data_2yal_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 2yal _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 ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.52 4.258 0 N-CA-C 118.564 2.186 . . . . 123.15000000000001 118.564 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.88 130.28 17.57 Favored 'Cis proline' 0 N--CA 1.49 1.295 0 N-CA-C 115.579 1.338 . . . . 98.019999999999996 115.579 14.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.42 147.58 32.28 Favored 'General case' 0 C--O 1.262 1.755 0 CA-C-O 121.83 0.824 . . . . 82.799999999999997 110.769 -177.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 8.1 mt -82.42 98.21 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.402 0 N-CA-C 102.703 -3.073 . . . . 71.769999999999996 102.703 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 43.9 p30 -79.14 -172.97 3.38 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 106.991 -1.485 . . . . 66.659999999999997 106.991 174.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 p -87.83 -16.47 33.96 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 115.125 -0.943 . . . . 87.939999999999998 110.793 -164.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -66.5 -41.24 89.2 Favored 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 124.285 0.99 . . . . 89.819999999999993 108.721 169.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -66.98 -48.17 69.33 Favored 'General case' 0 C--O 1.207 -1.142 0 O-C-N 125.848 1.967 . . . . 59.479999999999997 111.553 175.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -55.88 -38.94 70.82 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 113.09 0.774 . . . . 69.120000000000005 113.09 175.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.99 -40.25 84.28 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 115.472 1.656 . . . . 92.620000000000005 115.472 172.81 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.18 -50.04 44.26 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 114.563 -1.199 . . . . 57.82 109.137 -178.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 84.9 t -52.69 -50.75 40.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.068 -0.969 . . . . 68.159999999999997 110.435 174.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ARG . . . . . 0.733 ' NH1' ' O ' ' B' ' 72' ' ' PRO . 16.6 mtm-85 -50.9 -41.67 58.71 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 112.331 0.493 . . . . 79.510000000000005 112.331 177.213 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -67.76 -41.32 83.54 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-O 121.898 0.856 . . . . 98.780000000000001 110.344 178.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.53 -39.17 79.41 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 113.469 0.914 . . . . 77.400000000000006 113.469 177.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -21.23 46.23 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 123.425 0.453 . . . . 91.0 111.76 176.522 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . 0.505 ' O ' ' CG2' ' A' ' 87' ' ' THR . 1.2 m -79.33 -2.63 42.4 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.65 1.18 . . . . 102.61 112.739 177.602 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -140.96 174.28 10.67 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.519 1.303 . . . . 100.98999999999999 114.519 -174.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -72.87 78.44 0.76 Allowed Glycine 0 C--O 1.261 1.793 0 CA-C-O 121.953 0.751 . . . . 114.68000000000001 112.843 167.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.1 t -123.56 120.25 59.47 Favored 'Isoleucine or valine' 0 C--O 1.248 0.998 0 C-N-CA 119.138 -1.025 . . . . 107.42 110.716 170.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.0 t -87.57 133.44 33.79 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 113.815 -1.539 . . . . 109.16 109.985 -178.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -89.78 3.88 51.46 Favored 'General case' 0 CA--C 1.559 1.3 0 CA-C-O 121.982 0.896 . . . . 106.18000000000001 113.27 177.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -74.57 -60.01 2.47 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 106.828 -1.545 . . . . 143.91999999999999 106.828 155.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -63.94 -22.5 66.95 Favored 'General case' 0 CA--C 1.501 -0.929 0 C-N-CA 124.176 0.991 . . . . 119.78 112.003 -179.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PHE . . . . . 0.533 ' CB ' ' CZ ' ' B' ' 98' ' ' PHE . 32.7 t80 -81.62 -42.03 20.62 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 114.251 1.204 . . . . 88.109999999999999 114.251 166.766 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.1 tpt180 -53.72 -54.41 38.4 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 116.015 -0.539 . . . . 123.92 110.595 176.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -45.2 -48.37 12.52 Favored 'General case' 0 C--O 1.205 -1.265 0 C-N-CA 124.776 1.23 . . . . 115.52 109.177 173.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -62.07 -35.91 80.07 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 121.704 -0.622 . . . . 82.840000000000003 112.654 -177.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 11.2 mt -61.19 -57.29 13.06 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 112.82 0.674 . . . . 86.140000000000001 112.82 174.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 100' ' ' ASP . 3.3 m-20 -41.24 -43.2 2.32 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.624 1.342 . . . . 97.959999999999994 114.624 171.933 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -59.32 -53.16 61.44 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.032 -1.067 . . . . 84.349999999999994 109.125 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 -61.38 -30.18 70.38 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.87 0.843 . . . . 80.609999999999999 113.223 -177.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -74.88 -45.64 41.5 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 113.436 -1.711 . . . . 105.14 106.383 -175.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 84.5 t90 -59.52 -48.08 83.05 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 113.661 0.986 . . . . 84.799999999999997 113.661 175.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 12.6 mtp180 -60.19 -35.64 75.84 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-N 116.371 -0.377 . . . . 87.629999999999995 110.415 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.4 tttp -56.14 -38.3 70.64 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 114.65 -1.159 . . . . 95.989999999999995 112.895 175.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.8 m -80.41 -19.17 46.83 Favored 'General case' 0 C--O 1.245 0.848 0 N-CA-C 115.102 1.519 . . . . 112.59999999999999 115.102 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -64.14 -6.54 6.74 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.294 1.22 . . . . 110.95 114.294 176.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.4 mmtt . . . . . 0 N--CA 1.454 -0.244 0 C-N-CA 124.569 1.147 . . . . 113.78 109.263 178.98 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.535 5.271 1 N-CA-C 124.664 4.626 . . . . 101.04000000000001 124.664 . . . . . . . . . 2 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' PRO . . . . . 0.733 ' O ' ' NH1' ' A' ' 83' ' ' ARG . 15.6 Cg_endo -61.22 153.92 56.86 Favored 'Cis proline' 0 C--N 1.365 1.425 0 C-N-CA 125.242 -0.732 . . . . 102.22 110.95 -6.709 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.27 144.72 6.95 Favored 'General case' 0 CA--C 1.57 1.74 0 N-CA-C 114.685 1.365 . . . . 115.52 114.685 -178.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 2.3 pt -117.84 149.81 20.1 Favored 'Isoleucine or valine' 0 C--O 1.247 0.942 0 C-N-CA 123.061 0.544 . . . . 102.69 111.667 175.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -32.87 154.61 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 116.976 2.213 . . . . 114.31 116.976 179.665 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 67.3 m -81.87 -47.47 12.75 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 107.362 -1.348 . . . . 131.62 107.362 -176.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -81.28 -53.45 6.34 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 113.268 -1.787 . . . . 136.99000000000001 110.7 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' TRP . . . . . . . . . . . . . 7.0 m95 -40.18 -37.53 0.64 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 115.347 1.61 . . . . 90.569999999999993 115.347 165.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -67.22 -51.31 54.85 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 109.245 -0.65 . . . . 106.83 109.245 176.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 9.0 tptm -66.71 -17.83 65.06 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 114.256 1.206 . . . . 124.27 114.256 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 13.6 mt -81.28 -32.44 33.21 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.399 0.619 . . . . 94.819999999999993 110.491 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 2.9 t -75.92 -37.48 34.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 113.85 -1.523 . . . . 82.819999999999993 110.657 177.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 15.7 mtt-85 -60.02 -36.52 77.42 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 119.611 -0.836 . . . . 104.29000000000001 109.381 172.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ASP . . . . . 0.42 ' O ' ' C ' ' B' ' 85' ' ' ALA . 0.7 OUTLIER -64.8 -65.76 0.63 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.426 -0.806 . . . . 113.43000000000001 110.955 179.925 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' B' ' 84' ' ' ASP . . . -22.4 -53.47 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 113.876 1.065 . . . . 80.230000000000004 113.876 166.185 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' MET . . . . . . . . . . . . . 30.1 mtt -58.41 -52.03 67.33 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 122.646 1.212 . . . . 86.739999999999995 111.243 -171.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 12.2 p -66.13 -24.53 66.69 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.275 -1.33 . . . . 106.23999999999999 111.632 -179.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -80.81 2.72 25.13 Favored 'General case' 0 C--O 1.247 0.939 0 O-C-N 121.911 -0.493 . . . . 108.04000000000001 110.865 169.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . 66.33 28.22 73.56 Favored Glycine 0 C--O 1.252 1.234 0 CA-C-O 121.934 0.741 . . . . 86.799999999999997 114.943 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 98.2 t -76.43 130.31 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 N-CA-C 108.676 -0.861 . . . . 76.310000000000002 108.676 168.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.23 169.33 9.86 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 107.223 -1.399 . . . . 69.040000000000006 107.223 -170.517 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -69.08 -37.16 78.3 Favored 'General case' 0 N--CA 1.397 -3.081 0 N-CA-C 105.851 -1.907 . . . . 67.129999999999995 105.851 -174.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -67.67 -39.24 84.51 Favored 'General case' 0 CA--C 1.49 -1.34 0 O-C-N 123.57 0.544 . . . . 93.379999999999995 110.61 -179.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -61.76 -51.88 66.53 Favored 'General case' 0 CA--C 1.477 -1.833 0 O-C-N 124.916 1.385 . . . . 90.379999999999995 108.419 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -59.36 -48.56 81.15 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 125.19 1.556 . . . . 61.420000000000002 115.095 176.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -46.13 -55.93 6.35 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 123.855 0.862 . . . . 80.030000000000001 112.391 168.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -55.6 -48.9 74.1 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 115.658 1.725 . . . . 77.519999999999996 115.658 177.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' PHE . . . . . 0.533 ' CZ ' ' CB ' ' A' ' 95' ' ' PHE . 11.4 t80 -42.05 -64.54 0.57 Allowed 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 124.013 0.925 . . . . 66.599999999999994 110.057 167.043 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 6.3 mt -44.74 -57.41 3.72 Favored 'General case' 0 CA--C 1.486 -1.503 0 CA-C-N 114.222 -1.354 . . . . 67.879999999999995 112.512 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -52.68 -44.4 66.22 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.683 -1.144 . . . . 74.189999999999998 111.919 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -68.6 -35.37 77.24 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-O 121.086 0.47 . . . . 79.010000000000005 111.354 178.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -67.34 -35.07 78.64 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 114.413 1.264 . . . . 82.230000000000004 114.413 175.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -70.58 -43.13 70.04 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.652 -1.61 . . . . 82.159999999999997 106.652 176.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' TRP . . . . . . . . . . . . . 87.6 t90 -60.2 -47.45 85.91 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 116.767 2.136 . . . . 93.079999999999998 116.767 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -53.01 -52.32 58.81 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-O 122.722 1.249 . . . . 107.67 113.992 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 12.6 tttm -54.04 -28.34 37.87 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 111.872 -2.422 . . . . 112.98 109.488 179.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 7.4 m -66.35 -17.79 64.97 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.353 0.871 . . . . 111.76000000000001 113.353 176.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.64 0 CA-C-O 121.162 0.506 . . . . 108.03 110.683 172.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1110 ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.52 4.258 0 N-CA-C 118.564 2.186 . . . . 123.15000000000001 118.564 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.88 130.28 17.57 Favored 'Cis proline' 0 N--CA 1.49 1.295 0 N-CA-C 115.579 1.338 . . . . 98.019999999999996 115.579 14.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.42 147.58 32.28 Favored 'General case' 0 C--O 1.262 1.755 0 CA-C-O 121.83 0.824 . . . . 82.799999999999997 110.769 -177.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 8.1 mt -82.42 98.21 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.402 0 N-CA-C 102.703 -3.073 . . . . 71.769999999999996 102.703 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 43.9 p30 -79.14 -172.97 3.38 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 106.991 -1.485 . . . . 66.659999999999997 106.991 174.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 p -87.83 -16.47 33.96 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 115.125 -0.943 . . . . 87.939999999999998 110.793 -164.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -66.5 -41.24 89.2 Favored 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 124.285 0.99 . . . . 89.819999999999993 108.721 169.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' TRP . . . . . 0.508 ' CD1' ' HE2' ' B' ' 92' ' ' LYS . 49.9 m95 -66.98 -48.17 69.33 Favored 'General case' 0 C--O 1.207 -1.142 0 O-C-N 125.848 1.967 . . . . 59.479999999999997 111.553 175.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -55.88 -38.94 70.82 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 113.09 0.774 . . . . 69.120000000000005 113.09 175.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.99 -40.25 84.28 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 115.472 1.656 . . . . 92.620000000000005 115.472 172.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.18 -50.04 44.26 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 114.563 -1.199 . . . . 57.82 109.137 -178.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . 0.529 HG22 HG21 ' B' ' 82' ' ' VAL . 84.9 t -52.69 -50.75 40.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.068 -0.969 . . . . 68.159999999999997 110.435 174.031 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ARG . . . . . 0.733 ' NH1' ' O ' ' B' ' 72' ' ' PRO . 16.6 mtm-85 -50.9 -41.67 58.71 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 112.331 0.493 . . . . 79.510000000000005 112.331 177.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -67.76 -41.32 83.54 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-O 121.898 0.856 . . . . 98.780000000000001 110.344 178.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.53 -39.17 79.41 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 113.469 0.914 . . . . 77.400000000000006 113.469 177.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' MET . . . . . 0.464 ' HG3' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -79.31 -21.23 46.23 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 123.425 0.453 . . . . 91.0 111.76 176.522 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . 0.505 ' CG2' ' O ' ' A' ' 87' ' ' THR . 1.2 m -79.33 -2.63 42.4 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.65 1.18 . . . . 102.61 112.739 177.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -140.96 174.28 10.67 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.519 1.303 . . . . 100.98999999999999 114.519 -174.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . 0.566 ' HA3' ' HD2' ' B' ' 106' ' ' LYS . . . -72.87 78.44 0.76 Allowed Glycine 0 C--O 1.261 1.793 0 CA-C-O 121.953 0.751 . . . . 114.68000000000001 112.843 167.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.1 t -123.56 120.25 59.47 Favored 'Isoleucine or valine' 0 C--O 1.248 0.998 0 C-N-CA 119.138 -1.025 . . . . 107.42 110.716 170.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.0 t -87.57 133.44 33.79 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 113.815 -1.539 . . . . 109.16 109.985 -178.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LYS . . . . . 0.631 ' HB3' HD11 ' B' ' 81' ' ' LEU . 3.4 mtmt -89.78 3.88 51.46 Favored 'General case' 0 CA--C 1.559 1.3 0 CA-C-O 121.982 0.896 . . . . 106.18000000000001 113.27 177.779 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 27.0 tttt -74.57 -60.01 2.47 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 106.828 -1.545 . . . . 143.91999999999999 106.828 155.318 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -63.94 -22.5 66.95 Favored 'General case' 0 CA--C 1.501 -0.929 0 C-N-CA 124.176 0.991 . . . . 119.78 112.003 -179.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PHE . . . . . 0.845 ' HB2' ' CZ ' ' B' ' 98' ' ' PHE . 32.7 t80 -81.62 -42.03 20.62 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 114.251 1.204 . . . . 88.109999999999999 114.251 166.766 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' A' ' 92' ' ' LYS . 3.1 tpt180 -53.72 -54.41 38.4 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 116.015 -0.539 . . . . 123.92 110.595 176.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 93' ' ' LYS . 41.9 mt-10 -45.2 -48.37 12.52 Favored 'General case' 0 C--O 1.205 -1.265 0 C-N-CA 124.776 1.23 . . . . 115.52 109.177 173.271 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -62.07 -35.91 80.07 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 121.704 -0.622 . . . . 82.840000000000003 112.654 -177.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 11.2 mt -61.19 -57.29 13.06 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 112.82 0.674 . . . . 86.140000000000001 112.82 174.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . 0.455 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 3.3 m-20 -41.24 -43.2 2.32 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.624 1.342 . . . . 97.959999999999994 114.624 171.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -59.32 -53.16 61.44 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.032 -1.067 . . . . 84.349999999999994 109.125 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 -61.38 -30.18 70.38 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.87 0.843 . . . . 80.609999999999999 113.223 -177.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -74.88 -45.64 41.5 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 113.436 -1.711 . . . . 105.14 106.383 -175.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 84.5 t90 -59.52 -48.08 83.05 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 113.661 0.986 . . . . 84.799999999999997 113.661 175.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 12.6 mtp180 -60.19 -35.64 75.84 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-N 116.371 -0.377 . . . . 87.629999999999995 110.415 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.4 tttp -56.14 -38.3 70.64 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 114.65 -1.159 . . . . 95.989999999999995 112.895 175.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.8 m -80.41 -19.17 46.83 Favored 'General case' 0 C--O 1.245 0.848 0 N-CA-C 115.102 1.519 . . . . 112.59999999999999 115.102 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -64.14 -6.54 6.74 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.294 1.22 . . . . 110.95 114.294 176.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.4 mmtt . . . . . 0 N--CA 1.454 -0.244 0 C-N-CA 124.569 1.147 . . . . 113.78 109.263 178.98 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.535 5.271 1 N-CA-C 124.664 4.626 . . . . 101.04000000000001 124.664 . . . . . . . . . 2 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' PRO . . . . . 0.733 ' O ' ' NH1' ' A' ' 83' ' ' ARG . 15.6 Cg_endo -61.22 153.92 56.86 Favored 'Cis proline' 0 C--N 1.365 1.425 0 C-N-CA 125.242 -0.732 . . . . 102.22 110.95 -6.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.27 144.72 6.95 Favored 'General case' 0 CA--C 1.57 1.74 0 N-CA-C 114.685 1.365 . . . . 115.52 114.685 -178.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 2.3 pt -117.84 149.81 20.1 Favored 'Isoleucine or valine' 0 C--O 1.247 0.942 0 C-N-CA 123.061 0.544 . . . . 102.69 111.667 175.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ASP . . . . . 1.064 ' HB3' ' HB2' ' B' ' 78' ' ' TRP . 0.5 OUTLIER -32.87 154.61 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 116.976 2.213 . . . . 114.31 116.976 179.665 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 67.3 m -81.87 -47.47 12.75 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 107.362 -1.348 . . . . 131.62 107.362 -176.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -81.28 -53.45 6.34 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 113.268 -1.787 . . . . 136.99000000000001 110.7 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' TRP . . . . . 1.064 ' HB2' ' HB3' ' B' ' 75' ' ' ASP . 7.0 m95 -40.18 -37.53 0.64 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 115.347 1.61 . . . . 90.569999999999993 115.347 165.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' B' ' 83' ' ' ARG . 4.9 tt0 -67.22 -51.31 54.85 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 109.245 -0.65 . . . . 106.83 109.245 176.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 9.0 tptm -66.71 -17.83 65.06 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 114.256 1.206 . . . . 124.27 114.256 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LEU . . . . . 0.693 HD13 ' HD2' ' A' ' 95' ' ' PHE . 13.6 mt -81.28 -32.44 33.21 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.399 0.619 . . . . 94.819999999999993 110.491 179.431 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' VAL . . . . . 0.536 ' O ' ' HG3' ' B' ' 86' ' ' MET . 2.9 t -75.92 -37.48 34.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 113.85 -1.523 . . . . 82.819999999999993 110.657 177.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' B' ' 79' ' ' GLU . 15.7 mtt-85 -60.02 -36.52 77.42 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 119.611 -0.836 . . . . 104.29000000000001 109.381 172.663 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ASP . . . . . 0.42 ' O ' ' C ' ' B' ' 85' ' ' ALA . 0.7 OUTLIER -64.8 -65.76 0.63 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.426 -0.806 . . . . 113.43000000000001 110.955 179.925 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' B' ' 84' ' ' ASP . . . -22.4 -53.47 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 113.876 1.065 . . . . 80.230000000000004 113.876 166.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' MET . . . . . 0.536 ' HG3' ' O ' ' B' ' 82' ' ' VAL . 30.1 mtt -58.41 -52.03 67.33 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 122.646 1.212 . . . . 86.739999999999995 111.243 -171.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 12.2 p -66.13 -24.53 66.69 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.275 -1.33 . . . . 106.23999999999999 111.632 -179.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -80.81 2.72 25.13 Favored 'General case' 0 C--O 1.247 0.939 0 O-C-N 121.911 -0.493 . . . . 108.04000000000001 110.865 169.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . 66.33 28.22 73.56 Favored Glycine 0 C--O 1.252 1.234 0 CA-C-O 121.934 0.741 . . . . 86.799999999999997 114.943 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 98.2 t -76.43 130.31 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 N-CA-C 108.676 -0.861 . . . . 76.310000000000002 108.676 168.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.23 169.33 9.86 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 107.223 -1.399 . . . . 69.040000000000006 107.223 -170.517 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' LYS . . . . . 0.508 ' HE2' ' CD1' ' A' ' 78' ' ' TRP . 56.8 mttt -69.08 -37.16 78.3 Favored 'General case' 0 N--CA 1.397 -3.081 0 N-CA-C 105.851 -1.907 . . . . 67.129999999999995 105.851 -174.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -67.67 -39.24 84.51 Favored 'General case' 0 CA--C 1.49 -1.34 0 O-C-N 123.57 0.544 . . . . 93.379999999999995 110.61 -179.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -61.76 -51.88 66.53 Favored 'General case' 0 CA--C 1.477 -1.833 0 O-C-N 124.916 1.385 . . . . 90.379999999999995 108.419 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -59.36 -48.56 81.15 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 125.19 1.556 . . . . 61.420000000000002 115.095 176.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' B' ' 99' ' ' LEU . 6.9 tpm_? -46.13 -55.93 6.35 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 123.855 0.862 . . . . 80.030000000000001 112.391 168.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -55.6 -48.9 74.1 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 115.658 1.725 . . . . 77.519999999999996 115.658 177.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' PHE . . . . . 0.845 ' CZ ' ' HB2' ' A' ' 95' ' ' PHE . 11.4 t80 -42.05 -64.54 0.57 Allowed 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 124.013 0.925 . . . . 66.599999999999994 110.057 167.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' LEU . . . . . 0.532 ' HB2' ' O ' ' B' ' 96' ' ' ARG . 6.3 mt -44.74 -57.41 3.72 Favored 'General case' 0 CA--C 1.486 -1.503 0 CA-C-N 114.222 -1.354 . . . . 67.879999999999995 112.512 179.06 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -52.68 -44.4 66.22 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.683 -1.144 . . . . 74.189999999999998 111.919 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -68.6 -35.37 77.24 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-O 121.086 0.47 . . . . 79.010000000000005 111.354 178.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -67.34 -35.07 78.64 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 114.413 1.264 . . . . 82.230000000000004 114.413 175.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 99' ' ' LEU . 8.6 mtmp? -70.58 -43.13 70.04 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.652 -1.61 . . . . 82.159999999999997 106.652 176.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' TRP . . . . . . . . . . . . . 87.6 t90 -60.2 -47.45 85.91 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 116.767 2.136 . . . . 93.079999999999998 116.767 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -53.01 -52.32 58.81 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-O 122.722 1.249 . . . . 107.67 113.992 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' LYS . . . . . 0.566 ' HD2' ' HA3' ' A' ' 89' ' ' GLY . 12.6 tttm -54.04 -28.34 37.87 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 111.872 -2.422 . . . . 112.98 109.488 179.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 7.4 m -66.35 -17.79 64.97 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.353 0.871 . . . . 111.76000000000001 113.353 176.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 . . . . . 0 N--CA 1.472 0.64 0 CA-C-O 121.162 0.506 . . . . 108.03 110.683 172.102 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1110 ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.52 4.258 0 N-CA-C 118.564 2.186 . . . . 123.15000000000001 118.564 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.88 130.28 17.57 Favored 'Cis proline' 0 N--CA 1.49 1.295 0 N-CA-C 115.579 1.338 . . . . 98.019999999999996 115.579 14.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.42 147.58 32.28 Favored 'General case' 0 C--O 1.262 1.755 0 CA-C-O 121.83 0.824 . . . . 82.799999999999997 110.769 -177.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 8.1 mt -82.42 98.21 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.402 0 N-CA-C 102.703 -3.073 . . . . 71.769999999999996 102.703 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 43.9 p30 -79.14 -172.97 3.38 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 106.991 -1.485 . . . . 66.659999999999997 106.991 174.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 p -87.83 -16.47 33.96 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 115.125 -0.943 . . . . 87.939999999999998 110.793 -164.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -66.5 -41.24 89.2 Favored 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 124.285 0.99 . . . . 89.819999999999993 108.721 169.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.508 ' CD1' ' HE2' ' B' ' 92' ' ' LYS . 49.9 m95 -66.98 -48.17 69.33 Favored 'General case' 0 C--O 1.207 -1.142 0 O-C-N 125.848 1.967 . . . . 59.479999999999997 111.553 175.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -55.88 -38.94 70.82 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 113.09 0.774 . . . . 69.120000000000005 113.09 175.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.99 -40.25 84.28 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 115.472 1.656 . . . . 92.620000000000005 115.472 172.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.18 -50.04 44.26 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 114.563 -1.199 . . . . 57.82 109.137 -178.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.529 HG22 HG21 ' B' ' 82' ' ' VAL . 84.9 t -52.69 -50.75 40.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.068 -0.969 . . . . 68.159999999999997 110.435 174.031 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.733 ' NH1' ' O ' ' B' ' 72' ' ' PRO . 16.6 mtm-85 -50.9 -41.67 58.71 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 112.331 0.493 . . . . 79.510000000000005 112.331 177.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -67.76 -41.32 83.54 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-O 121.898 0.856 . . . . 98.780000000000001 110.344 178.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.53 -39.17 79.41 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 113.469 0.914 . . . . 77.400000000000006 113.469 177.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' MET . . . . . 0.464 ' HG3' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -79.31 -21.23 46.23 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 123.425 0.453 . . . . 91.0 111.76 176.522 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . 0.505 ' CG2' ' O ' ' A' ' 87' ' ' THR . 1.2 m -79.33 -2.63 42.4 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.65 1.18 . . . . 102.61 112.739 177.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -140.96 174.28 10.67 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.519 1.303 . . . . 100.98999999999999 114.519 -174.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.566 ' HA3' ' HD2' ' B' ' 106' ' ' LYS . . . -72.87 78.44 0.76 Allowed Glycine 0 C--O 1.261 1.793 0 CA-C-O 121.953 0.751 . . . . 114.68000000000001 112.843 167.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.1 t -123.56 120.25 59.47 Favored 'Isoleucine or valine' 0 C--O 1.248 0.998 0 C-N-CA 119.138 -1.025 . . . . 107.42 110.716 170.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.0 t -87.57 133.44 33.79 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 113.815 -1.539 . . . . 109.16 109.985 -178.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.631 ' HB3' HD11 ' B' ' 81' ' ' LEU . 3.4 mtmt -89.78 3.88 51.46 Favored 'General case' 0 CA--C 1.559 1.3 0 CA-C-O 121.982 0.896 . . . . 106.18000000000001 113.27 177.779 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' A' ' 97' ' ' GLU . 27.0 tttt -74.57 -60.01 2.47 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 106.828 -1.545 . . . . 143.91999999999999 106.828 155.318 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -63.94 -22.5 66.95 Favored 'General case' 0 CA--C 1.501 -0.929 0 C-N-CA 124.176 0.991 . . . . 119.78 112.003 -179.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.845 ' HB2' ' CZ ' ' B' ' 98' ' ' PHE . 32.7 t80 -81.62 -42.03 20.62 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 114.251 1.204 . . . . 88.109999999999999 114.251 166.766 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' A' ' 92' ' ' LYS . 3.1 tpt180 -53.72 -54.41 38.4 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 116.015 -0.539 . . . . 123.92 110.595 176.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 93' ' ' LYS . 41.9 mt-10 -45.2 -48.37 12.52 Favored 'General case' 0 C--O 1.205 -1.265 0 C-N-CA 124.776 1.23 . . . . 115.52 109.177 173.271 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -62.07 -35.91 80.07 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 121.704 -0.622 . . . . 82.840000000000003 112.654 -177.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 11.2 mt -61.19 -57.29 13.06 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 112.82 0.674 . . . . 86.140000000000001 112.82 174.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.455 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 3.3 m-20 -41.24 -43.2 2.32 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.624 1.342 . . . . 97.959999999999994 114.624 171.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -59.32 -53.16 61.44 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.032 -1.067 . . . . 84.349999999999994 109.125 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 -61.38 -30.18 70.38 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.87 0.843 . . . . 80.609999999999999 113.223 -177.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -74.88 -45.64 41.5 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 113.436 -1.711 . . . . 105.14 106.383 -175.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 84.5 t90 -59.52 -48.08 83.05 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 113.661 0.986 . . . . 84.799999999999997 113.661 175.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 12.6 mtp180 -60.19 -35.64 75.84 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-N 116.371 -0.377 . . . . 87.629999999999995 110.415 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.4 tttp -56.14 -38.3 70.64 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 114.65 -1.159 . . . . 95.989999999999995 112.895 175.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.8 m -80.41 -19.17 46.83 Favored 'General case' 0 C--O 1.245 0.848 0 N-CA-C 115.102 1.519 . . . . 112.59999999999999 115.102 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -64.14 -6.54 6.74 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.294 1.22 . . . . 110.95 114.294 176.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.4 mmtt . . . . . 0 N--CA 1.454 -0.244 0 C-N-CA 124.569 1.147 . . . . 113.78 109.263 178.98 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.535 5.271 1 N-CA-C 124.664 4.626 . . . . 101.04000000000001 124.664 . . . . . . . . . 2 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.733 ' O ' ' NH1' ' A' ' 83' ' ' ARG . 15.6 Cg_endo -61.22 153.92 56.86 Favored 'Cis proline' 0 C--N 1.365 1.425 0 C-N-CA 125.242 -0.732 . . . . 102.22 110.95 -6.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.27 144.72 6.95 Favored 'General case' 0 CA--C 1.57 1.74 0 N-CA-C 114.685 1.365 . . . . 115.52 114.685 -178.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 2.3 pt -117.84 149.81 20.1 Favored 'Isoleucine or valine' 0 C--O 1.247 0.942 0 C-N-CA 123.061 0.544 . . . . 102.69 111.667 175.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ASP . . . . . 1.064 ' HB3' ' HB2' ' B' ' 78' ' ' TRP . 0.5 OUTLIER -32.87 154.61 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 116.976 2.213 . . . . 114.31 116.976 179.665 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 67.3 m -81.87 -47.47 12.75 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 107.362 -1.348 . . . . 131.62 107.362 -176.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -81.28 -53.45 6.34 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 113.268 -1.787 . . . . 136.99000000000001 110.7 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' TRP . . . . . 1.064 ' HB2' ' HB3' ' B' ' 75' ' ' ASP . 7.0 m95 -40.18 -37.53 0.64 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 115.347 1.61 . . . . 90.569999999999993 115.347 165.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' B' ' 83' ' ' ARG . 4.9 tt0 -67.22 -51.31 54.85 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 109.245 -0.65 . . . . 106.83 109.245 176.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 9.0 tptm -66.71 -17.83 65.06 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 114.256 1.206 . . . . 124.27 114.256 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.693 HD13 ' HD2' ' A' ' 95' ' ' PHE . 13.6 mt -81.28 -32.44 33.21 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.399 0.619 . . . . 94.819999999999993 110.491 179.431 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' VAL . . . . . 0.536 ' O ' ' HG3' ' B' ' 86' ' ' MET . 2.9 t -75.92 -37.48 34.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 113.85 -1.523 . . . . 82.819999999999993 110.657 177.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' B' ' 79' ' ' GLU . 15.7 mtt-85 -60.02 -36.52 77.42 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 119.611 -0.836 . . . . 104.29000000000001 109.381 172.663 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ASP . . . . . 0.42 ' O ' ' C ' ' B' ' 85' ' ' ALA . 0.7 OUTLIER -64.8 -65.76 0.63 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.426 -0.806 . . . . 113.43000000000001 110.955 179.925 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' B' ' 84' ' ' ASP . . . -22.4 -53.47 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 113.876 1.065 . . . . 80.230000000000004 113.876 166.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' MET . . . . . 0.536 ' HG3' ' O ' ' B' ' 82' ' ' VAL . 30.1 mtt -58.41 -52.03 67.33 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 122.646 1.212 . . . . 86.739999999999995 111.243 -171.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 12.2 p -66.13 -24.53 66.69 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.275 -1.33 . . . . 106.23999999999999 111.632 -179.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -80.81 2.72 25.13 Favored 'General case' 0 C--O 1.247 0.939 0 O-C-N 121.911 -0.493 . . . . 108.04000000000001 110.865 169.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . 66.33 28.22 73.56 Favored Glycine 0 C--O 1.252 1.234 0 CA-C-O 121.934 0.741 . . . . 86.799999999999997 114.943 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 98.2 t -76.43 130.31 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 N-CA-C 108.676 -0.861 . . . . 76.310000000000002 108.676 168.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.23 169.33 9.86 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 107.223 -1.399 . . . . 69.040000000000006 107.223 -170.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.508 ' HE2' ' CD1' ' A' ' 78' ' ' TRP . 56.8 mttt -69.08 -37.16 78.3 Favored 'General case' 0 N--CA 1.397 -3.081 0 N-CA-C 105.851 -1.907 . . . . 67.129999999999995 105.851 -174.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -67.67 -39.24 84.51 Favored 'General case' 0 CA--C 1.49 -1.34 0 O-C-N 123.57 0.544 . . . . 93.379999999999995 110.61 -179.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -61.76 -51.88 66.53 Favored 'General case' 0 CA--C 1.477 -1.833 0 O-C-N 124.916 1.385 . . . . 90.379999999999995 108.419 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -59.36 -48.56 81.15 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 125.19 1.556 . . . . 61.420000000000002 115.095 176.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' B' ' 99' ' ' LEU . 6.9 tpm_? -46.13 -55.93 6.35 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 123.855 0.862 . . . . 80.030000000000001 112.391 168.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -55.6 -48.9 74.1 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 115.658 1.725 . . . . 77.519999999999996 115.658 177.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' PHE . . . . . 0.845 ' CZ ' ' HB2' ' A' ' 95' ' ' PHE . 11.4 t80 -42.05 -64.54 0.57 Allowed 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 124.013 0.925 . . . . 66.599999999999994 110.057 167.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.532 ' HB2' ' O ' ' B' ' 96' ' ' ARG . 6.3 mt -44.74 -57.41 3.72 Favored 'General case' 0 CA--C 1.486 -1.503 0 CA-C-N 114.222 -1.354 . . . . 67.879999999999995 112.512 179.06 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -52.68 -44.4 66.22 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.683 -1.144 . . . . 74.189999999999998 111.919 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -68.6 -35.37 77.24 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-O 121.086 0.47 . . . . 79.010000000000005 111.354 178.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -67.34 -35.07 78.64 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 114.413 1.264 . . . . 82.230000000000004 114.413 175.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 99' ' ' LEU . 8.6 mtmp? -70.58 -43.13 70.04 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.652 -1.61 . . . . 82.159999999999997 106.652 176.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' TRP . . . . . . . . . . . . . 87.6 t90 -60.2 -47.45 85.91 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 116.767 2.136 . . . . 93.079999999999998 116.767 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -53.01 -52.32 58.81 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-O 122.722 1.249 . . . . 107.67 113.992 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.566 ' HD2' ' HA3' ' A' ' 89' ' ' GLY . 12.6 tttm -54.04 -28.34 37.87 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 111.872 -2.422 . . . . 112.98 109.488 179.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' SER . . . . . 0.488 ' HB2' HE21 ' B' ' 108' ' ' GLN . 7.4 m -66.35 -17.79 64.97 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.353 0.871 . . . . 111.76000000000001 113.353 176.072 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' GLN . . . . . 0.488 HE21 ' HB2' ' B' ' 107' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.64 0 CA-C-O 121.162 0.506 . . . . 108.03 110.683 172.102 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1110 ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_