data_6iya_residue ############################ # Computer software used # ############################ 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 6iya _Structure_validation_residue.Date_analyzed 2019-01-11 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 ' 2' ' ' SER . . . . . . . . . . . . . 67.4 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.7 0.285 . . . . 100.44 111.202 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 56.1 p -90.1 -176.95 5.03 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.867 0.841 . . . . 94.06 110.381 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 14.7 mm -126.76 139.05 52.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 109.002 -0.74 . . . . 77.73 109.002 -174.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . 0.601 ' N ' ' O ' ' B' ' 11' ' ' LEU . 75.7 mmtt -111.37 116.57 50.72 Favored Pre-proline 0 C--O 1.24 0.577 0 C-N-CA 123.436 0.694 . . . . 70.35 110.034 178.459 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -83.21 119.78 2.82 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 120.654 0.903 . . . . 65.47 110.911 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.4 m -108.55 142.35 21.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.599 -0.889 . . . . 50.98 108.599 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 31.6 t -93.85 122.59 36.49 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.657 -0.868 . . . . 50.58 108.657 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.0 t -114.72 116.6 53.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 108.302 -0.999 . . . . 46.87 108.302 -177.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -78.58 107.34 11.17 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.805 -0.813 . . . . 70.3 108.805 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.6 mt -113.82 141.31 47.47 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 122.97 0.508 . . . . 60.62 109.954 177.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -72.73 158.44 35.59 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.694 0.759 . . . . 58.27 110.074 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.01 -28.24 69.97 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.45 -0.795 . . . . 54.16 112.127 -174.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.48 -47.52 66.87 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.537 -0.465 . . . . 62.03 111.174 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.1 mm -72.09 -37.56 60.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 C-N-CA 120.293 -0.563 . . . . 46.0 110.607 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . 0.566 ' NZ ' ' OE2' ' A' ' 20' ' ' GLU . 58.7 tttm -65.15 -33.18 75.41 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.847 -0.533 . . . . 66.11 112.04 -179.421 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.13 -37.71 61.3 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.075 -0.65 . . . . 56.65 111.672 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -69.47 -27.87 65.6 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.689 -0.804 . . . . 43.38 111.573 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -71.48 -37.64 65.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.477 -0.489 . . . . 55.04 110.325 177.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . 0.566 ' OE2' ' NZ ' ' A' ' 16' ' ' LYS . 94.2 mt-10 -72.66 -24.97 61.1 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 121.762 -0.586 . . . . 63.66 112.324 -179.564 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -73.53 -40.77 63.75 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.549 -0.461 . . . . 57.49 111.317 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.56 -32.59 74.04 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 111.939 0.348 . . . . 61.47 111.939 -177.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.09 -33.36 74.38 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 119.877 -0.729 . . . . 68.89 111.751 -179.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -72.53 -31.35 65.24 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 118.283 -1.367 . . . . 81.05 111.439 177.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.0 p -81.21 -22.3 38.94 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.775 0.657 . . . . 62.84 112.775 -177.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ARG . . . . . 0.486 ' NH1' ' OE1' ' B' ' 45' ' ' GLU . 88.9 mtt180 -112.99 21.49 15.37 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.25 0.62 . . . . 56.6 112.17 176.04 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt 50.61 19.22 0.56 Allowed 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.071 1.137 . . . . 68.33 114.071 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -90.96 -178.86 5.32 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.635 0.731 . . . . 73.85 109.553 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 83.5 p -113.01 145.64 40.49 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.299 -0.63 . . . . 48.9 109.299 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.5 p -61.13 -31.12 70.83 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.796 -0.638 . . . . 46.55 111.598 -177.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -70.92 -36.57 72.72 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.14 -0.624 . . . . 57.36 111.359 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 85.2 t90 -68.33 -37.07 80.18 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.374 -0.53 . . . . 63.4 111.699 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 14.1 mtm -71.36 -33.29 69.44 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.384 -0.927 . . . . 37.87 111.876 -177.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 15.3 mtt -66.83 -34.25 77.4 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.541 -0.864 . . . . 37.52 110.852 177.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 49.6 mtm180 -65.9 -43.88 86.9 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.504 -0.478 . . . . 75.3 110.908 173.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -67.42 -34.15 76.63 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.429 -0.508 . . . . 36.96 111.692 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.7 -44.34 93.94 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.348 -0.541 . . . . 34.66 110.86 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 92.1 mt -68.25 -44.17 84.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 C-N-CA 120.645 -0.422 . . . . 42.92 110.547 177.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 19.4 ttp180 -58.88 -48.69 80.53 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.887 -0.508 . . . . 80.81 111.342 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -66.37 -28.35 68.58 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.274 -0.57 . . . . 40.52 111.918 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -66.92 -47.93 70.23 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.573 -0.451 . . . . 28.75 111.433 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.6 t -66.14 -42.75 91.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 119.82 -0.752 . . . . 32.86 110.355 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.37 -43.14 92.9 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.587 -0.445 . . . . 69.72 111.398 -178.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 38.1 ttp-105 -70.55 -44.62 67.09 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.907 -0.717 . . . . 53.57 111.573 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -76.23 -27.81 56.92 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.99 0.737 . . . . 47.93 112.99 -173.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -75.63 -33.26 60.47 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.585 -0.846 . . . . 61.64 112.056 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -71.56 -13.82 61.9 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.458 0.54 . . . . 75.93 112.458 175.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -87.35 -5.69 58.79 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.851 0.686 . . . . 71.44 112.851 173.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 118.304 0.502 . . . . 93.32 110.882 178.502 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 48.3 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.78 0.324 . . . . 106.36 110.94 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 15.2 p -108.72 32.89 4.53 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.883 0.473 . . . . 95.38 111.54 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.06 110.72 1.45 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 109.368 -0.604 . . . . 91.79 109.368 178.173 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -124.0 115.36 27.73 Favored Pre-proline 0 C--O 1.245 0.825 0 N-CA-C 108.954 -0.758 . . . . 89.69 108.954 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -82.43 117.92 2.82 Favored 'Trans proline' 0 C--N 1.331 -0.343 0 C-N-CA 121.474 1.449 . . . . 75.78 109.456 177.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -109.98 139.77 31.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 109.054 -0.721 . . . . 70.18 109.054 178.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 73.9 m -94.6 123.31 37.96 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.656 -0.868 . . . . 85.29 108.656 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.18 118.14 57.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 107.899 -1.148 . . . . 54.61 107.899 -178.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -76.33 106.6 8.05 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.672 -0.862 . . . . 61.26 108.672 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 5' ' ' LYS . 88.4 mt -113.51 140.36 48.2 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.074 0.549 . . . . 54.45 110.079 178.315 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -73.32 159.65 33.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 119.669 -0.812 . . . . 69.04 110.05 175.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.99 -26.94 68.51 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.356 -0.838 . . . . 50.41 111.998 -174.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.66 -48.52 66.43 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.579 -0.448 . . . . 75.34 110.879 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 21.6 mm -72.77 -35.86 51.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 C-N-CA 120.555 -0.458 . . . . 58.42 110.274 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -34.37 77.78 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 122.022 -0.423 . . . . 70.64 111.615 -179.547 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.23 -38.63 50.79 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.386 -0.526 . . . . 49.38 112.027 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -69.73 -28.67 66.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 119.755 -0.778 . . . . 52.9 112.033 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -71.5 -38.96 70.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 119.737 -0.785 . . . . 41.14 110.297 177.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -73.77 -36.12 65.06 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.167 -0.613 . . . . 67.09 111.399 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -63.45 -50.42 69.83 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.37 -0.532 . . . . 61.21 110.99 176.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.75 -35.01 65.73 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.859 -0.336 . . . . 39.32 111.129 175.603 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.64 -34.02 71.6 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.376 0.51 . . . . 34.68 112.376 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -70.47 -31.15 68.17 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.553 -0.459 . . . . 76.79 111.739 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 38.0 p -78.86 -20.24 50.03 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.193 0.812 . . . . 72.28 113.193 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -113.1 2.13 15.56 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 114.552 1.316 . . . . 45.62 114.552 177.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.1 13.24 7.63 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 125.601 1.561 . . . . 66.49 114.825 176.974 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ARG . . . . . 0.594 ' NH1' ' O ' ' F' ' 48' ' ' ARG . 21.3 mmt180 -99.51 144.78 28.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 119.265 0.939 . . . . 35.77 108.515 166.019 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 5.7 p -66.47 150.74 48.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.65 0.738 . . . . 33.7 111.573 -175.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 79.8 p -60.09 -30.09 69.01 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.333 -0.849 . . . . 49.03 111.396 175.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -69.59 -34.71 74.52 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.861 -0.336 . . . . 39.93 111.393 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -67.17 -37.63 84.06 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.606 -0.438 . . . . 35.42 111.24 179.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' MET . . . . . . . . . . . . . 13.3 mtm -72.29 -32.0 66.22 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.735 -0.786 . . . . 49.45 112.275 -178.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' MET . . . . . . . . . . . . . 70.6 mtm -67.63 -36.6 81.1 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.365 -0.934 . . . . 34.23 111.044 178.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -67.45 -37.98 83.78 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.99 -0.684 . . . . 72.31 110.923 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -72.62 -33.14 66.46 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.482 -0.487 . . . . 71.96 111.541 176.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.59 -44.7 95.65 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.577 -0.449 . . . . 33.94 111.083 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 89.9 mt -68.04 -41.52 84.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 120.657 -0.417 . . . . 38.98 110.533 178.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ARG . . . . . . . . . . . . . 56.9 ttm-85 -60.34 -42.65 96.12 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 121.885 -0.509 . . . . 71.63 111.528 -177.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -69.5 -28.52 66.12 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.268 -0.573 . . . . 49.61 111.933 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -66.88 -47.84 70.6 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.793 -0.363 . . . . 52.36 111.366 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -66.05 -44.08 92.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 119.97 -0.692 . . . . 52.05 110.906 179.39 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.93 -42.95 95.1 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.256 -0.578 . . . . 36.65 111.222 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 37.8 ttp-105 -69.89 -44.63 69.35 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.002 -0.679 . . . . 38.7 111.345 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . 0.486 ' OE1' ' NH1' ' A' ' 26' ' ' ARG . 80.7 mm-40 -75.71 -25.11 56.35 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.414 0.524 . . . . 54.96 112.414 -175.327 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -72.64 -34.19 67.11 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 119.528 -0.869 . . . . 58.3 111.367 178.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -72.17 -13.41 61.54 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.607 0.595 . . . . 55.07 112.607 175.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ARG . . . . . 0.495 ' NH1' ' OE2' ' C' ' 45' ' ' GLU . 98.8 mtt180 -87.42 -4.96 59.03 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 113.002 0.742 . . . . 60.68 113.002 172.731 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 C--N 1.331 -0.225 0 CA-C-N 118.263 0.483 . . . . 78.94 110.962 178.006 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' LYS . . . . . . . . . . . . . 11.8 mmmm . . . . . 0 C--O 1.23 0.07 0 N-CA-C 110.175 -0.306 . . . . 88.8 110.175 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -83.03 120.1 2.94 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 120.633 0.889 . . . . 80.32 111.794 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -108.09 140.18 27.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 108.692 -0.855 . . . . 72.48 108.692 176.731 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' SER . . . . . 0.595 ' O ' ' NE2' ' D' ' 31' ' ' HIS . 63.0 p -94.13 123.63 37.64 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.726 -0.842 . . . . 81.17 108.726 178.25 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' VAL . . . . . 0.416 ' N ' ' O ' ' D' ' 7' ' ' VAL . 61.6 t -112.69 115.81 50.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 N-CA-C 108.133 -1.062 . . . . 66.64 108.133 -177.163 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -79.18 108.28 12.56 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.184 -0.672 . . . . 83.78 109.184 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' LEU . . . . . . . . . . . . . 91.2 mt -112.54 142.26 45.33 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.421 0.688 . . . . 55.93 109.63 177.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -70.93 159.29 34.96 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.936 0.874 . . . . 70.71 110.608 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.22 -26.8 68.56 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.142 -0.935 . . . . 78.3 112.257 -173.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -68.0 -49.18 63.15 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.108 -0.637 . . . . 91.38 111.137 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 mp -73.94 -35.27 41.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.599 -0.44 . . . . 59.38 111.262 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -62.91 -34.57 77.71 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 121.741 -0.599 . . . . 69.16 111.517 -178.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.34 -35.74 58.59 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.75 -0.38 . . . . 48.68 111.015 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -67.3 -30.47 70.33 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 111.814 0.301 . . . . 50.24 111.814 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.22 -37.39 45.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 120.652 -0.419 . . . . 42.62 110.558 176.569 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -71.55 -40.61 69.91 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 121.773 -0.58 . . . . 59.6 111.237 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -64.34 -37.63 88.19 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.364 -0.534 . . . . 68.86 111.052 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.63 -37.71 76.91 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.294 -0.563 . . . . 39.63 111.089 178.794 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.22 -30.72 67.88 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.079 -0.648 . . . . 49.43 110.791 176.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -68.42 -33.63 74.55 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 111.906 0.336 . . . . 91.43 111.906 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.53 -24.03 36.88 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.601 0.963 . . . . 57.04 113.601 -176.879 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ARG . . . . . 0.445 ' NH1' ' OE1' ' D' ' 45' ' ' GLU 0.535 88.1 mtt180 -92.01 1.99 56.84 Favored 'General case' 0 C--N 1.33 -0.258 1 N-CA-C 121.958 4.058 . . . . 42.78 121.958 176.244 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt 51.77 50.13 19.34 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 129.58 3.152 . . . . 65.91 117.495 -162.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 mtt85 -137.31 175.53 9.52 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.501 0.667 . . . . 72.41 110.85 -179.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 29.0 t -92.88 145.1 24.64 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.405 -0.816 . . . . 54.49 110.96 -175.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -69.87 -30.68 68.2 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.777 -0.647 . . . . 50.32 111.605 179.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' HIS . . . . . 0.486 ' NE2' ' O ' ' D' ' 8' ' ' SER . 1.4 m80 -70.47 -35.77 73.48 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.351 -0.54 . . . . 82.55 111.177 177.924 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' TRP . . . . . . . . . . . . . 82.4 t90 -66.87 -36.39 82.19 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.658 -0.417 . . . . 44.14 111.068 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' MET . . . . . . . . . . . . . 12.3 mtm -70.34 -32.83 70.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.415 -0.514 . . . . 43.13 111.559 -178.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' MET . . . . . . . . . . . . . 15.3 mtm -68.35 -34.49 76.18 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.181 -0.608 . . . . 42.24 111.58 177.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' ARG . . . . . . . . . . . . . 48.3 mtm180 -66.46 -48.34 70.22 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.352 -0.539 . . . . 85.07 111.188 175.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' GLU . . . . . 0.421 ' OE1' ' NH2' ' C' ' 39' ' ' ARG . 63.2 mm-40 -61.24 -31.46 71.25 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.478 -0.489 . . . . 82.09 111.494 177.937 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.07 -44.71 88.04 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.335 -0.546 . . . . 38.4 111.026 174.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' ILE . . . . . . . . . . . . . 87.1 mt -69.02 -35.56 69.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-O 120.863 0.364 . . . . 39.64 110.485 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' ARG . . . . . 0.567 ' NH1' ' O ' ' C' ' 101' ' ' HOH . 55.1 ttm-85 -66.72 -43.24 84.77 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.439 -0.505 . . . . 42.53 111.391 -179.081 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -71.19 -28.59 64.33 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.992 -0.683 . . . . 56.42 111.83 179.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -66.45 -47.79 72.02 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.563 -0.455 . . . . 35.62 111.136 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 9.8 m -66.86 -42.82 89.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 119.949 -0.7 . . . . 46.91 110.62 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -60.58 -43.07 97.75 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.883 -0.51 . . . . 51.09 111.647 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' ARG . . . . . . . . . . . . . 38.4 ttp-105 -68.76 -43.81 75.03 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.062 -0.655 . . . . 50.4 111.155 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' GLU . . . . . 0.534 ' OE1' ' NH1' ' D' ' 26' ' ' ARG . 80.3 mm-40 -75.17 -23.69 57.77 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.49 0.552 . . . . 42.51 112.49 -176.27 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -72.76 -35.52 67.48 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.203 -0.599 . . . . 54.77 111.387 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -72.4 -13.15 61.39 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.262 -0.575 . . . . 94.39 112.386 174.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -85.98 -5.53 59.21 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.351 0.5 . . . . 55.55 112.351 173.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 . . . . . 0 C--N 1.33 -0.256 0 CA-C-O 120.802 0.334 . . . . 96.62 110.468 177.051 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.155 0 N-CA-C 110.059 -0.348 . . . . 94.71 110.059 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' ILE . . . . . . . . . . . . . 4.8 mp -133.92 101.94 4.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 106.675 -1.602 . . . . 107.11 106.675 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -113.45 112.1 49.08 Favored Pre-proline 0 C--O 1.242 0.695 0 N-CA-C 109.293 -0.632 . . . . 100.59 109.293 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -85.82 116.56 1.6 Allowed 'Trans proline' 0 C--O 1.235 0.358 0 CA-C-N 119.602 0.894 . . . . 94.8 111.557 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' VAL . . . . . 0.416 ' O ' ' N ' ' C' ' 9' ' ' VAL . 94.7 t -110.33 136.71 45.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 108.305 -0.998 . . . . 76.14 108.305 177.463 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' SER . . . . . 0.486 ' O ' ' NE2' ' C' ' 31' ' ' HIS . 74.8 m -96.06 121.92 38.34 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.796 -0.816 . . . . 81.14 108.796 177.766 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' VAL . . . . . . . . . . . . . 59.0 t -115.08 118.47 58.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.832 -1.173 . . . . 71.41 107.832 -178.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -77.34 107.0 9.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.324 -0.621 . . . . 116.29 109.324 178.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mp -113.81 138.85 49.71 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.552 -0.536 . . . . 76.91 109.552 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -73.58 160.34 31.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.673 0.749 . . . . 75.52 110.233 175.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.28 -27.56 68.56 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.435 -0.802 . . . . 74.3 111.718 -174.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -68.32 -47.97 66.13 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.372 -0.531 . . . . 79.53 110.692 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' ILE . . . . . . . . . . . . . 20.6 mm -72.92 -37.75 54.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 120.384 -0.526 . . . . 67.01 110.176 -179.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -65.11 -34.28 78.02 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 122.0 -0.437 . . . . 62.88 111.684 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.18 -37.57 53.43 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.133 -0.627 . . . . 50.14 111.939 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -69.66 -30.64 68.37 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.359 -0.936 . . . . 68.83 112.071 -178.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.05 -37.48 53.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 119.797 -0.761 . . . . 49.11 110.355 177.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -72.43 -37.22 68.65 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.151 -0.62 . . . . 61.06 110.978 179.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -66.36 -37.36 85.12 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.424 -0.51 . . . . 51.4 111.165 176.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.21 -36.84 84.12 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.329 -0.548 . . . . 44.15 111.177 178.546 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.78 -31.71 68.57 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.393 -0.523 . . . . 56.68 111.588 178.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -69.04 -33.38 73.51 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.433 -0.507 . . . . 87.37 112.05 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.22 -22.06 45.37 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.37 0.508 . . . . 50.76 112.37 -178.458 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' ARG . . . . . 0.534 ' NH1' ' OE1' ' C' ' 45' ' ' GLU . 87.7 mtt180 -104.87 8.0 34.56 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.245 0.831 . . . . 44.78 113.245 175.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 66.1 mttt 47.67 56.96 6.42 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.392 1.077 . . . . 57.8 113.494 -176.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -126.86 176.41 7.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.649 0.738 . . . . 56.67 109.544 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' SER . . . . . . . . . . . . . 16.8 t -88.58 143.58 26.87 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.34 -0.845 . . . . 54.67 110.178 176.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -66.71 -31.65 72.44 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 119.754 -0.778 . . . . 66.34 111.2 176.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' HIS . . . . . 0.595 ' NE2' ' O ' ' C' ' 8' ' ' SER . 0.4 OUTLIER -71.36 -35.14 71.02 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.248 -0.581 . . . . 89.74 111.31 177.382 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' TRP . . . . . . . . . . . . . 82.2 t90 -65.72 -37.05 85.35 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.923 -0.711 . . . . 71.46 111.036 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' MET . . . . . . . . . . . . . 8.2 mtt -70.8 -33.13 70.42 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.513 -0.875 . . . . 44.66 111.291 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' MET . . . . . . . . . . . . . 15.4 mtt -69.57 -35.16 75.11 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.405 -0.518 . . . . 50.41 111.446 176.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.43 -49.17 67.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.722 -0.791 . . . . 74.76 110.983 175.055 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.73 -33.84 75.96 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.281 -0.568 . . . . 50.82 111.546 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.62 -45.59 86.21 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.405 -0.518 . . . . 39.63 110.871 178.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' ILE . . . . . . . . . . . . . 86.9 mt -69.01 -44.01 81.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 120.538 -0.465 . . . . 36.75 110.199 177.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -54.21 -46.53 72.48 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.928 0.394 . . . . 41.28 111.263 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -72.6 -28.82 63.02 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.601 -0.44 . . . . 38.36 112.033 -178.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -66.55 -46.48 75.94 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.351 -0.54 . . . . 32.29 111.193 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' VAL . . . . . . . . . . . . . 2.4 t -65.09 -43.37 95.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 C-N-CA 120.074 -0.65 . . . . 42.47 110.283 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.91 -44.21 94.42 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.393 -0.523 . . . . 47.28 111.532 -179.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -69.43 -43.81 72.6 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.481 -0.888 . . . . 42.92 111.367 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' GLU . . . . . 0.445 ' OE1' ' NH1' ' C' ' 26' ' ' ARG . 80.1 mm-40 -76.42 -27.7 56.38 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.59 -0.844 . . . . 32.53 112.638 -174.732 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -76.04 -32.26 59.25 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 119.43 -0.908 . . . . 55.69 111.953 177.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -69.93 -15.83 63.12 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.861 -0.736 . . . . 56.76 111.621 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' ARG . . . . . 0.649 ' O ' ' NH2' ' E' ' 28' ' ' ARG . 99.2 mtt180 -86.72 -5.7 59.05 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 122.577 0.351 . . . . 50.44 111.726 172.144 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -98.26 12.61 34.16 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 122.844 0.458 . . . . 59.3 111.961 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.227 0 CA-C-O 120.806 0.336 . . . . 68.25 111.111 -177.49 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 3' ' ' THR . . . . . . . . . . . . . 5.7 p . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.88 0.372 . . . . 102.83 111.301 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 4' ' ' ILE . . . . . . . . . . . . . 56.3 mt -75.32 130.76 35.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 109.105 -0.702 . . . . 87.75 109.105 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -119.01 119.37 32.2 Favored Pre-proline 0 C--O 1.244 0.804 0 C-N-CA 122.88 0.472 . . . . 104.41 110.921 -172.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 6' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -81.21 122.42 4.18 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 121.535 1.49 . . . . 87.65 110.839 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -105.03 141.26 20.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.593 -0.891 . . . . 70.2 108.593 179.566 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 8' ' ' SER . . . . . . . . . . . . . 32.5 t -93.87 124.64 38.01 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.948 -0.569 . . . . 74.66 110.58 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 9' ' ' VAL . . . . . . . . . . . . . 63.3 t -114.17 115.47 49.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 107.792 -1.188 . . . . 54.55 107.792 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 10' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -78.4 108.33 11.68 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.478 -0.564 . . . . 68.56 109.478 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 11' ' ' LEU . . . . . . . . . . . . . 89.5 mt -112.54 141.29 46.48 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.338 0.655 . . . . 89.56 109.346 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -71.98 160.32 32.72 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.729 0.776 . . . . 71.95 110.031 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.85 -26.83 67.65 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.401 -0.818 . . . . 73.49 112.067 -173.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 14' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -68.94 -47.5 65.55 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.237 -0.585 . . . . 68.44 111.167 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 15' ' ' ILE . . . . . . . . . . . . . 21.8 mm -72.96 -38.57 56.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 C-N-CA 120.644 -0.422 . . . . 55.36 111.124 -178.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -63.93 -33.26 75.31 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.974 -0.691 . . . . 65.36 111.189 -177.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.76 -36.66 56.91 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.495 -0.482 . . . . 53.75 111.674 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 18' ' ' ARG . . . . . . . . . . . . . 73.1 mtm180 -68.6 -26.68 65.49 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.581 -0.848 . . . . 53.99 112.001 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 19' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -71.59 -40.01 70.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 119.195 -1.002 . . . . 42.25 110.447 177.963 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -74.6 -34.17 62.77 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.181 -1.008 . . . . 71.25 111.296 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 21' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -61.1 -34.18 74.54 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.284 -0.567 . . . . 66.89 110.964 171.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.01 -35.2 69.36 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 121.068 -0.253 . . . . 46.61 111.347 171.776 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.95 -28.63 66.81 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 111.792 0.293 . . . . 39.61 111.792 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 24' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -66.56 -29.85 70.02 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.625 -0.43 . . . . 61.98 111.989 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.26 -20.56 54.96 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.759 0.652 . . . . 64.71 112.759 -177.245 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 26' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -112.33 177.14 4.74 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.602 0.761 . . . . 51.71 109.075 175.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -80.74 -4.08 53.16 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.95 -0.568 . . . . 71.57 112.126 178.949 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 28' ' ' ARG . . . . . 0.649 ' NH2' ' O ' ' D' ' 48' ' ' ARG . 38.4 mmt180 -89.04 154.93 19.8 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.987 0.899 . . . . 67.2 111.59 -166.208 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 29' ' ' SER . . . . . . . . . . . . . 3.5 t -79.4 156.93 27.7 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.825 -1.079 . . . . 48.73 110.557 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 30' ' ' SER . . . . . . . . . . . . . 19.8 m -62.74 -31.1 71.98 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.34 -0.845 . . . . 54.04 111.195 173.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 31' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -71.15 -35.36 71.65 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.838 -0.345 . . . . 41.25 111.068 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 32' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -67.38 -36.92 82.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.736 -0.386 . . . . 39.15 111.237 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 33' ' ' MET . . . . . . . . . . . . . 8.3 mtm -70.81 -32.4 69.47 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.459 -0.496 . . . . 46.93 111.804 -178.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 34' ' ' MET . . . . . . . . . . . . . 15.3 mtt -67.78 -34.04 76.01 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.111 -0.635 . . . . 36.15 111.644 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.14 -46.59 76.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.256 -0.578 . . . . 63.84 111.037 174.819 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 36' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -67.8 -29.58 68.79 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.629 -0.428 . . . . 26.98 111.396 177.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.24 -45.28 77.21 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.59 -0.444 . . . . 31.58 110.909 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 38' ' ' ILE . . . . . . . . . . . . . 88.8 mt -69.21 -40.46 80.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 120.659 -0.416 . . . . 32.56 110.387 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 39' ' ' ARG . . . . . . . . . . . . . 22.7 ttt85 -59.89 -41.92 92.68 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 122.079 -0.388 . . . . 82.1 111.505 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 40' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -70.05 -28.77 65.73 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.213 -0.595 . . . . 43.49 111.683 178.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 41' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -66.25 -47.24 74.38 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.552 -0.459 . . . . 41.88 110.95 179.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 42' ' ' VAL . . . . . . . . . . . . . 2.0 t -66.53 -43.9 90.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 120.211 -0.596 . . . . 50.47 110.427 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 43' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.9 -42.92 98.98 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.449 -0.5 . . . . 49.77 111.414 -179.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 44' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -68.99 -44.84 72.02 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.165 -0.614 . . . . 58.32 111.37 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 45' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -76.04 -25.83 56.02 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.483 0.549 . . . . 67.54 112.483 -175.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 46' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -73.45 -35.45 65.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.726 -0.79 . . . . 71.96 111.063 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 47' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -73.12 -14.15 61.32 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.261 0.467 . . . . 74.96 112.261 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 48' ' ' ARG . . . . . 0.523 ' NH1' ' OE2' ' F' ' 40' ' ' GLU . 0.2 OUTLIER -85.51 -3.08 58.75 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.171 0.588 . . . . 76.74 112.485 173.694 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' E' E ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -88.43 29.94 0.94 Allowed 'General case' 0 C--O 1.236 0.364 0 N-CA-C 115.076 1.509 . . . . 74.44 115.076 176.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.217 0 C-N-CA 124.928 1.291 . . . . 75.9 110.833 -168.68 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 3' ' ' THR . . . . . 0.54 ' O ' ' OG1' ' F' ' 3' ' ' THR . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.828 0.347 . . . . 119.15 111.284 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 4' ' ' ILE . . . . . . . . . . . . . 55.5 mt -89.59 115.07 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.683 -1.229 . . . . 103.61 107.683 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 5' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -99.84 118.13 62.3 Favored Pre-proline 0 C--O 1.241 0.639 0 CA-C-N 116.476 -0.329 . . . . 96.33 110.725 -172.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 6' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -81.57 122.44 4.01 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 121.503 1.469 . . . . 97.41 110.33 177.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -105.03 143.21 16.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 108.696 -0.853 . . . . 72.8 108.696 179.859 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 8' ' ' SER . . . . . . . . . . . . . 32.4 t -91.04 124.41 35.25 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.431 -0.581 . . . . 84.4 109.431 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 9' ' ' VAL . . . . . . . . . . . . . 66.3 t -113.11 118.31 57.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.357 -0.979 . . . . 60.65 108.357 -176.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 108.66 10.2 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.809 -0.812 . . . . 89.14 108.809 178.696 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -114.99 138.75 50.49 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.748 -0.464 . . . . 74.31 109.748 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 12' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -74.61 158.62 33.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.676 0.75 . . . . 74.73 110.326 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.87 -27.68 69.51 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.419 -0.81 . . . . 85.45 111.827 -175.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.37 -49.5 59.77 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.494 -0.482 . . . . 89.65 111.146 -179.75 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 15' ' ' ILE . . . . . . . . . . . . . 22.8 mm -73.85 -35.42 42.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 120.935 0.398 . . . . 73.83 110.473 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -62.6 -33.09 74.28 Favored 'General case' 0 C--O 1.236 0.395 0 O-C-N 121.904 -0.498 . . . . 81.58 111.472 -179.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.33 -35.5 61.19 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.511 -0.476 . . . . 60.84 111.14 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 18' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -66.39 -29.13 69.23 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.994 -0.282 . . . . 74.56 111.588 -179.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 19' ' ' VAL . . . . . . . . . . . . . 60.3 t -71.62 -35.42 55.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 120.935 0.398 . . . . 58.05 110.449 177.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 20' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -69.1 -61.06 1.95 Allowed 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.858 -0.526 . . . . 104.56 111.601 -175.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -72.22 -6.97 46.66 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 117.733 -1.587 . . . . 91.07 113.071 -177.48 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.02 -38.84 56.8 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.245 -0.982 . . . . 55.21 110.215 163.038 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.65 -31.24 66.62 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 121.054 -0.258 . . . . 74.8 111.005 175.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 24' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -68.57 -32.44 72.36 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 111.465 0.172 . . . . 93.29 111.465 178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 25' ' ' THR . . . . . . . . . . . . . 2.6 m -80.43 -22.95 40.65 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.782 0.66 . . . . 75.69 112.782 -177.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 26' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -104.65 11.08 34.53 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 115.8 1.778 . . . . 58.83 115.8 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 27' ' ' LYS . . . . . . . . . . . . . 37.7 mttm 47.53 52.27 12.66 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.91 1.284 . . . . 73.59 110.641 -177.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -133.58 164.32 27.44 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.54 -0.911 . . . . 77.59 108.54 177.511 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 29' ' ' SER . . . . . . . . . . . . . 16.2 t -79.26 136.73 37.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.955 -0.566 . . . . 56.49 110.729 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -68.22 -30.68 69.81 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.966 -0.561 . . . . 57.82 111.737 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.91 -33.66 70.76 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.2 -0.6 . . . . 94.54 111.245 177.313 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 32' ' ' TRP . . . . . . . . . . . . . 80.0 t90 -65.17 -35.66 81.79 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.796 -0.361 . . . . 58.72 111.553 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 33' ' ' MET . . . . . . . . . . . . . 13.8 mtm -69.45 -31.72 70.22 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.402 -0.919 . . . . 63.57 111.09 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 34' ' ' MET . . . . . . . . . . . . . 64.2 mtt -67.61 -36.57 81.1 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.43 -0.508 . . . . 58.08 111.072 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -37.0 82.22 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.644 -0.422 . . . . 64.94 111.505 175.952 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 36' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -75.58 -29.27 59.26 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.517 -0.473 . . . . 67.99 111.784 176.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.07 97.78 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.78 -0.368 . . . . 47.95 111.27 173.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 38' ' ' ILE . . . . . . . . . . . . . 20.9 mm -66.65 -45.41 88.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 120.902 0.382 . . . . 50.88 110.533 179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 39' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.89 -47.14 86.33 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.026 -0.421 . . . . 84.35 111.298 -176.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 40' ' ' GLU . . . . . 0.523 ' OE2' ' NH1' ' E' ' 48' ' ' ARG . 99.5 mt-10 -66.47 -29.83 70.04 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.382 -0.527 . . . . 43.0 111.668 -179.039 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 41' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -67.55 -46.59 72.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.637 -0.425 . . . . 43.08 110.716 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 42' ' ' VAL . . . . . . . . . . . . . 47.5 t -66.42 -43.29 91.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 120.881 -0.328 . . . . 46.08 110.813 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 43' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -60.3 -43.86 95.93 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.97 -0.456 . . . . 60.17 111.634 -178.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 44' ' ' ARG . . . . . . . . . . . . . 36.9 ttp-105 -69.94 -43.22 72.06 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.269 -0.572 . . . . 47.77 111.417 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 45' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -74.87 -25.28 58.86 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.166 -0.614 . . . . 56.89 111.992 -175.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 46' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -73.18 -35.19 66.35 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.368 -0.933 . . . . 45.09 110.905 177.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 47' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -74.14 -15.59 61.03 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.022 -0.671 . . . . 61.18 112.795 175.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 48' ' ' ARG . . . . . 0.594 ' O ' ' NH1' ' B' ' 28' ' ' ARG . 98.6 mtt180 -87.73 -10.19 51.84 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.827 0.676 . . . . 42.1 112.827 173.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.65 6.84 42.16 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.059 0.544 . . . . 57.91 112.214 175.557 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 50' ' ' ALA . . . . . . . . . . . . . . . 54.2 43.51 30.5 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.481 0.657 . . . . 58.94 110.78 -173.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 16.3 mt . . . . . 0 N--CA 1.464 0.256 0 CA-C-N 115.692 -0.686 . . . . 87.81 112.029 -177.8 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' HOH . . . . . 0.567 ' O ' ' NH1' ' C' ' 39' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' HOH . . . . . 0.417 ' O ' ' NH1' ' D' ' 26' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.4 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.7 0.285 . . . . 100.44 111.202 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 56.1 p -90.1 -176.95 5.03 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.867 0.841 . . . . 94.06 110.381 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . 0.502 HG21 ' HB3' ' B' ' 10' ' ' LYS . 14.7 mm -126.76 139.05 52.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 109.002 -0.74 . . . . 77.73 109.002 -174.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -111.37 116.57 50.72 Favored Pre-proline 0 C--O 1.24 0.577 0 C-N-CA 123.436 0.694 . . . . 70.35 110.034 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -83.21 119.78 2.82 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 120.654 0.903 . . . . 65.47 110.911 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.4 m -108.55 142.35 21.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.599 -0.889 . . . . 50.98 108.599 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 31.6 t -93.85 122.59 36.49 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.657 -0.868 . . . . 50.58 108.657 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.0 t -114.72 116.6 53.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 108.302 -0.999 . . . . 46.87 108.302 -177.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -78.58 107.34 11.17 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.805 -0.813 . . . . 70.3 108.805 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . 0.492 HD12 HG21 ' B' ' 7' ' ' VAL . 92.6 mt -113.82 141.31 47.47 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 122.97 0.508 . . . . 60.62 109.954 177.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -72.73 158.44 35.59 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.694 0.759 . . . . 58.27 110.074 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.01 -28.24 69.97 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.45 -0.795 . . . . 54.16 112.127 -174.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.48 -47.52 66.87 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.537 -0.465 . . . . 62.03 111.174 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . 0.438 HD13 HH11 ' A' ' 18' ' ' ARG . 22.1 mm -72.09 -37.56 60.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 C-N-CA 120.293 -0.563 . . . . 46.0 110.607 -178.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . 0.566 ' NZ ' ' OE2' ' A' ' 20' ' ' GLU . 58.7 tttm -65.15 -33.18 75.41 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.847 -0.533 . . . . 66.11 112.04 -179.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.13 -37.71 61.3 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.075 -0.65 . . . . 56.65 111.672 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ARG . . . . . 0.438 HH11 HD13 ' A' ' 15' ' ' ILE . 74.3 mtm180 -69.47 -27.87 65.6 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.689 -0.804 . . . . 43.38 111.573 179.181 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -71.48 -37.64 65.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.477 -0.489 . . . . 55.04 110.325 177.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . 0.566 ' OE2' ' NZ ' ' A' ' 16' ' ' LYS . 94.2 mt-10 -72.66 -24.97 61.1 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 121.762 -0.586 . . . . 63.66 112.324 -179.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -73.53 -40.77 63.75 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.549 -0.461 . . . . 57.49 111.317 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.56 -32.59 74.04 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 111.939 0.348 . . . . 61.47 111.939 -177.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . 0.521 ' N ' ' HE1' ' A' ' 33' ' ' MET . . . -68.09 -33.36 74.38 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 119.877 -0.729 . . . . 68.89 111.751 -179.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -72.53 -31.35 65.24 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 118.283 -1.367 . . . . 81.05 111.439 177.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.0 p -81.21 -22.3 38.94 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.775 0.657 . . . . 62.84 112.775 -177.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -112.99 21.49 15.37 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.25 0.62 . . . . 56.6 112.17 176.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt 50.61 19.22 0.56 Allowed 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.071 1.137 . . . . 68.33 114.071 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -90.96 -178.86 5.32 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.635 0.731 . . . . 73.85 109.553 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 83.5 p -113.01 145.64 40.49 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.299 -0.63 . . . . 48.9 109.299 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.5 p -61.13 -31.12 70.83 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.796 -0.638 . . . . 46.55 111.598 -177.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -70.92 -36.57 72.72 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.14 -0.624 . . . . 57.36 111.359 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 85.2 t90 -68.33 -37.07 80.18 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.374 -0.53 . . . . 63.4 111.699 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' MET . . . . . 0.521 ' HE1' ' N ' ' A' ' 23' ' ' ALA . 14.1 mtm -71.36 -33.29 69.44 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.384 -0.927 . . . . 37.87 111.876 -177.75 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 15.3 mtt -66.83 -34.25 77.4 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.541 -0.864 . . . . 37.52 110.852 177.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . 0.479 ' HD3' ' O ' ' B' ' 10' ' ' LYS . 49.6 mtm180 -65.9 -43.88 86.9 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.504 -0.478 . . . . 75.3 110.908 173.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -67.42 -34.15 76.63 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.429 -0.508 . . . . 36.96 111.692 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.7 -44.34 93.94 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.348 -0.541 . . . . 34.66 110.86 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . 0.495 ' O ' HG23 ' A' ' 42' ' ' VAL . 92.1 mt -68.25 -44.17 84.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 C-N-CA 120.645 -0.422 . . . . 42.92 110.547 177.717 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 19.4 ttp180 -58.88 -48.69 80.53 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.887 -0.508 . . . . 80.81 111.342 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -66.37 -28.35 68.58 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.274 -0.57 . . . . 40.52 111.918 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -66.92 -47.93 70.23 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.573 -0.451 . . . . 28.75 111.433 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 38' ' ' ILE . 1.6 t -66.14 -42.75 91.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 119.82 -0.752 . . . . 32.86 110.355 179.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.37 -43.14 92.9 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.587 -0.445 . . . . 69.72 111.398 -178.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 38.1 ttp-105 -70.55 -44.62 67.09 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.907 -0.717 . . . . 53.57 111.573 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -76.23 -27.81 56.92 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.99 0.737 . . . . 47.93 112.99 -173.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -75.63 -33.26 60.47 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.585 -0.846 . . . . 61.64 112.056 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -71.56 -13.82 61.9 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.458 0.54 . . . . 75.93 112.458 175.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -87.35 -5.69 58.79 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.851 0.686 . . . . 71.44 112.851 173.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 118.304 0.502 . . . . 93.32 110.882 178.502 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 48.3 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.78 0.324 . . . . 106.36 110.94 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 15.2 p -108.72 32.89 4.53 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.883 0.473 . . . . 95.38 111.54 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.06 110.72 1.45 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 109.368 -0.604 . . . . 91.79 109.368 178.173 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -124.0 115.36 27.73 Favored Pre-proline 0 C--O 1.245 0.825 0 N-CA-C 108.954 -0.758 . . . . 89.69 108.954 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -82.43 117.92 2.82 Favored 'Trans proline' 0 C--N 1.331 -0.343 0 C-N-CA 121.474 1.449 . . . . 75.78 109.456 177.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' VAL . . . . . 0.492 HG21 HD12 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -109.98 139.77 31.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 109.054 -0.721 . . . . 70.18 109.054 178.835 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 73.9 m -94.6 123.31 37.96 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.656 -0.868 . . . . 85.29 108.656 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.18 118.14 57.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 107.899 -1.148 . . . . 54.61 107.899 -178.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' LYS . . . . . 0.502 ' HB3' HG21 ' A' ' 4' ' ' ILE . 51.2 mtmt -76.33 106.6 8.05 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.672 -0.862 . . . . 61.26 108.672 178.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 88.4 mt -113.51 140.36 48.2 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.074 0.549 . . . . 54.45 110.079 178.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -73.32 159.65 33.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 119.669 -0.812 . . . . 69.04 110.05 175.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.99 -26.94 68.51 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.356 -0.838 . . . . 50.41 111.998 -174.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.66 -48.52 66.43 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.579 -0.448 . . . . 75.34 110.879 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 21.6 mm -72.77 -35.86 51.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 C-N-CA 120.555 -0.458 . . . . 58.42 110.274 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -34.37 77.78 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 122.022 -0.423 . . . . 70.64 111.615 -179.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.23 -38.63 50.79 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.386 -0.526 . . . . 49.38 112.027 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -69.73 -28.67 66.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 119.755 -0.778 . . . . 52.9 112.033 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -71.5 -38.96 70.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 119.737 -0.785 . . . . 41.14 110.297 177.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -73.77 -36.12 65.06 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.167 -0.613 . . . . 67.09 111.399 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -63.45 -50.42 69.83 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.37 -0.532 . . . . 61.21 110.99 176.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.75 -35.01 65.73 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.859 -0.336 . . . . 39.32 111.129 175.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ALA . . . . . 0.404 ' HB1' ' O ' ' B' ' 28' ' ' ARG . . . -70.64 -34.02 71.6 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.376 0.51 . . . . 34.68 112.376 -179.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -70.47 -31.15 68.17 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.553 -0.459 . . . . 76.79 111.739 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 38.0 p -78.86 -20.24 50.03 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.193 0.812 . . . . 72.28 113.193 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -113.1 2.13 15.56 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 114.552 1.316 . . . . 45.62 114.552 177.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LYS . . . . . 0.444 ' HB2' ' NH1' ' E' ' 26' ' ' ARG . 0.0 OUTLIER 64.1 13.24 7.63 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 125.601 1.561 . . . . 66.49 114.825 176.974 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ARG . . . . . 0.594 ' NH1' ' O ' ' F' ' 48' ' ' ARG . 21.3 mmt180 -99.51 144.78 28.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 119.265 0.939 . . . . 35.77 108.515 166.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 5.7 p -66.47 150.74 48.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.65 0.738 . . . . 33.7 111.573 -175.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 79.8 p -60.09 -30.09 69.01 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.333 -0.849 . . . . 49.03 111.396 175.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -69.59 -34.71 74.52 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.861 -0.336 . . . . 39.93 111.393 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -67.17 -37.63 84.06 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.606 -0.438 . . . . 35.42 111.24 179.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' MET . . . . . . . . . . . . . 13.3 mtm -72.29 -32.0 66.22 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.735 -0.786 . . . . 49.45 112.275 -178.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' MET . . . . . . . . . . . . . 70.6 mtm -67.63 -36.6 81.1 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.365 -0.934 . . . . 34.23 111.044 178.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -67.45 -37.98 83.78 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.99 -0.684 . . . . 72.31 110.923 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -72.62 -33.14 66.46 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.482 -0.487 . . . . 71.96 111.541 176.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.59 -44.7 95.65 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.577 -0.449 . . . . 33.94 111.083 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ILE . . . . . 0.405 ' O ' HG23 ' B' ' 42' ' ' VAL . 89.9 mt -68.04 -41.52 84.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 120.657 -0.417 . . . . 38.98 110.533 178.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ARG . . . . . . . . . . . . . 56.9 ttm-85 -60.34 -42.65 96.12 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 121.885 -0.509 . . . . 71.63 111.528 -177.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -69.5 -28.52 66.12 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.268 -0.573 . . . . 49.61 111.933 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -66.88 -47.84 70.6 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.793 -0.363 . . . . 52.36 111.366 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' VAL . . . . . 0.405 HG23 ' O ' ' B' ' 38' ' ' ILE . 0.2 OUTLIER -66.05 -44.08 92.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 119.97 -0.692 . . . . 52.05 110.906 179.39 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.93 -42.95 95.1 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.256 -0.578 . . . . 36.65 111.222 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 37.8 ttp-105 -69.89 -44.63 69.35 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.002 -0.679 . . . . 38.7 111.345 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -75.71 -25.11 56.35 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.414 0.524 . . . . 54.96 112.414 -175.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -72.64 -34.19 67.11 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 119.528 -0.869 . . . . 58.3 111.367 178.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -72.17 -13.41 61.54 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.607 0.595 . . . . 55.07 112.607 175.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -87.42 -4.96 59.03 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 113.002 0.742 . . . . 60.68 113.002 172.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 C--N 1.331 -0.225 0 CA-C-N 118.263 0.483 . . . . 78.94 110.962 178.006 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 5' ' ' LYS . . . . . . . . . . . . . 11.8 mmmm . . . . . 0 C--O 1.23 0.07 0 N-CA-C 110.175 -0.306 . . . . 88.8 110.175 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -83.03 120.1 2.94 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 120.633 0.889 . . . . 80.32 111.794 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -108.09 140.18 27.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 108.692 -0.855 . . . . 72.48 108.692 176.731 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' SER . . . . . 0.561 ' O ' ' NE2' ' D' ' 31' ' ' HIS . 63.0 p -94.13 123.63 37.64 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.726 -0.842 . . . . 81.17 108.726 178.25 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 61.6 t -112.69 115.81 50.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 N-CA-C 108.133 -1.062 . . . . 66.64 108.133 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -79.18 108.28 12.56 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.184 -0.672 . . . . 83.78 109.184 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' LEU . . . . . . . . . . . . . 91.2 mt -112.54 142.26 45.33 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.421 0.688 . . . . 55.93 109.63 177.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -70.93 159.29 34.96 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.936 0.874 . . . . 70.71 110.608 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.22 -26.8 68.56 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.142 -0.935 . . . . 78.3 112.257 -173.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -68.0 -49.18 63.15 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.108 -0.637 . . . . 91.38 111.137 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 mp -73.94 -35.27 41.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.599 -0.44 . . . . 59.38 111.262 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -62.91 -34.57 77.71 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 121.741 -0.599 . . . . 69.16 111.517 -178.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.34 -35.74 58.59 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.75 -0.38 . . . . 48.68 111.015 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -67.3 -30.47 70.33 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 111.814 0.301 . . . . 50.24 111.814 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.22 -37.39 45.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 120.652 -0.419 . . . . 42.62 110.558 176.569 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -71.55 -40.61 69.91 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 121.773 -0.58 . . . . 59.6 111.237 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -64.34 -37.63 88.19 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.364 -0.534 . . . . 68.86 111.052 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' LEU . . . . . 0.401 HD12 HG13 ' D' ' 42' ' ' VAL . 0.4 OUTLIER -69.63 -37.71 76.91 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.294 -0.563 . . . . 39.63 111.089 178.794 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.22 -30.72 67.88 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.079 -0.648 . . . . 49.43 110.791 176.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -68.42 -33.63 74.55 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 111.906 0.336 . . . . 91.43 111.906 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.53 -24.03 36.88 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.601 0.963 . . . . 57.04 113.601 -176.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ARG . . . . . 0.406 ' HG2' ' HB2' ' E' ' 29' ' ' SER 0.535 88.1 mtt180 -92.01 1.99 56.84 Favored 'General case' 0 C--N 1.33 -0.258 1 N-CA-C 121.958 4.058 . . . . 42.78 121.958 176.244 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt 51.77 50.13 19.34 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 129.58 3.152 . . . . 65.91 117.495 -162.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 mtt85 -137.31 175.53 9.52 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.501 0.667 . . . . 72.41 110.85 -179.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 29.0 t -92.88 145.1 24.64 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.405 -0.816 . . . . 54.49 110.96 -175.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -69.87 -30.68 68.2 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.777 -0.647 . . . . 50.32 111.605 179.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' HIS . . . . . 0.486 ' NE2' ' O ' ' D' ' 8' ' ' SER . 1.4 m80 -70.47 -35.77 73.48 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.351 -0.54 . . . . 82.55 111.177 177.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 32' ' ' TRP . . . . . . . . . . . . . 82.4 t90 -66.87 -36.39 82.19 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.658 -0.417 . . . . 44.14 111.068 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' MET . . . . . . . . . . . . . 12.3 mtm -70.34 -32.83 70.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.415 -0.514 . . . . 43.13 111.559 -178.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' MET . . . . . . . . . . . . . 15.3 mtm -68.35 -34.49 76.18 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.181 -0.608 . . . . 42.24 111.58 177.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' ARG . . . . . 0.491 ' HD3' ' O ' ' D' ' 10' ' ' LYS . 48.3 mtm180 -66.46 -48.34 70.22 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.352 -0.539 . . . . 85.07 111.188 175.36 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -61.24 -31.46 71.25 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.478 -0.489 . . . . 82.09 111.494 177.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.07 -44.71 88.04 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.335 -0.546 . . . . 38.4 111.026 174.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' ILE . . . . . . . . . . . . . 87.1 mt -69.02 -35.56 69.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-O 120.863 0.364 . . . . 39.64 110.485 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' ARG . . . . . 0.567 ' NH1' ' O ' ' C' ' 101' ' ' HOH . 55.1 ttm-85 -66.72 -43.24 84.77 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.439 -0.505 . . . . 42.53 111.391 -179.081 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -71.19 -28.59 64.33 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.992 -0.683 . . . . 56.42 111.83 179.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -66.45 -47.79 72.02 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.563 -0.455 . . . . 35.62 111.136 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 9.8 m -66.86 -42.82 89.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 119.949 -0.7 . . . . 46.91 110.62 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -60.58 -43.07 97.75 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.883 -0.51 . . . . 51.09 111.647 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' ARG . . . . . . . . . . . . . 38.4 ttp-105 -68.76 -43.81 75.03 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.062 -0.655 . . . . 50.4 111.155 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' GLU . . . . . 0.413 ' OE1' ' NH1' ' D' ' 26' ' ' ARG . 80.3 mm-40 -75.17 -23.69 57.77 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.49 0.552 . . . . 42.51 112.49 -176.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 46' ' ' GLU . . . . . 0.441 ' OE2' ' HD2' ' D' ' 18' ' ' ARG . 66.1 mt-10 -72.76 -35.52 67.48 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.203 -0.599 . . . . 54.77 111.387 179.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -72.4 -13.15 61.39 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.262 -0.575 . . . . 94.39 112.386 174.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -85.98 -5.53 59.21 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.351 0.5 . . . . 55.55 112.351 173.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 . . . . . 0 C--N 1.33 -0.256 0 CA-C-O 120.802 0.334 . . . . 96.62 110.468 177.051 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.155 0 N-CA-C 110.059 -0.348 . . . . 94.71 110.059 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' ILE . . . . . . . . . . . . . 4.8 mp -133.92 101.94 4.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 106.675 -1.602 . . . . 107.11 106.675 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -113.45 112.1 49.08 Favored Pre-proline 0 C--O 1.242 0.695 0 N-CA-C 109.293 -0.632 . . . . 100.59 109.293 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -85.82 116.56 1.6 Allowed 'Trans proline' 0 C--O 1.235 0.358 0 CA-C-N 119.602 0.894 . . . . 94.8 111.557 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 94.7 t -110.33 136.71 45.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 108.305 -0.998 . . . . 76.14 108.305 177.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' SER . . . . . 0.486 ' O ' ' NE2' ' C' ' 31' ' ' HIS . 74.8 m -96.06 121.92 38.34 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.796 -0.816 . . . . 81.14 108.796 177.766 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 9' ' ' VAL . . . . . . . . . . . . . 59.0 t -115.08 118.47 58.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.832 -1.173 . . . . 71.41 107.832 -178.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' LYS . . . . . 0.491 ' O ' ' HD3' ' C' ' 35' ' ' ARG . 68.9 mttm -77.34 107.0 9.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.324 -0.621 . . . . 116.29 109.324 178.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mp -113.81 138.85 49.71 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.552 -0.536 . . . . 76.91 109.552 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -73.58 160.34 31.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.673 0.749 . . . . 75.52 110.233 175.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.28 -27.56 68.56 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.435 -0.802 . . . . 74.3 111.718 -174.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -68.32 -47.97 66.13 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.372 -0.531 . . . . 79.53 110.692 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' ILE . . . . . 0.483 HD13 HH21 ' D' ' 18' ' ' ARG . 20.6 mm -72.92 -37.75 54.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 120.384 -0.526 . . . . 67.01 110.176 -179.24 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -65.11 -34.28 78.02 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 122.0 -0.437 . . . . 62.88 111.684 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.18 -37.57 53.43 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.133 -0.627 . . . . 50.14 111.939 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' ARG . . . . . 0.483 HH21 HD13 ' D' ' 15' ' ' ILE . 74.1 mtm180 -69.66 -30.64 68.37 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.359 -0.936 . . . . 68.83 112.071 -178.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 19' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.05 -37.48 53.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 119.797 -0.761 . . . . 49.11 110.355 177.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -72.43 -37.22 68.65 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.151 -0.62 . . . . 61.06 110.978 179.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -66.36 -37.36 85.12 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.424 -0.51 . . . . 51.4 111.165 176.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.21 -36.84 84.12 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.329 -0.548 . . . . 44.15 111.177 178.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.78 -31.71 68.57 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.393 -0.523 . . . . 56.68 111.588 178.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -69.04 -33.38 73.51 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.433 -0.507 . . . . 87.37 112.05 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.22 -22.06 45.37 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.37 0.508 . . . . 50.76 112.37 -178.458 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 26' ' ' ARG . . . . . 0.413 ' NH1' ' OE1' ' C' ' 45' ' ' GLU . 87.7 mtt180 -104.87 8.0 34.56 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.245 0.831 . . . . 44.78 113.245 175.43 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 66.1 mttt 47.67 56.96 6.42 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.392 1.077 . . . . 57.8 113.494 -176.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' ARG . . . . . 0.418 ' HB2' ' HE3' ' D' ' 33' ' ' MET . 24.8 mmt85 -126.86 176.41 7.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.649 0.738 . . . . 56.67 109.544 178.222 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 29' ' ' SER . . . . . . . . . . . . . 16.8 t -88.58 143.58 26.87 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.34 -0.845 . . . . 54.67 110.178 176.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -66.71 -31.65 72.44 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 119.754 -0.778 . . . . 66.34 111.2 176.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 31' ' ' HIS . . . . . 0.561 ' NE2' ' O ' ' C' ' 8' ' ' SER . 0.4 OUTLIER -71.36 -35.14 71.02 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.248 -0.581 . . . . 89.74 111.31 177.382 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 32' ' ' TRP . . . . . . . . . . . . . 82.2 t90 -65.72 -37.05 85.35 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.923 -0.711 . . . . 71.46 111.036 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 33' ' ' MET . . . . . 0.418 ' HE3' ' HB2' ' D' ' 28' ' ' ARG . 8.2 mtt -70.8 -33.13 70.42 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.513 -0.875 . . . . 44.66 111.291 179.43 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 34' ' ' MET . . . . . . . . . . . . . 15.4 mtt -69.57 -35.16 75.11 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.405 -0.518 . . . . 50.41 111.446 176.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.43 -49.17 67.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.722 -0.791 . . . . 74.76 110.983 175.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 36' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.73 -33.84 75.96 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.281 -0.568 . . . . 50.82 111.546 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.62 -45.59 86.21 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.405 -0.518 . . . . 39.63 110.871 178.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 38' ' ' ILE . . . . . 0.51 ' O ' HG23 ' D' ' 42' ' ' VAL . 86.9 mt -69.01 -44.01 81.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 120.538 -0.465 . . . . 36.75 110.199 177.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 39' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -54.21 -46.53 72.48 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.928 0.394 . . . . 41.28 111.263 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 40' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -72.6 -28.82 63.02 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.601 -0.44 . . . . 38.36 112.033 -178.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -66.55 -46.48 75.94 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.351 -0.54 . . . . 32.29 111.193 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 42' ' ' VAL . . . . . 0.51 HG23 ' O ' ' D' ' 38' ' ' ILE . 2.4 t -65.09 -43.37 95.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 C-N-CA 120.074 -0.65 . . . . 42.47 110.283 -179.706 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 43' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' D' ' 47' ' ' LYS . 97.1 mt-10 -59.91 -44.21 94.42 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.393 -0.523 . . . . 47.28 111.532 -179.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 44' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -69.43 -43.81 72.6 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.481 -0.888 . . . . 42.92 111.367 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 45' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -76.42 -27.7 56.38 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.59 -0.844 . . . . 32.53 112.638 -174.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 46' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -76.04 -32.26 59.25 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 119.43 -0.908 . . . . 55.69 111.953 177.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 47' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' D' ' 43' ' ' GLU . 64.2 mttm -69.93 -15.83 63.12 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.861 -0.736 . . . . 56.76 111.621 175.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 48' ' ' ARG . . . . . 0.649 ' O ' ' NH2' ' E' ' 28' ' ' ARG . 99.2 mtt180 -86.72 -5.7 59.05 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 122.577 0.351 . . . . 50.44 111.726 172.144 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -98.26 12.61 34.16 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 122.844 0.458 . . . . 59.3 111.961 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.227 0 CA-C-O 120.806 0.336 . . . . 68.25 111.111 -177.49 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 3' ' ' THR . . . . . . . . . . . . . 5.7 p . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.88 0.372 . . . . 102.83 111.301 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 4' ' ' ILE . . . . . . . . . . . . . 56.3 mt -75.32 130.76 35.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 109.105 -0.702 . . . . 87.75 109.105 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -119.01 119.37 32.2 Favored Pre-proline 0 C--O 1.244 0.804 0 C-N-CA 122.88 0.472 . . . . 104.41 110.921 -172.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 6' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -81.21 122.42 4.18 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 121.535 1.49 . . . . 87.65 110.839 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -105.03 141.26 20.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.593 -0.891 . . . . 70.2 108.593 179.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 8' ' ' SER . . . . . . . . . . . . . 32.5 t -93.87 124.64 38.01 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.948 -0.569 . . . . 74.66 110.58 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 9' ' ' VAL . . . . . . . . . . . . . 63.3 t -114.17 115.47 49.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 107.792 -1.188 . . . . 54.55 107.792 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 10' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -78.4 108.33 11.68 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.478 -0.564 . . . . 68.56 109.478 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 11' ' ' LEU . . . . . . . . . . . . . 89.5 mt -112.54 141.29 46.48 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.338 0.655 . . . . 89.56 109.346 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -71.98 160.32 32.72 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.729 0.776 . . . . 71.95 110.031 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.85 -26.83 67.65 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.401 -0.818 . . . . 73.49 112.067 -173.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 14' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -68.94 -47.5 65.55 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.237 -0.585 . . . . 68.44 111.167 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 15' ' ' ILE . . . . . 0.446 ' CD1' HH11 ' E' ' 18' ' ' ARG . 21.8 mm -72.96 -38.57 56.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 C-N-CA 120.644 -0.422 . . . . 55.36 111.124 -178.157 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -63.93 -33.26 75.31 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.974 -0.691 . . . . 65.36 111.189 -177.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.76 -36.66 56.91 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.495 -0.482 . . . . 53.75 111.674 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 18' ' ' ARG . . . . . 0.446 HH11 ' CD1' ' E' ' 15' ' ' ILE . 73.1 mtm180 -68.6 -26.68 65.49 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.581 -0.848 . . . . 53.99 112.001 -179.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 19' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -71.59 -40.01 70.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 119.195 -1.002 . . . . 42.25 110.447 177.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -74.6 -34.17 62.77 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.181 -1.008 . . . . 71.25 111.296 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 21' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -61.1 -34.18 74.54 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.284 -0.567 . . . . 66.89 110.964 171.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 22' ' ' LEU . . . . . 0.431 HD21 HH21 ' E' ' 26' ' ' ARG . 0.5 OUTLIER -72.01 -35.2 69.36 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 121.068 -0.253 . . . . 46.61 111.347 171.776 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' E' E ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.95 -28.63 66.81 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 111.792 0.293 . . . . 39.61 111.792 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 24' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -66.56 -29.85 70.02 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.625 -0.43 . . . . 61.98 111.989 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.26 -20.56 54.96 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.759 0.652 . . . . 64.71 112.759 -177.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 26' ' ' ARG . . . . . 0.444 ' NH1' ' HB2' ' B' ' 27' ' ' LYS . 1.5 mmt180 -112.33 177.14 4.74 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.602 0.761 . . . . 51.71 109.075 175.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -80.74 -4.08 53.16 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.95 -0.568 . . . . 71.57 112.126 178.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 28' ' ' ARG . . . . . 0.649 ' NH2' ' O ' ' D' ' 48' ' ' ARG . 38.4 mmt180 -89.04 154.93 19.8 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.987 0.899 . . . . 67.2 111.59 -166.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 29' ' ' SER . . . . . 0.406 ' HB2' ' HG2' ' C' ' 26' ' ' ARG . 3.5 t -79.4 156.93 27.7 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.825 -1.079 . . . . 48.73 110.557 175.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 30' ' ' SER . . . . . . . . . . . . . 19.8 m -62.74 -31.1 71.98 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.34 -0.845 . . . . 54.04 111.195 173.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 31' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -71.15 -35.36 71.65 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.838 -0.345 . . . . 41.25 111.068 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 32' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -67.38 -36.92 82.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.736 -0.386 . . . . 39.15 111.237 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 33' ' ' MET . . . . . 0.404 ' HE1' ' HB3' ' E' ' 22' ' ' LEU . 8.3 mtm -70.81 -32.4 69.47 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.459 -0.496 . . . . 46.93 111.804 -178.05 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 34' ' ' MET . . . . . . . . . . . . . 15.3 mtt -67.78 -34.04 76.01 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.111 -0.635 . . . . 36.15 111.644 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.14 -46.59 76.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.256 -0.578 . . . . 63.84 111.037 174.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 36' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -67.8 -29.58 68.79 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.629 -0.428 . . . . 26.98 111.396 177.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.24 -45.28 77.21 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.59 -0.444 . . . . 31.58 110.909 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 38' ' ' ILE . . . . . 0.423 ' O ' HG23 ' E' ' 42' ' ' VAL . 88.8 mt -69.21 -40.46 80.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 120.659 -0.416 . . . . 32.56 110.387 177.272 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 39' ' ' ARG . . . . . . . . . . . . . 22.7 ttt85 -59.89 -41.92 92.68 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 122.079 -0.388 . . . . 82.1 111.505 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 40' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -70.05 -28.77 65.73 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.213 -0.595 . . . . 43.49 111.683 178.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 41' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -66.25 -47.24 74.38 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.552 -0.459 . . . . 41.88 110.95 179.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 42' ' ' VAL . . . . . 0.423 HG23 ' O ' ' E' ' 38' ' ' ILE . 2.0 t -66.53 -43.9 90.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 120.211 -0.596 . . . . 50.47 110.427 179.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 43' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.9 -42.92 98.98 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.449 -0.5 . . . . 49.77 111.414 -179.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 44' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -68.99 -44.84 72.02 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.165 -0.614 . . . . 58.32 111.37 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 45' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -76.04 -25.83 56.02 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.483 0.549 . . . . 67.54 112.483 -175.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 46' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -73.45 -35.45 65.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.726 -0.79 . . . . 71.96 111.063 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 47' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -73.12 -14.15 61.32 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.261 0.467 . . . . 74.96 112.261 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 48' ' ' ARG . . . . . 0.523 ' NH1' ' OE2' ' F' ' 40' ' ' GLU . 0.2 OUTLIER -85.51 -3.08 58.75 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.171 0.588 . . . . 76.74 112.485 173.694 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' E' E ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -88.43 29.94 0.94 Allowed 'General case' 0 C--O 1.236 0.364 0 N-CA-C 115.076 1.509 . . . . 74.44 115.076 176.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.217 0 C-N-CA 124.928 1.291 . . . . 75.9 110.833 -168.68 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 3' ' ' THR . . . . . 0.54 ' O ' ' OG1' ' F' ' 3' ' ' THR . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.828 0.347 . . . . 119.15 111.284 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 4' ' ' ILE . . . . . . . . . . . . . 55.5 mt -89.59 115.07 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.683 -1.229 . . . . 103.61 107.683 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 5' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -99.84 118.13 62.3 Favored Pre-proline 0 C--O 1.241 0.639 0 CA-C-N 116.476 -0.329 . . . . 96.33 110.725 -172.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 6' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -81.57 122.44 4.01 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 121.503 1.469 . . . . 97.41 110.33 177.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -105.03 143.21 16.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 108.696 -0.853 . . . . 72.8 108.696 179.859 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 8' ' ' SER . . . . . . . . . . . . . 32.4 t -91.04 124.41 35.25 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.431 -0.581 . . . . 84.4 109.431 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 9' ' ' VAL . . . . . . . . . . . . . 66.3 t -113.11 118.31 57.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.357 -0.979 . . . . 60.65 108.357 -176.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 108.66 10.2 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.809 -0.812 . . . . 89.14 108.809 178.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -114.99 138.75 50.49 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.748 -0.464 . . . . 74.31 109.748 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 12' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -74.61 158.62 33.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.676 0.75 . . . . 74.73 110.326 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.87 -27.68 69.51 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.419 -0.81 . . . . 85.45 111.827 -175.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.37 -49.5 59.77 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.494 -0.482 . . . . 89.65 111.146 -179.75 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 15' ' ' ILE . . . . . . . . . . . . . 22.8 mm -73.85 -35.42 42.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 120.935 0.398 . . . . 73.83 110.473 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -62.6 -33.09 74.28 Favored 'General case' 0 C--O 1.236 0.395 0 O-C-N 121.904 -0.498 . . . . 81.58 111.472 -179.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.33 -35.5 61.19 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.511 -0.476 . . . . 60.84 111.14 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 18' ' ' ARG . . . . . 0.475 ' HA ' ' NE2' ' F' ' 21' ' ' HIS . 59.2 mtp180 -66.39 -29.13 69.23 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.994 -0.282 . . . . 74.56 111.588 -179.255 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 19' ' ' VAL . . . . . . . . . . . . . 60.3 t -71.62 -35.42 55.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 120.935 0.398 . . . . 58.05 110.449 177.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 20' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -69.1 -61.06 1.95 Allowed 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.858 -0.526 . . . . 104.56 111.601 -175.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 21' ' ' HIS . . . . . 0.475 ' NE2' ' HA ' ' F' ' 18' ' ' ARG . 0.8 OUTLIER -72.22 -6.97 46.66 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 117.733 -1.587 . . . . 91.07 113.071 -177.48 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.02 -38.84 56.8 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.245 -0.982 . . . . 55.21 110.215 163.038 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 23' ' ' ALA . . . . . 0.439 ' HB1' ' O ' ' F' ' 28' ' ' ARG . . . -71.65 -31.24 66.62 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 121.054 -0.258 . . . . 74.8 111.005 175.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 24' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -68.57 -32.44 72.36 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 111.465 0.172 . . . . 93.29 111.465 178.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 25' ' ' THR . . . . . . . . . . . . . 2.6 m -80.43 -22.95 40.65 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.782 0.66 . . . . 75.69 112.782 -177.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 26' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -104.65 11.08 34.53 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 115.8 1.778 . . . . 58.83 115.8 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 27' ' ' LYS . . . . . . . . . . . . . 37.7 mttm 47.53 52.27 12.66 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.91 1.284 . . . . 73.59 110.641 -177.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 28' ' ' ARG . . . . . 0.439 ' O ' ' HB1' ' F' ' 23' ' ' ALA . 0.4 OUTLIER -133.58 164.32 27.44 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.54 -0.911 . . . . 77.59 108.54 177.511 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' F' F ' 29' ' ' SER . . . . . . . . . . . . . 16.2 t -79.26 136.73 37.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.955 -0.566 . . . . 56.56 110.729 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -68.22 -30.68 69.81 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.966 -0.561 . . . . 57.82 111.737 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.91 -33.66 70.76 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.2 -0.6 . . . . 94.54 111.245 177.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 32' ' ' TRP . . . . . . . . . . . . . 80.0 t90 -65.17 -35.66 81.79 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.796 -0.361 . . . . 58.72 111.553 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 33' ' ' MET . . . . . . . . . . . . . 13.8 mtm -69.45 -31.72 70.22 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.402 -0.919 . . . . 63.57 111.09 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 34' ' ' MET . . . . . 0.445 ' O ' HG12 ' F' ' 38' ' ' ILE . 64.2 mtt -67.61 -36.57 81.1 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.43 -0.508 . . . . 58.08 111.072 177.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -37.0 82.22 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.644 -0.422 . . . . 64.94 111.505 175.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 36' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -75.58 -29.27 59.26 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.517 -0.473 . . . . 67.99 111.784 176.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.07 97.78 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.78 -0.368 . . . . 47.95 111.27 173.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 38' ' ' ILE . . . . . 0.445 HG12 ' O ' ' F' ' 34' ' ' MET . 20.9 mm -66.65 -45.41 88.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 120.902 0.382 . . . . 50.88 110.533 179.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 39' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.89 -47.14 86.33 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.026 -0.421 . . . . 84.35 111.298 -176.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 40' ' ' GLU . . . . . 0.523 ' OE2' ' NH1' ' E' ' 48' ' ' ARG . 99.5 mt-10 -66.47 -29.83 70.04 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.382 -0.527 . . . . 43.0 111.668 -179.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 41' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -67.55 -46.59 72.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.637 -0.425 . . . . 43.08 110.716 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 42' ' ' VAL . . . . . . . . . . . . . 47.5 t -66.42 -43.29 91.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 120.881 -0.328 . . . . 46.08 110.813 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 43' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -60.3 -43.86 95.93 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.97 -0.456 . . . . 60.17 111.634 -178.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 44' ' ' ARG . . . . . . . . . . . . . 36.9 ttp-105 -69.94 -43.22 72.06 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.269 -0.572 . . . . 47.77 111.417 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 45' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -74.87 -25.28 58.86 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.166 -0.614 . . . . 56.89 111.992 -175.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 46' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -73.18 -35.19 66.35 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.368 -0.933 . . . . 45.09 110.905 177.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 47' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -74.14 -15.59 61.03 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.022 -0.671 . . . . 61.18 112.795 175.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 48' ' ' ARG . . . . . 0.594 ' O ' ' NH1' ' B' ' 28' ' ' ARG . 98.6 mtt180 -87.73 -10.19 51.84 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.827 0.676 . . . . 42.1 112.827 173.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.65 6.84 42.16 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.059 0.544 . . . . 57.91 112.214 175.557 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 50' ' ' ALA . . . . . . . . . . . . . . . 54.2 43.51 30.5 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.481 0.657 . . . . 58.94 110.78 -173.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 16.3 mt . . . . . 0 N--CA 1.464 0.256 0 CA-C-N 115.692 -0.686 . . . . 87.81 112.029 -177.8 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 101' ' ' HOH . . . . . 0.567 ' O ' ' NH1' ' C' ' 39' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.4 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.7 0.285 . . . . 100.44 111.202 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 56.1 p -90.1 -176.95 5.03 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.867 0.841 . . . . 94.06 110.381 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.502 HG21 ' HB3' ' B' ' 10' ' ' LYS . 14.7 mm -126.76 139.05 52.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 109.002 -0.74 . . . . 77.73 109.002 -174.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -111.37 116.57 50.72 Favored Pre-proline 0 C--O 1.24 0.577 0 C-N-CA 123.436 0.694 . . . . 70.35 110.034 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -83.21 119.78 2.82 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 120.654 0.903 . . . . 65.47 110.911 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.4 m -108.55 142.35 21.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 108.599 -0.889 . . . . 50.98 108.599 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 31.6 t -93.85 122.59 36.49 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.657 -0.868 . . . . 50.58 108.657 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.0 t -114.72 116.6 53.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 108.302 -0.999 . . . . 46.87 108.302 -177.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -78.58 107.34 11.17 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.805 -0.813 . . . . 70.3 108.805 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.492 HD12 HG21 ' B' ' 7' ' ' VAL . 92.6 mt -113.82 141.31 47.47 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 122.97 0.508 . . . . 60.62 109.954 177.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -72.73 158.44 35.59 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.694 0.759 . . . . 58.27 110.074 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.01 -28.24 69.97 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.45 -0.795 . . . . 54.16 112.127 -174.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.48 -47.52 66.87 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.537 -0.465 . . . . 62.03 111.174 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.438 HD13 HH11 ' A' ' 18' ' ' ARG . 22.1 mm -72.09 -37.56 60.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 C-N-CA 120.293 -0.563 . . . . 46.0 110.607 -178.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.566 ' NZ ' ' OE2' ' A' ' 20' ' ' GLU . 58.7 tttm -65.15 -33.18 75.41 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.847 -0.533 . . . . 66.11 112.04 -179.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.13 -37.71 61.3 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.075 -0.65 . . . . 56.65 111.672 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.438 HH11 HD13 ' A' ' 15' ' ' ILE . 74.3 mtm180 -69.47 -27.87 65.6 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.689 -0.804 . . . . 43.38 111.573 179.181 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -71.48 -37.64 65.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.477 -0.489 . . . . 55.04 110.325 177.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.566 ' OE2' ' NZ ' ' A' ' 16' ' ' LYS . 94.2 mt-10 -72.66 -24.97 61.1 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 121.762 -0.586 . . . . 63.66 112.324 -179.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -73.53 -40.77 63.75 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.549 -0.461 . . . . 57.49 111.317 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.56 -32.59 74.04 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 111.939 0.348 . . . . 61.47 111.939 -177.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.521 ' N ' ' HE1' ' A' ' 33' ' ' MET . . . -68.09 -33.36 74.38 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 119.877 -0.729 . . . . 68.89 111.751 -179.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -72.53 -31.35 65.24 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 118.283 -1.367 . . . . 81.05 111.439 177.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.0 p -81.21 -22.3 38.94 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.775 0.657 . . . . 62.84 112.775 -177.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -112.99 21.49 15.37 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.25 0.62 . . . . 56.6 112.17 176.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt 50.61 19.22 0.56 Allowed 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.071 1.137 . . . . 68.33 114.071 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -90.96 -178.86 5.32 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.635 0.731 . . . . 73.85 109.553 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 83.5 p -113.01 145.64 40.49 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.299 -0.63 . . . . 48.9 109.299 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.5 p -61.13 -31.12 70.83 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.796 -0.638 . . . . 46.55 111.598 -177.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -70.92 -36.57 72.72 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.14 -0.624 . . . . 57.36 111.359 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 85.2 t90 -68.33 -37.07 80.18 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.374 -0.53 . . . . 63.4 111.699 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' MET . . . . . 0.521 ' HE1' ' N ' ' A' ' 23' ' ' ALA . 14.1 mtm -71.36 -33.29 69.44 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.384 -0.927 . . . . 37.87 111.876 -177.75 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 15.3 mtt -66.83 -34.25 77.4 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.541 -0.864 . . . . 37.52 110.852 177.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.479 ' HD3' ' O ' ' B' ' 10' ' ' LYS . 49.6 mtm180 -65.9 -43.88 86.9 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.504 -0.478 . . . . 75.3 110.908 173.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -67.42 -34.15 76.63 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.429 -0.508 . . . . 36.96 111.692 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.7 -44.34 93.94 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.348 -0.541 . . . . 34.66 110.86 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.495 ' O ' HG23 ' A' ' 42' ' ' VAL . 92.1 mt -68.25 -44.17 84.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 C-N-CA 120.645 -0.422 . . . . 42.92 110.547 177.717 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 19.4 ttp180 -58.88 -48.69 80.53 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.887 -0.508 . . . . 80.81 111.342 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -66.37 -28.35 68.58 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.274 -0.57 . . . . 40.52 111.918 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -66.92 -47.93 70.23 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.573 -0.451 . . . . 28.75 111.433 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 38' ' ' ILE . 1.6 t -66.14 -42.75 91.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 119.82 -0.752 . . . . 32.86 110.355 179.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.37 -43.14 92.9 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.587 -0.445 . . . . 69.72 111.398 -178.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 38.1 ttp-105 -70.55 -44.62 67.09 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.907 -0.717 . . . . 53.57 111.573 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -76.23 -27.81 56.92 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.99 0.737 . . . . 47.93 112.99 -173.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -75.63 -33.26 60.47 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.585 -0.846 . . . . 61.64 112.056 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -71.56 -13.82 61.9 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.458 0.54 . . . . 75.93 112.458 175.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -87.35 -5.69 58.79 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.851 0.686 . . . . 71.44 112.851 173.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 118.304 0.502 . . . . 93.32 110.882 178.502 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 48.3 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.78 0.324 . . . . 106.36 110.94 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 15.2 p -108.72 32.89 4.53 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.883 0.473 . . . . 95.38 111.54 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.06 110.72 1.45 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 109.368 -0.604 . . . . 91.79 109.368 178.173 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -124.0 115.36 27.73 Favored Pre-proline 0 C--O 1.245 0.825 0 N-CA-C 108.954 -0.758 . . . . 89.69 108.954 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -82.43 117.92 2.82 Favored 'Trans proline' 0 C--N 1.331 -0.343 0 C-N-CA 121.474 1.449 . . . . 75.78 109.456 177.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.492 HG21 HD12 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -109.98 139.77 31.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 109.054 -0.721 . . . . 70.18 109.054 178.835 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 73.9 m -94.6 123.31 37.96 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.656 -0.868 . . . . 85.29 108.656 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.18 118.14 57.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 107.899 -1.148 . . . . 54.61 107.899 -178.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' LYS . . . . . 0.502 ' HB3' HG21 ' A' ' 4' ' ' ILE . 51.2 mtmt -76.33 106.6 8.05 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.672 -0.862 . . . . 61.26 108.672 178.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 88.4 mt -113.51 140.36 48.2 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.074 0.549 . . . . 54.45 110.079 178.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -73.32 159.65 33.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 119.669 -0.812 . . . . 69.04 110.05 175.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.99 -26.94 68.51 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.356 -0.838 . . . . 50.41 111.998 -174.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.66 -48.52 66.43 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.579 -0.448 . . . . 75.34 110.879 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 21.6 mm -72.77 -35.86 51.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 C-N-CA 120.555 -0.458 . . . . 58.42 110.274 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -34.37 77.78 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 122.022 -0.423 . . . . 70.64 111.615 -179.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.23 -38.63 50.79 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.386 -0.526 . . . . 49.38 112.027 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -69.73 -28.67 66.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 119.755 -0.778 . . . . 52.9 112.033 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -71.5 -38.96 70.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 119.737 -0.785 . . . . 41.14 110.297 177.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -73.77 -36.12 65.06 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.167 -0.613 . . . . 67.09 111.399 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -63.45 -50.42 69.83 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.37 -0.532 . . . . 61.21 110.99 176.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.75 -35.01 65.73 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.859 -0.336 . . . . 39.32 111.129 175.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.404 ' HB1' ' O ' ' B' ' 28' ' ' ARG . . . -70.64 -34.02 71.6 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.376 0.51 . . . . 34.68 112.376 -179.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -70.47 -31.15 68.17 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.553 -0.459 . . . . 76.79 111.739 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 38.0 p -78.86 -20.24 50.03 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.193 0.812 . . . . 72.28 113.193 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -113.1 2.13 15.56 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 114.552 1.316 . . . . 45.62 114.552 177.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.444 ' HB2' ' NH1' ' E' ' 26' ' ' ARG . 0.0 OUTLIER 64.1 13.24 7.63 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 125.601 1.561 . . . . 66.49 114.825 176.974 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.594 ' NH1' ' O ' ' F' ' 48' ' ' ARG . 21.3 mmt180 -99.51 144.78 28.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 119.265 0.939 . . . . 35.77 108.515 166.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 5.7 p -66.47 150.74 48.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.65 0.738 . . . . 33.7 111.573 -175.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 79.8 p -60.09 -30.09 69.01 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.333 -0.849 . . . . 49.03 111.396 175.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -69.59 -34.71 74.52 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.861 -0.336 . . . . 39.93 111.393 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -67.17 -37.63 84.06 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.606 -0.438 . . . . 35.42 111.24 179.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' MET . . . . . . . . . . . . . 13.3 mtm -72.29 -32.0 66.22 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.735 -0.786 . . . . 49.45 112.275 -178.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' MET . . . . . . . . . . . . . 70.6 mtm -67.63 -36.6 81.1 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.365 -0.934 . . . . 34.23 111.044 178.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -67.45 -37.98 83.78 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.99 -0.684 . . . . 72.31 110.923 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -72.62 -33.14 66.46 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.482 -0.487 . . . . 71.96 111.541 176.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.59 -44.7 95.65 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.577 -0.449 . . . . 33.94 111.083 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.405 ' O ' HG23 ' B' ' 42' ' ' VAL . 89.9 mt -68.04 -41.52 84.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 120.657 -0.417 . . . . 38.98 110.533 178.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ARG . . . . . . . . . . . . . 56.9 ttm-85 -60.34 -42.65 96.12 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 121.885 -0.509 . . . . 71.63 111.528 -177.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -69.5 -28.52 66.12 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.268 -0.573 . . . . 49.61 111.933 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -66.88 -47.84 70.6 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.793 -0.363 . . . . 52.36 111.366 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.405 HG23 ' O ' ' B' ' 38' ' ' ILE . 0.2 OUTLIER -66.05 -44.08 92.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 119.97 -0.692 . . . . 52.05 110.906 179.39 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.93 -42.95 95.1 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.256 -0.578 . . . . 36.65 111.222 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 37.8 ttp-105 -69.89 -44.63 69.35 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.002 -0.679 . . . . 38.7 111.345 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -75.71 -25.11 56.35 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.414 0.524 . . . . 54.96 112.414 -175.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -72.64 -34.19 67.11 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 119.528 -0.869 . . . . 58.3 111.367 178.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -72.17 -13.41 61.54 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.607 0.595 . . . . 55.07 112.607 175.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -87.42 -4.96 59.03 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 113.002 0.742 . . . . 60.68 113.002 172.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 C--N 1.331 -0.225 0 CA-C-N 118.263 0.483 . . . . 78.94 110.962 178.006 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' LYS . . . . . . . . . . . . . 11.8 mmmm . . . . . 0 C--O 1.23 0.07 0 N-CA-C 110.175 -0.306 . . . . 88.8 110.175 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -83.03 120.1 2.94 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 120.633 0.889 . . . . 80.32 111.794 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -108.09 140.18 27.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 108.692 -0.855 . . . . 72.48 108.692 176.731 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' SER . . . . . 0.561 ' O ' ' NE2' ' D' ' 31' ' ' HIS . 63.0 p -94.13 123.63 37.64 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.726 -0.842 . . . . 81.17 108.726 178.25 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 61.6 t -112.69 115.81 50.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 N-CA-C 108.133 -1.062 . . . . 66.64 108.133 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -79.18 108.28 12.56 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.184 -0.672 . . . . 83.78 109.184 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' LEU . . . . . . . . . . . . . 91.2 mt -112.54 142.26 45.33 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.421 0.688 . . . . 55.93 109.63 177.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -70.93 159.29 34.96 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.936 0.874 . . . . 70.71 110.608 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.22 -26.8 68.56 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.142 -0.935 . . . . 78.3 112.257 -173.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -68.0 -49.18 63.15 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.108 -0.637 . . . . 91.38 111.137 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 mp -73.94 -35.27 41.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.599 -0.44 . . . . 59.38 111.262 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -62.91 -34.57 77.71 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 121.741 -0.599 . . . . 69.16 111.517 -178.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.34 -35.74 58.59 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.75 -0.38 . . . . 48.68 111.015 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -67.3 -30.47 70.33 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 111.814 0.301 . . . . 50.24 111.814 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.22 -37.39 45.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 120.652 -0.419 . . . . 42.62 110.558 176.569 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -71.55 -40.61 69.91 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 121.773 -0.58 . . . . 59.6 111.237 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -64.34 -37.63 88.19 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.364 -0.534 . . . . 68.86 111.052 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' LEU . . . . . 0.401 HD12 HG13 ' D' ' 42' ' ' VAL . 0.4 OUTLIER -69.63 -37.71 76.91 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.294 -0.563 . . . . 39.63 111.089 178.794 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.22 -30.72 67.88 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.079 -0.648 . . . . 49.43 110.791 176.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -68.42 -33.63 74.55 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 111.906 0.336 . . . . 91.43 111.906 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.53 -24.03 36.88 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.601 0.963 . . . . 57.04 113.601 -176.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ARG . . . . . 0.406 ' HG2' ' HB2' ' E' ' 29' ' ' SER 0.535 88.1 mtt180 -92.01 1.99 56.84 Favored 'General case' 0 C--N 1.33 -0.258 1 N-CA-C 121.958 4.058 . . . . 42.78 121.958 176.244 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt 51.77 50.13 19.34 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 129.58 3.152 . . . . 65.91 117.495 -162.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 mtt85 -137.31 175.53 9.52 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.501 0.667 . . . . 72.41 110.85 -179.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' SER . . . . . . . . . . . . . 29.0 t -92.88 145.1 24.64 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.405 -0.816 . . . . 54.49 110.96 -175.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -69.87 -30.68 68.2 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.777 -0.647 . . . . 50.32 111.605 179.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' HIS . . . . . 0.486 ' NE2' ' O ' ' D' ' 8' ' ' SER . 1.4 m80 -70.47 -35.77 73.48 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.351 -0.54 . . . . 82.55 111.177 177.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' TRP . . . . . . . . . . . . . 82.4 t90 -66.87 -36.39 82.19 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.658 -0.417 . . . . 44.14 111.068 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' MET . . . . . . . . . . . . . 12.3 mtm -70.34 -32.83 70.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.415 -0.514 . . . . 43.13 111.559 -178.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' MET . . . . . . . . . . . . . 15.3 mtm -68.35 -34.49 76.18 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.181 -0.608 . . . . 42.24 111.58 177.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' ARG . . . . . 0.491 ' HD3' ' O ' ' D' ' 10' ' ' LYS . 48.3 mtm180 -66.46 -48.34 70.22 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.352 -0.539 . . . . 85.07 111.188 175.36 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -61.24 -31.46 71.25 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.478 -0.489 . . . . 82.09 111.494 177.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.07 -44.71 88.04 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.335 -0.546 . . . . 38.4 111.026 174.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' ILE . . . . . . . . . . . . . 87.1 mt -69.02 -35.56 69.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-O 120.863 0.364 . . . . 39.64 110.485 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' ARG . . . . . 0.567 ' NH1' ' O ' ' C' ' 101' ' ' HOH . 55.1 ttm-85 -66.72 -43.24 84.77 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.439 -0.505 . . . . 42.53 111.391 -179.081 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -71.19 -28.59 64.33 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.992 -0.683 . . . . 56.42 111.83 179.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -66.45 -47.79 72.02 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.563 -0.455 . . . . 35.62 111.136 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' VAL . . . . . . . . . . . . . 9.8 m -66.86 -42.82 89.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 119.949 -0.7 . . . . 46.91 110.62 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -60.58 -43.07 97.75 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.883 -0.51 . . . . 51.09 111.647 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' ARG . . . . . . . . . . . . . 38.4 ttp-105 -68.76 -43.81 75.03 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.062 -0.655 . . . . 50.4 111.155 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' GLU . . . . . 0.413 ' OE1' ' NH1' ' D' ' 26' ' ' ARG . 80.3 mm-40 -75.17 -23.69 57.77 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.49 0.552 . . . . 42.51 112.49 -176.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' GLU . . . . . 0.441 ' OE2' ' HD2' ' D' ' 18' ' ' ARG . 66.1 mt-10 -72.76 -35.52 67.48 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.203 -0.599 . . . . 54.77 111.387 179.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -72.4 -13.15 61.39 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.262 -0.575 . . . . 94.39 112.386 174.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -85.98 -5.53 59.21 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.351 0.5 . . . . 55.55 112.351 173.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 . . . . . 0 C--N 1.33 -0.256 0 CA-C-O 120.802 0.334 . . . . 96.62 110.468 177.051 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.155 0 N-CA-C 110.059 -0.348 . . . . 94.71 110.059 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' ILE . . . . . . . . . . . . . 4.8 mp -133.92 101.94 4.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 106.675 -1.602 . . . . 107.11 106.675 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -113.45 112.1 49.08 Favored Pre-proline 0 C--O 1.242 0.695 0 N-CA-C 109.293 -0.632 . . . . 100.59 109.293 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -85.82 116.56 1.6 Allowed 'Trans proline' 0 C--O 1.235 0.358 0 CA-C-N 119.602 0.894 . . . . 94.8 111.557 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 94.7 t -110.33 136.71 45.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 108.305 -0.998 . . . . 76.14 108.305 177.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' SER . . . . . 0.486 ' O ' ' NE2' ' C' ' 31' ' ' HIS . 74.8 m -96.06 121.92 38.34 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.796 -0.816 . . . . 81.14 108.796 177.766 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' VAL . . . . . . . . . . . . . 59.0 t -115.08 118.47 58.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.832 -1.173 . . . . 71.41 107.832 -178.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' LYS . . . . . 0.491 ' O ' ' HD3' ' C' ' 35' ' ' ARG . 68.9 mttm -77.34 107.0 9.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.324 -0.621 . . . . 116.29 109.324 178.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mp -113.81 138.85 49.71 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.552 -0.536 . . . . 76.91 109.552 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -73.58 160.34 31.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.673 0.749 . . . . 75.52 110.233 175.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.28 -27.56 68.56 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.435 -0.802 . . . . 74.3 111.718 -174.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -68.32 -47.97 66.13 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.372 -0.531 . . . . 79.53 110.692 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' ILE . . . . . 0.483 HD13 HH21 ' D' ' 18' ' ' ARG . 20.6 mm -72.92 -37.75 54.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 120.384 -0.526 . . . . 67.01 110.176 -179.24 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -65.11 -34.28 78.02 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 122.0 -0.437 . . . . 62.88 111.684 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.18 -37.57 53.43 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.133 -0.627 . . . . 50.14 111.939 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' ARG . . . . . 0.483 HH21 HD13 ' D' ' 15' ' ' ILE . 74.1 mtm180 -69.66 -30.64 68.37 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.359 -0.936 . . . . 68.83 112.071 -178.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.05 -37.48 53.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 119.797 -0.761 . . . . 49.11 110.355 177.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -72.43 -37.22 68.65 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.151 -0.62 . . . . 61.06 110.978 179.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -66.36 -37.36 85.12 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.424 -0.51 . . . . 51.4 111.165 176.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.21 -36.84 84.12 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.329 -0.548 . . . . 44.15 111.177 178.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.78 -31.71 68.57 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.393 -0.523 . . . . 56.68 111.588 178.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -69.04 -33.38 73.51 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.433 -0.507 . . . . 87.37 112.05 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.22 -22.06 45.37 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.37 0.508 . . . . 50.76 112.37 -178.458 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' ARG . . . . . 0.413 ' NH1' ' OE1' ' C' ' 45' ' ' GLU . 87.7 mtt180 -104.87 8.0 34.56 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.245 0.831 . . . . 44.78 113.245 175.43 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 66.1 mttt 47.67 56.96 6.42 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.392 1.077 . . . . 57.8 113.494 -176.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' ARG . . . . . 0.418 ' HB2' ' HE3' ' D' ' 33' ' ' MET . 24.8 mmt85 -126.86 176.41 7.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.649 0.738 . . . . 56.67 109.544 178.222 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' SER . . . . . . . . . . . . . 16.8 t -88.58 143.58 26.87 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.34 -0.845 . . . . 54.67 110.178 176.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -66.71 -31.65 72.44 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 119.754 -0.778 . . . . 66.34 111.2 176.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' HIS . . . . . 0.561 ' NE2' ' O ' ' C' ' 8' ' ' SER . 0.4 OUTLIER -71.36 -35.14 71.02 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.248 -0.581 . . . . 89.74 111.31 177.382 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' TRP . . . . . . . . . . . . . 82.2 t90 -65.72 -37.05 85.35 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.923 -0.711 . . . . 71.46 111.036 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' MET . . . . . 0.418 ' HE3' ' HB2' ' D' ' 28' ' ' ARG . 8.2 mtt -70.8 -33.13 70.42 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.513 -0.875 . . . . 44.66 111.291 179.43 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' MET . . . . . . . . . . . . . 15.4 mtt -69.57 -35.16 75.11 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.405 -0.518 . . . . 50.41 111.446 176.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.43 -49.17 67.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.722 -0.791 . . . . 74.76 110.983 175.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.73 -33.84 75.96 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.281 -0.568 . . . . 50.82 111.546 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.62 -45.59 86.21 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.405 -0.518 . . . . 39.63 110.871 178.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' ILE . . . . . 0.51 ' O ' HG23 ' D' ' 42' ' ' VAL . 86.9 mt -69.01 -44.01 81.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 120.538 -0.465 . . . . 36.75 110.199 177.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -54.21 -46.53 72.48 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.928 0.394 . . . . 41.28 111.263 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -72.6 -28.82 63.02 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.601 -0.44 . . . . 38.36 112.033 -178.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -66.55 -46.48 75.94 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.351 -0.54 . . . . 32.29 111.193 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' VAL . . . . . 0.51 HG23 ' O ' ' D' ' 38' ' ' ILE . 2.4 t -65.09 -43.37 95.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 C-N-CA 120.074 -0.65 . . . . 42.47 110.283 -179.706 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' D' ' 47' ' ' LYS . 97.1 mt-10 -59.91 -44.21 94.42 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.393 -0.523 . . . . 47.28 111.532 -179.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -69.43 -43.81 72.6 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.481 -0.888 . . . . 42.92 111.367 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -76.42 -27.7 56.38 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.59 -0.844 . . . . 32.53 112.638 -174.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -76.04 -32.26 59.25 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 119.43 -0.908 . . . . 55.69 111.953 177.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' D' ' 43' ' ' GLU . 64.2 mttm -69.93 -15.83 63.12 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.861 -0.736 . . . . 56.76 111.621 175.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' ARG . . . . . 0.649 ' O ' ' NH2' ' E' ' 28' ' ' ARG . 99.2 mtt180 -86.72 -5.7 59.05 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 122.577 0.351 . . . . 50.44 111.726 172.144 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -98.26 12.61 34.16 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 122.844 0.458 . . . . 59.3 111.961 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.227 0 CA-C-O 120.806 0.336 . . . . 68.25 111.111 -177.49 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 3' ' ' THR . . . . . . . . . . . . . 5.7 p . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.88 0.372 . . . . 102.83 111.301 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 4' ' ' ILE . . . . . . . . . . . . . 56.3 mt -75.32 130.76 35.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 109.105 -0.702 . . . . 87.75 109.105 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 5' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -119.01 119.37 32.2 Favored Pre-proline 0 C--O 1.244 0.804 0 C-N-CA 122.88 0.472 . . . . 104.41 110.921 -172.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 6' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -81.21 122.42 4.18 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 121.535 1.49 . . . . 87.65 110.839 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -105.03 141.26 20.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.593 -0.891 . . . . 70.2 108.593 179.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 8' ' ' SER . . . . . . . . . . . . . 32.5 t -93.87 124.64 38.01 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.948 -0.569 . . . . 74.66 110.58 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 9' ' ' VAL . . . . . . . . . . . . . 63.3 t -114.17 115.47 49.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 107.792 -1.188 . . . . 54.55 107.792 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 10' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -78.4 108.33 11.68 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.478 -0.564 . . . . 68.56 109.478 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 11' ' ' LEU . . . . . . . . . . . . . 89.5 mt -112.54 141.29 46.48 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.338 0.655 . . . . 89.56 109.346 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -71.98 160.32 32.72 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.729 0.776 . . . . 71.95 110.031 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.85 -26.83 67.65 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.401 -0.818 . . . . 73.49 112.067 -173.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 14' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -68.94 -47.5 65.55 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.237 -0.585 . . . . 68.44 111.167 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 15' ' ' ILE . . . . . 0.446 ' CD1' HH11 ' E' ' 18' ' ' ARG . 21.8 mm -72.96 -38.57 56.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 C-N-CA 120.644 -0.422 . . . . 55.36 111.124 -178.157 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -63.93 -33.26 75.31 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.974 -0.691 . . . . 65.36 111.189 -177.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.76 -36.66 56.91 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.495 -0.482 . . . . 53.75 111.674 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 18' ' ' ARG . . . . . 0.446 HH11 ' CD1' ' E' ' 15' ' ' ILE . 73.1 mtm180 -68.6 -26.68 65.49 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.581 -0.848 . . . . 53.99 112.001 -179.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 19' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -71.59 -40.01 70.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 119.195 -1.002 . . . . 42.25 110.447 177.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -74.6 -34.17 62.77 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.181 -1.008 . . . . 71.25 111.296 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 21' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -61.1 -34.18 74.54 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.284 -0.567 . . . . 66.89 110.964 171.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.431 HD21 HH21 ' E' ' 26' ' ' ARG . 0.5 OUTLIER -72.01 -35.2 69.36 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 121.068 -0.253 . . . . 46.61 111.347 171.776 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' E' E ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.95 -28.63 66.81 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 111.792 0.293 . . . . 39.61 111.792 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 24' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -66.56 -29.85 70.02 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.625 -0.43 . . . . 61.98 111.989 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.26 -20.56 54.96 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.759 0.652 . . . . 64.71 112.759 -177.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 26' ' ' ARG . . . . . 0.444 ' NH1' ' HB2' ' B' ' 27' ' ' LYS . 1.5 mmt180 -112.33 177.14 4.74 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.602 0.761 . . . . 51.71 109.075 175.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -80.74 -4.08 53.16 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.95 -0.568 . . . . 71.57 112.126 178.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 28' ' ' ARG . . . . . 0.649 ' NH2' ' O ' ' D' ' 48' ' ' ARG . 38.4 mmt180 -89.04 154.93 19.8 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.987 0.899 . . . . 67.2 111.59 -166.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 29' ' ' SER . . . . . 0.406 ' HB2' ' HG2' ' C' ' 26' ' ' ARG . 3.5 t -79.4 156.93 27.7 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.825 -1.079 . . . . 48.73 110.557 175.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 30' ' ' SER . . . . . . . . . . . . . 19.8 m -62.74 -31.1 71.98 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.34 -0.845 . . . . 54.04 111.195 173.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 31' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -71.15 -35.36 71.65 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.838 -0.345 . . . . 41.25 111.068 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 32' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -67.38 -36.92 82.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.736 -0.386 . . . . 39.15 111.237 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 33' ' ' MET . . . . . 0.404 ' HE1' ' HB3' ' E' ' 22' ' ' LEU . 8.3 mtm -70.81 -32.4 69.47 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.459 -0.496 . . . . 46.93 111.804 -178.05 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 34' ' ' MET . . . . . . . . . . . . . 15.3 mtt -67.78 -34.04 76.01 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.111 -0.635 . . . . 36.15 111.644 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.14 -46.59 76.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.256 -0.578 . . . . 63.84 111.037 174.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 36' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -67.8 -29.58 68.79 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.629 -0.428 . . . . 26.98 111.396 177.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.24 -45.28 77.21 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.59 -0.444 . . . . 31.58 110.909 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 38' ' ' ILE . . . . . 0.423 ' O ' HG23 ' E' ' 42' ' ' VAL . 88.8 mt -69.21 -40.46 80.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 120.659 -0.416 . . . . 32.56 110.387 177.272 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 39' ' ' ARG . . . . . . . . . . . . . 22.7 ttt85 -59.89 -41.92 92.68 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 122.079 -0.388 . . . . 82.1 111.505 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 40' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -70.05 -28.77 65.73 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.213 -0.595 . . . . 43.49 111.683 178.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 41' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -66.25 -47.24 74.38 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.552 -0.459 . . . . 41.88 110.95 179.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 42' ' ' VAL . . . . . 0.423 HG23 ' O ' ' E' ' 38' ' ' ILE . 2.0 t -66.53 -43.9 90.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 120.211 -0.596 . . . . 50.47 110.427 179.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 43' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.9 -42.92 98.98 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.449 -0.5 . . . . 49.77 111.414 -179.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 44' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -68.99 -44.84 72.02 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.165 -0.614 . . . . 58.32 111.37 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 45' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -76.04 -25.83 56.02 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.483 0.549 . . . . 67.54 112.483 -175.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 46' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -73.45 -35.45 65.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.726 -0.79 . . . . 71.96 111.063 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 47' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -73.12 -14.15 61.32 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.261 0.467 . . . . 74.96 112.261 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 48' ' ' ARG . . . . . 0.523 ' NH1' ' OE2' ' F' ' 40' ' ' GLU . 0.2 OUTLIER -85.51 -3.08 58.75 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.171 0.588 . . . . 76.74 112.485 173.694 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' E' E ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -88.43 29.94 0.94 Allowed 'General case' 0 C--O 1.236 0.364 0 N-CA-C 115.076 1.509 . . . . 74.44 115.076 176.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.217 0 C-N-CA 124.928 1.291 . . . . 75.9 110.833 -168.68 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 3' ' ' THR . . . . . 0.54 ' O ' ' OG1' ' F' ' 3' ' ' THR . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.828 0.347 . . . . 119.15 111.284 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 4' ' ' ILE . . . . . . . . . . . . . 55.5 mt -89.59 115.07 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.683 -1.229 . . . . 103.61 107.683 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 5' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -99.84 118.13 62.3 Favored Pre-proline 0 C--O 1.241 0.639 0 CA-C-N 116.476 -0.329 . . . . 96.33 110.725 -172.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 6' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -81.57 122.44 4.01 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 121.503 1.469 . . . . 97.41 110.33 177.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -105.03 143.21 16.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 108.696 -0.853 . . . . 72.8 108.696 179.859 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 8' ' ' SER . . . . . . . . . . . . . 32.4 t -91.04 124.41 35.25 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.431 -0.581 . . . . 84.4 109.431 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 9' ' ' VAL . . . . . . . . . . . . . 66.3 t -113.11 118.31 57.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.357 -0.979 . . . . 60.65 108.357 -176.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 108.66 10.2 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.809 -0.812 . . . . 89.14 108.809 178.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 11' ' ' LEU . . . . . . . . . . . . . 92.8 mt -114.99 138.75 50.49 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.748 -0.464 . . . . 74.31 109.748 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 12' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -74.61 158.62 33.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.676 0.75 . . . . 74.73 110.326 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.87 -27.68 69.51 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.419 -0.81 . . . . 85.45 111.827 -175.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.37 -49.5 59.77 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.494 -0.482 . . . . 89.65 111.146 -179.75 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 15' ' ' ILE . . . . . . . . . . . . . 22.8 mm -73.85 -35.42 42.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 120.935 0.398 . . . . 73.83 110.473 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -62.6 -33.09 74.28 Favored 'General case' 0 C--O 1.236 0.395 0 O-C-N 121.904 -0.498 . . . . 81.58 111.472 -179.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.33 -35.5 61.19 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.511 -0.476 . . . . 60.84 111.14 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 18' ' ' ARG . . . . . 0.475 ' HA ' ' NE2' ' F' ' 21' ' ' HIS . 59.2 mtp180 -66.39 -29.13 69.23 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.994 -0.282 . . . . 74.56 111.588 -179.255 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 19' ' ' VAL . . . . . . . . . . . . . 60.3 t -71.62 -35.42 55.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 120.935 0.398 . . . . 58.05 110.449 177.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 20' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -69.1 -61.06 1.95 Allowed 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.858 -0.526 . . . . 104.56 111.601 -175.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 21' ' ' HIS . . . . . 0.475 ' NE2' ' HA ' ' F' ' 18' ' ' ARG . 0.8 OUTLIER -72.22 -6.97 46.66 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 117.733 -1.587 . . . . 91.07 113.071 -177.48 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.02 -38.84 56.8 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.245 -0.982 . . . . 55.21 110.215 163.038 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 23' ' ' ALA . . . . . 0.439 ' HB1' ' O ' ' F' ' 28' ' ' ARG . . . -71.65 -31.24 66.62 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 121.054 -0.258 . . . . 74.8 111.005 175.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 24' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -68.57 -32.44 72.36 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 111.465 0.172 . . . . 93.29 111.465 178.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 25' ' ' THR . . . . . . . . . . . . . 2.6 m -80.43 -22.95 40.65 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.782 0.66 . . . . 75.69 112.782 -177.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 26' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -104.65 11.08 34.53 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 115.8 1.778 . . . . 58.83 115.8 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 27' ' ' LYS . . . . . . . . . . . . . 37.7 mttm 47.53 52.27 12.66 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.91 1.284 . . . . 73.59 110.641 -177.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 28' ' ' ARG . . . . . 0.439 ' O ' ' HB1' ' F' ' 23' ' ' ALA . 0.4 OUTLIER -133.58 164.32 27.44 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.54 -0.911 . . . . 77.59 108.54 177.511 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' F' F ' 29' ' ' SER . . . . . . . . . . . . . 16.2 t -79.26 136.73 37.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.955 -0.566 . . . . 56.56 110.729 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -68.22 -30.68 69.81 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.966 -0.561 . . . . 57.82 111.737 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.91 -33.66 70.76 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.2 -0.6 . . . . 94.54 111.245 177.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 32' ' ' TRP . . . . . . . . . . . . . 80.0 t90 -65.17 -35.66 81.79 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.796 -0.361 . . . . 58.72 111.553 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 33' ' ' MET . . . . . . . . . . . . . 13.8 mtm -69.45 -31.72 70.22 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.402 -0.919 . . . . 63.57 111.09 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 34' ' ' MET . . . . . 0.445 ' O ' HG12 ' F' ' 38' ' ' ILE . 64.2 mtt -67.61 -36.57 81.1 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.43 -0.508 . . . . 58.08 111.072 177.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -37.0 82.22 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.644 -0.422 . . . . 64.94 111.505 175.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 36' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -75.58 -29.27 59.26 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.517 -0.473 . . . . 67.99 111.784 176.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.07 97.78 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.78 -0.368 . . . . 47.95 111.27 173.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 38' ' ' ILE . . . . . 0.445 HG12 ' O ' ' F' ' 34' ' ' MET . 20.9 mm -66.65 -45.41 88.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 120.902 0.382 . . . . 50.88 110.533 179.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 39' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.89 -47.14 86.33 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.026 -0.421 . . . . 84.35 111.298 -176.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 40' ' ' GLU . . . . . 0.523 ' OE2' ' NH1' ' E' ' 48' ' ' ARG . 99.5 mt-10 -66.47 -29.83 70.04 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.382 -0.527 . . . . 43.0 111.668 -179.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 41' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -67.55 -46.59 72.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.637 -0.425 . . . . 43.08 110.716 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 42' ' ' VAL . . . . . . . . . . . . . 47.5 t -66.42 -43.29 91.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 120.881 -0.328 . . . . 46.08 110.813 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 43' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -60.3 -43.86 95.93 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.97 -0.456 . . . . 60.17 111.634 -178.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 44' ' ' ARG . . . . . . . . . . . . . 36.9 ttp-105 -69.94 -43.22 72.06 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.269 -0.572 . . . . 47.77 111.417 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 45' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -74.87 -25.28 58.86 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.166 -0.614 . . . . 56.89 111.992 -175.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 46' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -73.18 -35.19 66.35 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.368 -0.933 . . . . 45.09 110.905 177.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 47' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -74.14 -15.59 61.03 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.022 -0.671 . . . . 61.18 112.795 175.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 48' ' ' ARG . . . . . 0.594 ' O ' ' NH1' ' B' ' 28' ' ' ARG . 98.6 mtt180 -87.73 -10.19 51.84 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.827 0.676 . . . . 42.1 112.827 173.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.65 6.84 42.16 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.059 0.544 . . . . 57.91 112.214 175.557 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 50' ' ' ALA . . . . . . . . . . . . . . . 54.2 43.51 30.5 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.481 0.657 . . . . 58.94 110.78 -173.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 16.3 mt . . . . . 0 N--CA 1.464 0.256 0 CA-C-N 115.692 -0.686 . . . . 87.81 112.029 -177.8 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' HOH . . . . . 0.567 ' O ' ' NH1' ' C' ' 39' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_