 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 118.642 -1.223 . . . . 53.52 112.807 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 3.1 m -83.83 -30.35 7.71 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 C-N-CA 117.74 -1.584 . . . . 35.41 109.315 -179.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -67.91 -29.6 68.73 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.313 0.578 . . . . 61.32 110.115 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.47 -43.38 69.91 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 107.27 -1.381 . . . . 59.04 107.27 178.632 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.67 -37.49 86.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.515 -0.766 . . . . 39.97 112.392 179.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' MSE . . . . . . . . . . . . . 50.5 mtp -65.77 -32.34 73.82 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.803 0.841 . . . . 50.25 110.236 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -77.69 -50.3 12.72 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.031 -0.668 . . . . 52.03 111.108 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -67.53 -32.27 72.94 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 115.383 1.623 . . . . 54.51 115.383 -178.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . 0.649 ' O ' ' O ' ' A' ' 77' ' ' HOH . 89.1 mt -94.8 154.03 39.93 Favored Pre-proline 0 N--CA 1.448 -0.57 0 CA-C-O 121.444 0.64 . . . . 36.14 111.78 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -88.32 161.77 6.89 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 N-CA-C 107.849 -1.635 . . . . 37.19 107.849 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.6 t -83.56 144.63 9.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 120.263 -0.575 . . . . 48.63 109.889 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 85.8 m -62.54 139.59 58.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.529 -0.305 . . . . 51.98 111.029 179.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.63 -45.05 57.49 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.042 -0.526 . . . . 69.08 111.703 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.211 0 CA-C-O 117.611 -1.185 . . . . 71.7 111.735 179.993 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.689 0 CA-C-O 120.936 0.398 . . . . 71.29 110.156 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -104.83 102.79 12.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.922 -0.581 . . . . 72.73 111.928 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 52.1 mtm180 -78.65 154.39 78.56 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.164 0.507 . . . . 91.88 110.69 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -76.26 158.22 37.29 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 N-CA-C 107.557 -1.747 . . . . 45.57 107.557 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -119.15 154.04 33.91 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 120.146 -0.622 . . . . 66.42 110.269 179.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -80.07 123.79 28.17 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 112.278 0.473 . . . . 69.96 112.278 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' CYS . . . . . . . . . . . . . 86.6 m -128.63 150.1 50.37 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.642 -0.708 . . . . 52.48 109.807 179.391 -70.524 -58.491 -80.476 106.148 2.039 104.316 -76.051 -70.135 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' CYS . . . . . 0.415 ' N ' ' O ' ' B' ' 75' ' ' HOH . 67.5 m -91.95 117.82 30.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.088 -0.708 . . . . 56.51 109.088 178.729 -72.287 -56.872 -87.755 104.073 2.047 104.057 -81.827 -98.664 2 2 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 1.1 mp -103.68 -18.43 14.71 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.052 -1.092 . . . . 64.6 108.052 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -136.37 153.14 21.43 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 108.546 -1.822 . . . . 61.95 108.546 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -114.34 160.69 18.82 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.486 0.921 . . . . 61.59 113.486 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -88.56 117.22 27.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 102.262 -3.236 . . . . 71.06 102.262 177.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . . . -73.39 -58.82 3.04 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 114.095 1.146 . . . . 55.54 114.095 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . . . -75.4 134.52 73.28 Favored Pre-proline 0 CA--C 1.516 -0.356 0 CA-C-N 116.251 -0.431 . . . . 50.35 110.876 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -55.0 144.43 68.36 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.399 2.066 . . . . 52.39 111.153 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 44.2 mt -99.92 133.66 21.5 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 121.276 0.56 . . . . 46.86 111.376 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.35 123.75 11.24 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 N-CA-C 109.286 -1.082 . . . . 47.73 109.286 179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -49.55 -29.8 7.51 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.677 -0.692 . . . . 57.35 112.328 -179.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.58 -21.51 29.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 N-CA-C 113.505 0.928 . . . . 49.61 113.505 -178.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 8.4 mp -92.09 -3.24 55.99 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 112.816 0.673 . . . . 58.69 112.816 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 54.2 mt -107.44 147.11 30.85 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 114.856 1.428 . . . . 41.11 114.856 -177.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 3.1 t -106.63 -38.01 6.27 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.214 0.82 . . . . 36.97 113.214 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 91.0 p -170.7 -175.6 1.86 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.605 -0.887 . . . . 32.36 108.605 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' TRP . . . . . . . . . . . . . 38.7 p-90 -145.7 163.48 34.78 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 120.898 0.38 . . . . 44.23 110.327 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -146.98 140.05 14.63 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.274 -0.421 . . . . 44.53 111.449 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -80.21 157.6 23.07 Favored 'Trans proline' 0 C--O 1.225 -0.171 0 C-N-CA 117.945 -0.903 . . . . 37.55 113.081 -179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 20.2 p -102.43 164.58 11.59 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 106.215 -1.772 . . . . 40.42 106.215 176.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' SER . . . . . . . . . . . . . 26.7 t -61.82 139.55 58.34 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.625 0.972 . . . . 39.68 113.625 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -16.71 50.28 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 119.839 -0.744 . . . . 62.88 109.436 178.618 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 57.8 mt -80.93 -3.79 52.7 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 114.841 1.422 . . . . 53.35 114.841 -179.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' CYS . . . . . . . . . . . . . 91.7 m -74.45 151.17 39.65 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 110.064 -0.347 . . . . 50.32 110.064 179.195 -70.135 -76.051 -80.476 104.316 2.039 106.148 -58.491 -70.524 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 24.1 m -49.83 -54.21 20.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 57.63 111.893 -179.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 33.0 mtmm -110.98 139.07 21.38 Favored Pre-proline 0 C--O 1.235 0.295 0 N-CA-C 113.014 0.746 . . . . 68.22 113.014 -179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -68.0 143.79 61.52 Favored 'Trans proline' 0 C--N 1.346 0.414 0 N-CA-C 106.987 -1.967 . . . . 56.37 106.987 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.71 175.73 43.17 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 118.107 -1.996 . . . . 40.28 114.62 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 28.6 m -140.39 156.97 24.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 N-CA-C 105.799 -1.926 . . . . 40.55 105.799 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.7 mt -120.65 124.04 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 N-CA-C 109.235 -0.654 . . . . 40.47 109.235 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -98.66 137.2 37.63 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.679 -0.691 . . . . 44.28 110.134 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 58.8 tp -102.18 118.25 36.5 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.818 -1.549 . . . . 42.52 106.818 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 19.8 p -74.32 162.62 28.71 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 109.335 -0.616 . . . . 49.87 109.335 179.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -55.96 -40.56 73.42 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.298 -0.63 . . . . 55.5 109.298 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -73.38 8.63 1.65 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 93.15 111.885 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 77.92 20.97 72.32 Favored Glycine 0 C--O 1.227 -0.322 0 N-CA-C 119.131 2.413 . . . . 59.46 119.131 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . . . -95.77 159.03 15.18 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 117.968 0.884 . . . . 58.64 109.568 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -113.85 112.89 24.11 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.898 1.073 . . . . 62.77 113.898 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 45.0 t -107.9 131.98 56.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.123 -0.489 . . . . 45.83 112.277 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 1.2 m -85.61 143.17 28.6 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.678 -0.49 . . . . 54.88 109.678 178.606 -98.664 -81.827 -87.755 104.057 2.047 104.073 -56.872 -72.287 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -146.24 155.97 43.05 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 123.6 0.562 . . . . 45.19 111.552 -179.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -89.88 115.76 27.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.7 -0.227 . . . . 63.62 110.796 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 16.5 pttm -69.68 6.46 1.12 Allowed 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.95 0.722 . . . . 76.98 112.95 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 26.8 t -88.03 -36.48 16.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.077 0.465 . . . . 72.13 109.96 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -67.77 145.21 54.92 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.426 0.631 . . . . 75.94 111.445 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -65.16 -43.54 91.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 113.675 0.991 . . . . 71.78 113.675 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' TRP . . . . . . . . . . . . . 59.7 p-90 -57.6 -28.26 63.46 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.669 -0.812 . . . . 53.0 110.561 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 49.5 t -78.11 -42.03 27.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.075 -0.713 . . . . 43.49 109.075 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -61.87 -40.21 94.59 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 109.489 -0.56 . . . . 56.87 109.489 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -61.44 -45.49 94.06 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.249 -0.58 . . . . 64.93 111.255 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.84 -32.96 74.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 120.768 -0.373 . . . . 40.91 111.348 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' MSE . . . . . . . . . . . . . 41.7 mtp -61.21 -36.16 79.15 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.301 0.572 . . . . 55.25 109.531 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -78.91 -43.02 25.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.314 0.578 . . . . 55.62 111.843 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -64.99 -44.96 87.59 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.263 -0.575 . . . . 51.79 111.939 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 72.7 mt -86.58 153.27 55.56 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 117.056 2.243 . . . . 45.96 117.056 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -83.81 162.95 14.09 Favored 'Trans proline' 0 CA--C 1.531 0.365 0 N-CA-C 107.081 -1.93 . . . . 29.37 107.081 179.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.2 135.81 25.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 106.651 -1.611 . . . . 39.83 106.651 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 28.5 m -55.14 136.28 48.49 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.176 -0.676 . . . . 42.73 109.176 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.92 74.49 8.98 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.484 -0.561 . . . . 66.14 109.484 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.193 0 CA-C-O 117.737 -1.125 . . . . 76.87 111.26 179.976 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HOH . . . . . 0.401 ' O ' ' N ' ' A' ' 35' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' HOH . . . . . 0.649 ' O ' ' O ' ' A' ' 69' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' HOH . . . . . 0.415 ' O ' ' N ' ' B' ' 15' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 120.825 0.345 . . . . 100.25 110.784 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . . . -39.19 92.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 115.395 1.628 . . . . 98.57 115.395 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -139.68 19.04 2.51 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 104.187 -2.523 . . . . 96.6 104.187 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . . . -21.77 144.04 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.25 0 N-CA-C 117.254 2.316 . . . . 77.24 117.254 -179.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -71.95 153.18 58.09 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.261 2.641 . . . . 64.64 109.208 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . 0.439 ' CB ' HD22 ' B' ' 16' ' ' LEU . . . -105.11 156.58 17.95 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.667 0.988 . . . . 56.32 113.667 -178.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -84.9 122.62 29.44 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.194 -1.039 . . . . 67.81 108.194 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.8 m -129.36 157.15 42.74 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.116 -0.698 . . . . 54.9 109.116 179.537 -73.035 -55.791 -83.437 106.329 2.046 104.762 -70.764 -75.647 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.8 m -102.1 107.07 18.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.82 0.674 . . . . 49.84 112.82 -179.76 -70.866 -63.052 -85.2 102.108 2.039 102.374 -82.558 -85.126 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.3 mt -87.21 -25.61 23.94 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.042 -0.663 . . . . 61.85 110.748 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -131.75 165.25 23.43 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 109.273 -1.531 . . . . 54.36 109.273 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -123.45 145.55 48.73 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 113.036 0.754 . . . . 48.94 113.036 -179.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLN . . . . . 1.073 ' OE1' ' NE ' ' A' ' 21' ' ' ARG . 3.0 tp-100 -69.55 121.96 18.11 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.273 -1.751 . . . . 67.44 106.273 175.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . 0.649 ' HD2' ' H ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -79.86 -64.83 1.1 Allowed 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.193 0.521 . . . . 74.7 112.367 -176.51 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . 1.073 ' NE ' ' OE1' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -58.12 133.25 84.16 Favored Pre-proline 0 N--CA 1.477 0.915 0 CA-C-O 122.25 1.024 . . . . 79.96 110.872 -179.059 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -57.36 155.44 30.2 Favored 'Trans proline' 0 C--O 1.27 2.077 1 O-C-N 113.308 -4.101 . . . . 57.2 111.936 173.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . 0.442 HD11 HG11 ' A' ' 53' ' ' VAL . 63.1 mt -103.6 135.51 19.36 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 124.718 1.261 . . . . 52.09 111.073 -178.456 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PRO . . . . . 0.656 ' HG2' HD22 ' A' ' 27' ' ' LEU . 70.9 Cg_endo -75.93 121.63 6.33 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 121.102 1.201 . . . . 49.58 109.674 179.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLN . . . . . 0.545 ' HA ' HD23 ' A' ' 28' ' ' LEU . 7.2 tt0 -50.18 -34.24 21.87 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 115.669 1.729 . . . . 59.28 115.669 -178.525 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . 0.712 HG23 ' CD1' ' A' ' 27' ' ' LEU . 5.9 m -61.06 -11.83 4.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.217 0.821 . . . . 58.97 113.217 -179.344 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . 0.712 ' CD1' HG23 ' A' ' 26' ' ' VAL . 4.7 mp -100.49 -7.73 23.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.233 0.827 . . . . 52.97 113.233 179.944 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 25' ' ' GLN . 1.1 mm? -104.6 153.26 21.43 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 113.764 1.024 . . . . 50.28 113.764 -177.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.4 t -108.16 -47.82 3.48 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.144 -0.934 . . . . 46.7 111.816 -179.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.4 p -164.33 -165.31 0.95 Allowed 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 109.026 -0.731 . . . . 43.6 109.026 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 36.2 p-90 -159.73 168.52 25.74 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.747 0.784 . . . . 45.09 110.386 179.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 48.5 p90 -155.63 142.88 13.77 Favored Pre-proline 0 N--CA 1.443 -0.808 0 CA-C-N 115.014 -0.994 . . . . 63.87 108.612 177.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.8 160.04 41.25 Favored 'Trans proline' 0 C--N 1.33 -0.396 0 N-CA-C 109.542 -0.984 . . . . 42.02 109.542 179.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 72.9 p -100.62 167.12 10.54 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 104.312 -2.477 . . . . 49.6 104.312 177.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.0 t -56.97 152.73 12.44 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 119.995 -0.682 . . . . 52.33 111.377 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -76.05 -21.23 57.01 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.919 -0.771 . . . . 82.91 108.919 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.8 mt -75.11 -3.95 35.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.73 -0.668 . . . . 60.39 111.709 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 54.7 m -70.36 159.29 34.41 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.916 -0.713 . . . . 59.35 110.655 179.415 -75.647 -70.764 -83.437 104.762 2.046 106.329 -55.791 -73.035 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 39.9 t -47.15 -62.59 1.34 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.188 -0.914 . . . . 64.62 110.454 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . 0.412 ' HB2' ' NZ ' ' A' ' 40' ' ' LYS . 10.9 mtmp? -118.52 152.83 51.62 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 77.32 111.291 -179.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.71 146.14 71.88 Favored 'Trans proline' 0 C--O 1.224 -0.211 0 N-CA-C 107.652 -1.711 . . . . 54.74 107.652 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.91 161.43 32.65 Favored Glycine 0 C--O 1.244 0.74 0 C-N-CA 119.814 -1.184 . . . . 42.69 114.79 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.4 m -127.13 155.27 38.09 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.804 0 N-CA-C 104.724 -2.325 . . . . 44.53 104.724 178.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 82.4 mt -117.77 130.64 72.34 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 N-CA-C 107.092 -1.447 . . . . 41.25 107.092 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -101.75 137.41 40.09 Favored 'General case' 0 CA--C 1.508 -0.636 0 O-C-N 124.103 0.877 . . . . 36.58 108.979 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.0 mt -104.8 119.59 39.36 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 107.158 -1.423 . . . . 45.92 107.158 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.1 p -81.06 162.13 23.89 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.119 -1.808 . . . . 42.29 106.119 179.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . 0.487 ' HE2' ' O ' ' A' ' 26' ' ' VAL . 65.9 mttm -63.5 -21.92 66.59 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 110.044 -0.354 . . . . 52.82 110.044 179.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . 0.481 ' HG2' ' NE ' ' A' ' 51' ' ' ARG . 10.5 tpp180 -81.35 -13.42 58.38 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.135 -0.32 . . . . 94.5 110.135 179.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 101.05 9.74 44.42 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 117.097 1.599 . . . . 54.86 117.097 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ARG . . . . . 0.481 ' NE ' ' HG2' ' A' ' 49' ' ' ARG . 1.0 OUTLIER -86.89 148.19 25.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 117.393 0.596 . . . . 83.36 109.655 179.148 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -102.3 130.22 48.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 107.846 -1.168 . . . . 54.68 107.846 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' VAL . . . . . 0.442 HG11 HD11 ' A' ' 23' ' ' LEU . 41.4 t -128.75 126.25 64.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 113.186 0.81 . . . . 41.48 113.186 -178.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 6.7 m -80.75 135.36 35.97 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 115.143 1.534 . . . . 49.11 115.143 179.868 -85.126 -82.558 -85.2 102.374 2.039 102.108 -63.052 -70.866 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -142.0 148.6 38.79 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 113.766 1.024 . . . . 39.31 113.766 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASP . . . . . 0.582 ' O ' HG21 ' A' ' 62' ' ' VAL . 38.0 t0 -79.94 107.84 13.05 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.031 1.332 . . . . 43.16 111.121 -179.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . 0.558 ' HA ' HG21 ' A' ' 62' ' ' VAL . 13.4 ptmt -63.92 -0.29 1.06 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.004 1.112 . . . . 58.9 114.004 -178.153 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 83.2 p -87.89 -23.74 23.86 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 119.785 -0.766 . . . . 55.09 111.082 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . 0.57 ' HD3' ' HB3' ' A' ' 56' ' ' ASP . 4.7 mptp? -72.96 139.72 46.92 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.481 0.658 . . . . 66.97 112.475 179.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -61.26 -41.66 97.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.72 -0.673 . . . . 68.84 112.26 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 48.0 p-90 -63.17 -25.91 68.56 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 118.642 -1.223 . . . . 53.52 112.807 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' ' 56' ' ' ASP . 3.1 m -83.83 -30.35 7.71 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 C-N-CA 117.74 -1.584 . . . . 35.41 109.315 -179.066 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -67.91 -29.6 68.73 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.313 0.578 . . . . 61.32 110.115 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.47 -43.38 69.91 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 107.27 -1.381 . . . . 59.04 107.27 178.632 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.67 -37.49 86.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.515 -0.766 . . . . 39.97 112.392 179.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' MSE . . . . . . . . . . . . . 50.5 mtp -65.77 -32.34 73.82 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.803 0.841 . . . . 50.25 110.236 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -77.69 -50.3 12.72 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.031 -0.668 . . . . 52.03 111.108 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -67.53 -32.27 72.94 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 115.383 1.623 . . . . 54.51 115.383 -178.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . 0.649 ' O ' ' O ' ' A' ' 77' ' ' HOH . 89.1 mt -94.8 154.03 39.93 Favored Pre-proline 0 N--CA 1.448 -0.57 0 CA-C-O 121.444 0.64 . . . . 36.14 111.78 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -88.32 161.77 6.89 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 N-CA-C 107.849 -1.635 . . . . 37.19 107.849 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.6 t -83.56 144.63 9.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 120.263 -0.575 . . . . 48.63 109.889 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 85.8 m -62.54 139.59 58.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.529 -0.305 . . . . 51.98 111.029 179.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.63 -45.05 57.49 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.042 -0.526 . . . . 69.08 111.703 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.211 0 CA-C-O 117.611 -1.185 . . . . 71.7 111.735 179.993 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 8' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.689 0 CA-C-O 120.936 0.398 . . . . 71.29 110.156 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 9' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -104.83 102.79 12.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.922 -0.581 . . . . 72.73 111.928 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 52.1 mtm180 -78.65 154.39 78.56 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.164 0.507 . . . . 91.88 110.69 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -76.26 158.22 37.29 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 N-CA-C 107.557 -1.747 . . . . 45.57 107.557 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -119.15 154.04 33.91 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 120.146 -0.622 . . . . 66.42 110.269 179.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -80.07 123.79 28.17 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 112.278 0.473 . . . . 69.96 112.278 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' CYS . . . . . . . . . . . . . 86.6 m -128.63 150.1 50.37 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.642 -0.708 . . . . 52.48 109.807 179.391 -70.524 -58.491 -80.476 106.148 2.039 104.316 -76.051 -70.135 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' CYS . . . . . . . . . . . . . 67.5 m -91.95 117.82 30.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.088 -0.708 . . . . 56.51 109.088 178.729 -72.287 -56.872 -87.755 104.073 2.047 104.057 -81.827 -98.664 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LEU . . . . . 0.439 HD22 ' CB ' ' A' ' 12' ' ' ASP . 1.1 mp -103.68 -18.43 14.71 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.052 -1.092 . . . . 64.6 108.052 179.662 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -136.37 153.14 21.43 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 108.546 -1.822 . . . . 61.95 108.546 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -114.34 160.69 18.82 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.486 0.921 . . . . 61.59 113.486 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -88.56 117.22 27.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 102.262 -3.236 . . . . 71.06 102.262 177.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . . . -73.39 -58.82 3.04 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 114.095 1.146 . . . . 55.54 114.095 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . . . -75.4 134.52 73.28 Favored Pre-proline 0 CA--C 1.516 -0.356 0 CA-C-N 116.251 -0.431 . . . . 50.35 110.876 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -55.0 144.43 68.36 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.399 2.066 . . . . 52.39 111.153 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 44.2 mt -99.92 133.66 21.5 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 121.276 0.56 . . . . 46.86 111.376 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.35 123.75 11.24 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 N-CA-C 109.286 -1.082 . . . . 47.73 109.286 179.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -49.55 -29.8 7.51 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.677 -0.692 . . . . 57.35 112.328 -179.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' VAL . . . . . 0.649 HG13 HD12 ' B' ' 27' ' ' LEU . 9.9 p -64.58 -21.51 29.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 N-CA-C 113.505 0.928 . . . . 49.61 113.505 -178.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LEU . . . . . 0.649 HD12 HG13 ' B' ' 26' ' ' VAL . 8.4 mp -92.09 -3.24 55.99 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 112.816 0.673 . . . . 58.69 112.816 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 54.2 mt -107.44 147.11 30.85 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 114.856 1.428 . . . . 41.11 114.856 -177.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 3.1 t -106.63 -38.01 6.27 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.214 0.82 . . . . 36.97 113.214 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 91.0 p -170.7 -175.6 1.86 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.605 -0.887 . . . . 32.36 108.605 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' TRP . . . . . . . . . . . . . 38.7 p-90 -145.7 163.48 34.78 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 120.898 0.38 . . . . 44.23 110.327 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -146.98 140.05 14.63 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.274 -0.421 . . . . 44.53 111.449 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -80.21 157.6 23.07 Favored 'Trans proline' 0 C--O 1.225 -0.171 0 C-N-CA 117.945 -0.903 . . . . 37.55 113.081 -179.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 20.2 p -102.43 164.58 11.59 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 106.215 -1.772 . . . . 40.42 106.215 176.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' SER . . . . . . . . . . . . . 26.7 t -61.82 139.55 58.34 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.625 0.972 . . . . 39.68 113.625 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -61.54 -16.71 50.28 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 119.839 -0.744 . . . . 62.88 109.436 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 57.8 mt -80.93 -3.79 52.7 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 114.841 1.422 . . . . 53.35 114.841 -179.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' CYS . . . . . . . . . . . . . 91.7 m -74.45 151.17 39.65 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 110.064 -0.347 . . . . 50.32 110.064 179.195 -70.135 -76.051 -80.476 104.316 2.039 106.148 -58.491 -70.524 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 24.1 m -49.83 -54.21 20.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 57.63 111.893 -179.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 33.0 mtmm -110.98 139.07 21.38 Favored Pre-proline 0 C--O 1.235 0.295 0 N-CA-C 113.014 0.746 . . . . 68.22 113.014 -179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -68.0 143.79 61.52 Favored 'Trans proline' 0 C--N 1.346 0.414 0 N-CA-C 106.987 -1.967 . . . . 56.37 106.987 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.71 175.73 43.17 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 118.107 -1.996 . . . . 40.28 114.62 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' VAL . . . . . 0.409 HG13 ' HB3' ' B' ' 57' ' ' LYS . 28.6 m -140.39 156.97 24.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 N-CA-C 105.799 -1.926 . . . . 40.55 105.799 178.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.7 mt -120.65 124.04 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 N-CA-C 109.235 -0.654 . . . . 40.47 109.235 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -98.66 137.2 37.63 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.679 -0.691 . . . . 44.28 110.134 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 58.8 tp -102.18 118.25 36.5 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.818 -1.549 . . . . 42.52 106.818 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 19.8 p -74.32 162.62 28.71 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 109.335 -0.616 . . . . 49.87 109.335 179.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -55.96 -40.56 73.42 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.298 -0.63 . . . . 55.5 109.298 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -73.38 8.63 1.65 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 93.15 111.885 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 77.92 20.97 72.32 Favored Glycine 0 C--O 1.227 -0.322 0 N-CA-C 119.131 2.413 . . . . 59.46 119.131 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . . . -95.77 159.03 15.18 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 117.968 0.884 . . . . 58.64 109.568 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -113.85 112.89 24.11 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.898 1.073 . . . . 62.77 113.898 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 45.0 t -107.9 131.98 56.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.123 -0.489 . . . . 45.83 112.277 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 1.2 m -85.61 143.17 28.6 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.678 -0.49 . . . . 54.88 109.678 178.606 -98.664 -81.827 -87.755 104.057 2.047 104.073 -56.872 -72.287 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -146.24 155.97 43.05 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 123.6 0.562 . . . . 45.19 111.552 -179.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -89.88 115.76 27.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.7 -0.227 . . . . 63.62 110.796 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LYS . . . . . 0.409 ' HB3' HG13 ' B' ' 43' ' ' VAL . 16.5 pttm -69.68 6.46 1.12 Allowed 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.95 0.722 . . . . 76.98 112.95 -179.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 26.8 t -88.03 -36.48 16.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.077 0.465 . . . . 72.13 109.96 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -67.77 145.21 54.92 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.426 0.631 . . . . 75.94 111.445 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -65.16 -43.54 91.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 113.675 0.991 . . . . 71.78 113.675 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' TRP . . . . . . . . . . . . . 59.7 p-90 -57.6 -28.26 63.46 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.669 -0.812 . . . . 53.0 110.561 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 49.5 t -78.11 -42.03 27.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.075 -0.713 . . . . 43.49 109.075 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -61.87 -40.21 94.59 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 109.489 -0.56 . . . . 56.87 109.489 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -61.44 -45.49 94.06 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.249 -0.58 . . . . 64.93 111.255 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.84 -32.96 74.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 120.768 -0.373 . . . . 40.91 111.348 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' MSE . . . . . . . . . . . . . 41.7 mtp -61.21 -36.16 79.15 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.301 0.572 . . . . 55.25 109.531 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -78.91 -43.02 25.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.314 0.578 . . . . 55.62 111.843 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -64.99 -44.96 87.59 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.263 -0.575 . . . . 51.79 111.939 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 72.7 mt -86.58 153.27 55.56 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 117.056 2.243 . . . . 45.96 117.056 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -83.81 162.95 14.09 Favored 'Trans proline' 0 CA--C 1.531 0.365 0 N-CA-C 107.081 -1.93 . . . . 29.37 107.081 179.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.2 135.81 25.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 106.651 -1.611 . . . . 39.83 106.651 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 28.5 m -55.14 136.28 48.49 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.176 -0.676 . . . . 42.73 109.176 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.92 74.49 8.98 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.484 -0.561 . . . . 66.14 109.484 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.193 0 CA-C-O 117.737 -1.125 . . . . 76.87 111.26 179.976 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 77' ' ' HOH . . . . . 0.649 ' O ' ' O ' ' A' ' 69' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 80' ' ' HOH . . . . . 0.629 ' O ' HG22 ' A' ' 26' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 120.825 0.345 . . . . 100.25 110.784 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . . . -39.19 92.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 115.395 1.628 . . . . 98.57 115.395 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -139.68 19.04 2.51 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 104.187 -2.523 . . . . 96.6 104.187 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . . . -21.77 144.04 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.25 0 N-CA-C 117.254 2.316 . . . . 77.24 117.254 -179.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -71.95 153.18 58.09 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.261 2.641 . . . . 64.64 109.208 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.439 ' CB ' HD22 ' B' ' 16' ' ' LEU . . . -105.11 156.58 17.95 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.667 0.988 . . . . 56.32 113.667 -178.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -84.9 122.62 29.44 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.194 -1.039 . . . . 67.81 108.194 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.8 m -129.36 157.15 42.74 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.116 -0.698 . . . . 54.9 109.116 179.537 -73.035 -55.791 -83.437 106.329 2.046 104.762 -70.764 -75.647 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.8 m -102.1 107.07 18.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.82 0.674 . . . . 49.84 112.82 -179.76 -70.866 -63.052 -85.2 102.108 2.039 102.374 -82.558 -85.126 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.3 mt -87.21 -25.61 23.94 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.042 -0.663 . . . . 61.85 110.748 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -131.75 165.25 23.43 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 109.273 -1.531 . . . . 54.36 109.273 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -123.45 145.55 48.73 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 113.036 0.754 . . . . 48.94 113.036 -179.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLN . . . . . 1.073 ' OE1' ' NE ' ' A' ' 21' ' ' ARG . 3.0 tp-100 -69.55 121.96 18.11 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.273 -1.751 . . . . 67.44 106.273 175.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.649 ' HD2' ' H ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -79.86 -64.83 1.1 Allowed 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.193 0.521 . . . . 74.7 112.367 -176.51 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . 1.073 ' NE ' ' OE1' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -58.12 133.25 84.16 Favored Pre-proline 0 N--CA 1.477 0.915 0 CA-C-O 122.25 1.024 . . . . 79.96 110.872 -179.059 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -57.36 155.44 30.2 Favored 'Trans proline' 0 C--O 1.27 2.077 1 O-C-N 113.308 -4.101 . . . . 57.2 111.936 173.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.442 HD11 HG11 ' A' ' 53' ' ' VAL . 63.1 mt -103.6 135.51 19.36 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 124.718 1.261 . . . . 52.09 111.073 -178.456 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.656 ' HG2' HD22 ' A' ' 27' ' ' LEU . 70.9 Cg_endo -75.93 121.63 6.33 Favored 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 121.102 1.201 . . . . 49.58 109.674 179.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.545 ' HA ' HD23 ' A' ' 28' ' ' LEU . 7.2 tt0 -50.18 -34.24 21.87 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 115.669 1.729 . . . . 59.28 115.669 -178.525 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.712 HG23 ' CD1' ' A' ' 27' ' ' LEU . 5.9 m -61.06 -11.83 4.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.217 0.821 . . . . 58.97 113.217 -179.344 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.712 ' CD1' HG23 ' A' ' 26' ' ' VAL . 4.7 mp -100.49 -7.73 23.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.233 0.827 . . . . 52.97 113.233 179.944 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 25' ' ' GLN . 1.1 mm? -104.6 153.26 21.43 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 113.764 1.024 . . . . 50.28 113.764 -177.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.4 t -108.16 -47.82 3.48 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.144 -0.934 . . . . 46.7 111.816 -179.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.4 p -164.33 -165.31 0.95 Allowed 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 109.026 -0.731 . . . . 43.6 109.026 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 36.2 p-90 -159.73 168.52 25.74 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.747 0.784 . . . . 45.09 110.386 179.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 48.5 p90 -155.63 142.88 13.77 Favored Pre-proline 0 N--CA 1.443 -0.808 0 CA-C-N 115.014 -0.994 . . . . 63.87 108.612 177.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.8 160.04 41.25 Favored 'Trans proline' 0 C--N 1.33 -0.396 0 N-CA-C 109.542 -0.984 . . . . 42.02 109.542 179.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 72.9 p -100.62 167.12 10.54 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 104.312 -2.477 . . . . 49.6 104.312 177.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.0 t -56.97 152.73 12.44 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 119.995 -0.682 . . . . 52.33 111.377 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -76.05 -21.23 57.01 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.919 -0.771 . . . . 82.91 108.919 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.8 mt -75.11 -3.95 35.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.73 -0.668 . . . . 60.39 111.709 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 54.7 m -70.36 159.29 34.41 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.916 -0.713 . . . . 59.35 110.655 179.415 -75.647 -70.764 -83.437 104.762 2.046 106.329 -55.791 -73.035 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 39.9 t -47.15 -62.59 1.34 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.188 -0.914 . . . . 64.62 110.454 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.412 ' HB2' ' NZ ' ' A' ' 40' ' ' LYS . 10.9 mtmp? -118.52 152.83 51.62 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 77.32 111.291 -179.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.71 146.14 71.88 Favored 'Trans proline' 0 C--O 1.224 -0.211 0 N-CA-C 107.652 -1.711 . . . . 54.74 107.652 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.91 161.43 32.65 Favored Glycine 0 C--O 1.244 0.74 0 C-N-CA 119.814 -1.184 . . . . 42.69 114.79 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.4 m -127.13 155.27 38.09 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.804 0 N-CA-C 104.724 -2.325 . . . . 44.53 104.724 178.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 82.4 mt -117.77 130.64 72.34 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 N-CA-C 107.092 -1.447 . . . . 41.25 107.092 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -101.75 137.41 40.09 Favored 'General case' 0 CA--C 1.508 -0.636 0 O-C-N 124.103 0.877 . . . . 36.58 108.979 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.0 mt -104.8 119.59 39.36 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 107.158 -1.423 . . . . 45.92 107.158 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.1 p -81.06 162.13 23.89 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.119 -1.808 . . . . 42.29 106.119 179.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.487 ' HE2' ' O ' ' A' ' 26' ' ' VAL . 65.9 mttm -63.5 -21.92 66.59 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 110.044 -0.354 . . . . 52.82 110.044 179.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.481 ' HG2' ' NE ' ' A' ' 51' ' ' ARG . 10.5 tpp180 -81.35 -13.42 58.38 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.135 -0.32 . . . . 94.5 110.135 179.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 101.05 9.74 44.42 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 117.097 1.599 . . . . 54.86 117.097 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.481 ' NE ' ' HG2' ' A' ' 49' ' ' ARG . 1.0 OUTLIER -86.89 148.19 25.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 117.393 0.596 . . . . 83.36 109.655 179.148 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -102.3 130.22 48.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 107.846 -1.168 . . . . 54.68 107.846 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.442 HG11 HD11 ' A' ' 23' ' ' LEU . 41.4 t -128.75 126.25 64.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 113.186 0.81 . . . . 41.48 113.186 -178.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 6.7 m -80.75 135.36 35.97 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 115.143 1.534 . . . . 49.11 115.143 179.868 -85.126 -82.558 -85.2 102.374 2.039 102.108 -63.052 -70.866 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -142.0 148.6 38.79 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 113.766 1.024 . . . . 39.31 113.766 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.582 ' O ' HG21 ' A' ' 62' ' ' VAL . 38.0 t0 -79.94 107.84 13.05 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.031 1.332 . . . . 43.16 111.121 -179.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.558 ' HA ' HG21 ' A' ' 62' ' ' VAL . 13.4 ptmt -63.92 -0.29 1.06 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.004 1.112 . . . . 58.9 114.004 -178.153 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 83.2 p -87.89 -23.74 23.86 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 119.785 -0.766 . . . . 55.09 111.082 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.57 ' HD3' ' HB3' ' A' ' 56' ' ' ASP . 4.7 mptp? -72.96 139.72 46.92 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.481 0.658 . . . . 66.97 112.475 179.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -61.26 -41.66 97.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.72 -0.673 . . . . 68.84 112.26 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 48.0 p-90 -63.17 -25.91 68.56 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 118.642 -1.223 . . . . 53.52 112.807 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' ' 56' ' ' ASP . 3.1 m -83.83 -30.35 7.71 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 C-N-CA 117.74 -1.584 . . . . 35.41 109.315 -179.066 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -67.91 -29.6 68.73 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.313 0.578 . . . . 61.32 110.115 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.47 -43.38 69.91 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 107.27 -1.381 . . . . 59.04 107.27 178.632 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.67 -37.49 86.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.515 -0.766 . . . . 39.97 112.392 179.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' MSE . . . . . . . . . . . . . 50.5 mtp -65.77 -32.34 73.82 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.803 0.841 . . . . 50.25 110.236 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -77.69 -50.3 12.72 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.031 -0.668 . . . . 52.03 111.108 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -67.53 -32.27 72.94 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 115.383 1.623 . . . . 54.51 115.383 -178.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.649 ' O ' ' O ' ' A' ' 77' ' ' HOH . 89.1 mt -94.8 154.03 39.93 Favored Pre-proline 0 N--CA 1.448 -0.57 0 CA-C-O 121.444 0.64 . . . . 36.14 111.78 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -88.32 161.77 6.89 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 N-CA-C 107.849 -1.635 . . . . 37.19 107.849 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.6 t -83.56 144.63 9.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 120.263 -0.575 . . . . 48.63 109.889 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 85.8 m -62.54 139.59 58.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.529 -0.305 . . . . 51.98 111.029 179.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.63 -45.05 57.49 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.042 -0.526 . . . . 69.08 111.703 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.211 0 CA-C-O 117.611 -1.185 . . . . 71.7 111.735 179.993 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.689 0 CA-C-O 120.936 0.398 . . . . 71.29 110.156 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -104.83 102.79 12.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.922 -0.581 . . . . 72.73 111.928 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 52.1 mtm180 -78.65 154.39 78.56 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.164 0.507 . . . . 91.88 110.69 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -76.26 158.22 37.29 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 N-CA-C 107.557 -1.747 . . . . 45.57 107.557 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -119.15 154.04 33.91 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 120.146 -0.622 . . . . 66.42 110.269 179.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -80.07 123.79 28.17 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 112.278 0.473 . . . . 69.96 112.278 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' CYS . . . . . . . . . . . . . 86.6 m -128.63 150.1 50.37 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.642 -0.708 . . . . 52.48 109.807 179.391 -70.524 -58.491 -80.476 106.148 2.039 104.316 -76.051 -70.135 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' CYS . . . . . . . . . . . . . 67.5 m -91.95 117.82 30.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.088 -0.708 . . . . 56.51 109.088 178.729 -72.287 -56.872 -87.755 104.073 2.047 104.057 -81.827 -98.664 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LEU . . . . . 0.439 HD22 ' CB ' ' A' ' 12' ' ' ASP . 1.1 mp -103.68 -18.43 14.71 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.052 -1.092 . . . . 64.6 108.052 179.662 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -136.37 153.14 21.43 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 108.546 -1.822 . . . . 61.95 108.546 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -114.34 160.69 18.82 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.486 0.921 . . . . 61.59 113.486 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -88.56 117.22 27.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 102.262 -3.236 . . . . 71.06 102.262 177.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . . . -73.39 -58.82 3.04 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 114.095 1.146 . . . . 55.54 114.095 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . . . -75.4 134.52 73.28 Favored Pre-proline 0 CA--C 1.516 -0.356 0 CA-C-N 116.251 -0.431 . . . . 50.35 110.876 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -55.0 144.43 68.36 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.399 2.066 . . . . 52.39 111.153 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 44.2 mt -99.92 133.66 21.5 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 121.276 0.56 . . . . 46.86 111.376 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.35 123.75 11.24 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 N-CA-C 109.286 -1.082 . . . . 47.73 109.286 179.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -49.55 -29.8 7.51 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.677 -0.692 . . . . 57.35 112.328 -179.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' VAL . . . . . 0.649 HG13 HD12 ' B' ' 27' ' ' LEU . 9.9 p -64.58 -21.51 29.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 N-CA-C 113.505 0.928 . . . . 49.61 113.505 -178.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.649 HD12 HG13 ' B' ' 26' ' ' VAL . 8.4 mp -92.09 -3.24 55.99 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 112.816 0.673 . . . . 58.69 112.816 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 54.2 mt -107.44 147.11 30.85 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 114.856 1.428 . . . . 41.11 114.856 -177.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 3.1 t -106.63 -38.01 6.27 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.214 0.82 . . . . 36.97 113.214 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 91.0 p -170.7 -175.6 1.86 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.605 -0.887 . . . . 32.36 108.605 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' TRP . . . . . . . . . . . . . 38.7 p-90 -145.7 163.48 34.78 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 120.898 0.38 . . . . 44.23 110.327 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -146.98 140.05 14.63 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.274 -0.421 . . . . 44.53 111.449 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -80.21 157.6 23.07 Favored 'Trans proline' 0 C--O 1.225 -0.171 0 C-N-CA 117.945 -0.903 . . . . 37.55 113.081 -179.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 20.2 p -102.43 164.58 11.59 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 106.215 -1.772 . . . . 40.42 106.215 176.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' SER . . . . . . . . . . . . . 26.7 t -61.82 139.55 58.34 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.625 0.972 . . . . 39.68 113.625 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.465 ' H ' ' NE2' ' B' ' 36' ' ' GLN . 0.0 OUTLIER -61.54 -16.71 50.28 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 119.839 -0.744 . . . . 62.88 109.436 178.618 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 57.8 mt -80.93 -3.79 52.7 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 114.841 1.422 . . . . 53.35 114.841 -179.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' CYS . . . . . . . . . . . . . 91.7 m -74.45 151.17 39.65 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 110.064 -0.347 . . . . 50.32 110.064 179.195 -70.135 -76.051 -80.476 104.316 2.039 106.148 -58.491 -70.524 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 24.1 m -49.83 -54.21 20.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 57.63 111.893 -179.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 33.0 mtmm -110.98 139.07 21.38 Favored Pre-proline 0 C--O 1.235 0.295 0 N-CA-C 113.014 0.746 . . . . 68.22 113.014 -179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -68.0 143.79 61.52 Favored 'Trans proline' 0 C--N 1.346 0.414 0 N-CA-C 106.987 -1.967 . . . . 56.37 106.987 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.71 175.73 43.17 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 118.107 -1.996 . . . . 40.28 114.62 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.409 HG13 ' HB3' ' B' ' 57' ' ' LYS . 28.6 m -140.39 156.97 24.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 N-CA-C 105.799 -1.926 . . . . 40.55 105.799 178.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.7 mt -120.65 124.04 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 N-CA-C 109.235 -0.654 . . . . 40.47 109.235 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -98.66 137.2 37.63 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.679 -0.691 . . . . 44.28 110.134 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 58.8 tp -102.18 118.25 36.5 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.818 -1.549 . . . . 42.52 106.818 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 19.8 p -74.32 162.62 28.71 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 109.335 -0.616 . . . . 49.87 109.335 179.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -55.96 -40.56 73.42 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.298 -0.63 . . . . 55.5 109.298 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -73.38 8.63 1.65 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 93.15 111.885 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 77.92 20.97 72.32 Favored Glycine 0 C--O 1.227 -0.322 0 N-CA-C 119.131 2.413 . . . . 59.46 119.131 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . . . -95.77 159.03 15.18 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 117.968 0.884 . . . . 58.64 109.568 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -113.85 112.89 24.11 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.898 1.073 . . . . 62.77 113.898 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 45.0 t -107.9 131.98 56.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.123 -0.489 . . . . 45.83 112.277 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 1.2 m -85.61 143.17 28.6 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.678 -0.49 . . . . 54.88 109.678 178.606 -98.664 -81.827 -87.755 104.057 2.047 104.073 -56.872 -72.287 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -146.24 155.97 43.05 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 123.6 0.562 . . . . 45.19 111.552 -179.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -89.88 115.76 27.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.7 -0.227 . . . . 63.62 110.796 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LYS . . . . . 0.409 ' HB3' HG13 ' B' ' 43' ' ' VAL . 16.5 pttm -69.68 6.46 1.12 Allowed 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.95 0.722 . . . . 76.98 112.95 -179.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 26.8 t -88.03 -36.48 16.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.077 0.465 . . . . 72.13 109.96 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -67.77 145.21 54.92 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.426 0.631 . . . . 75.94 111.445 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -65.16 -43.54 91.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 113.675 0.991 . . . . 71.78 113.675 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' TRP . . . . . . . . . . . . . 59.7 p-90 -57.6 -28.26 63.46 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.669 -0.812 . . . . 53.0 110.561 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 49.5 t -78.11 -42.03 27.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.075 -0.713 . . . . 43.49 109.075 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -61.87 -40.21 94.59 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 109.489 -0.56 . . . . 56.87 109.489 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -61.44 -45.49 94.06 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.249 -0.58 . . . . 64.93 111.255 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.84 -32.96 74.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 120.768 -0.373 . . . . 40.91 111.348 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' MSE . . . . . . . . . . . . . 41.7 mtp -61.21 -36.16 79.15 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.301 0.572 . . . . 55.25 109.531 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -78.91 -43.02 25.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.314 0.578 . . . . 55.62 111.843 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -64.99 -44.96 87.59 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.263 -0.575 . . . . 51.79 111.939 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 72.7 mt -86.58 153.27 55.56 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 117.056 2.243 . . . . 45.96 117.056 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -83.81 162.95 14.09 Favored 'Trans proline' 0 CA--C 1.531 0.365 0 N-CA-C 107.081 -1.93 . . . . 29.37 107.081 179.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.2 135.81 25.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 106.651 -1.611 . . . . 39.83 106.651 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 28.5 m -55.14 136.28 48.49 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.176 -0.676 . . . . 42.73 109.176 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.92 74.49 8.98 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.484 -0.561 . . . . 66.14 109.484 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.193 0 CA-C-O 117.737 -1.125 . . . . 76.87 111.26 179.976 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' HOH . . . . . 0.649 ' O ' ' O ' ' A' ' 69' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' HOH . . . . . 0.629 ' O ' HG22 ' A' ' 26' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_