data_1ijw_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1ijw _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.531 0.34 0 O5'-C5'-C4' 112.434 1.596 . . . . 88.63 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.161 0 C5'-C4'-C3' 110.548 -2.768 . . . . 95.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.411 -1.826 0 O4'-C1'-N19 106.421 -1.723 . . . . 67.61 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.548 0 P-O5'-C5' 118.524 -1.485 . . . . 49.93 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.414 -1.299 0 C5'-C4'-O4' 112.667 2.042 . . . . 61.51 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.562 0 P-O5'-C5' 118.112 -1.742 . . . . 56.95 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ' DT' . . . . . 0.548 ' OP2' ' NH2' ' C' ' 178' ' ' ARG . . . . . . . . 0 O5'--C5' 1.409 -1.918 0 O3'-P-O5' 100.48 -1.853 . . . . 50.73 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.644 ' N7 ' ' NH1' ' C' ' 178' ' ' ARG . . . . . . . . 0 O3'--C3' 1.408 -1.768 0 C3'-C2'-C1' 100.18 -1.8 . . . . 44.7 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.581 -2.176 0 C5'-C4'-O4' 112.747 2.092 . . . . 49.84 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.565 0 C5'-C4'-O4' 113.733 2.708 . . . . 53.39 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ' DA' . . . . . 0.441 ' N1 ' ' N3 ' ' B' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.414 -1.636 0 O3'-P-O5' 101.496 -1.318 . . . . 62.91 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ' DA' . . . . . 0.409 ' N1 ' ' N3 ' ' B' ' 19' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.414 -1.284 0 C5'-C4'-O4' 111.625 1.391 . . . . 71.58 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.587 -1.65 0 C3'-C2'-C1' 99.913 -1.99 . . . . 75.95 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.417 -1.416 0 O4'-C1'-N19 109.607 2.258 . . . . 80.86 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ' DA' . . . . . 0.495 " C2'" " O5'" ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.534 1.635 3 C5'-C4'-C3' 125.903 7.469 . . . . 68.02 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.495 " O5'" " C2'" ' B' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.401 -2.418 0 N19-C1'-C2' 108.169 -3.769 . . . . 64.5 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' CBR . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.383 -3.692 0 C4'-C3'-O3' 116.422 2.783 . . . . 73.77 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ' DT' . . . . . 0.409 ' N3 ' ' N1 ' ' A' ' 13' ' ' ' DA' . . . . . . . . 3 C4'--C3' 1.428 -9.968 3 P-O3'-C3' 141.148 17.873 . . . . 53.59 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ' DT' . . . . . 0.441 ' N3 ' ' N1 ' ' A' ' 12' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.416 -1.181 0 C4'-C3'-C2' 105.197 1.997 . . . . 44.02 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.186 0 O3'-P-O5' 101.269 -1.437 . . . . 53.99 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.556 0 C4'-C3'-O3' 107.396 -1.32 . . . . 59.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ' DC' . . . . . 0.442 ' N3 ' ' N1 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.418 -1.398 0 C3'-C2'-C1' 99.259 -2.458 . . . . 46.23 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C5'-C4'-C3' 116.608 1.272 . . . . 44.89 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.704 0 C3'-C2'-C1' 99.486 -2.295 . . . . 55.04 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.536 0 C5'-C4'-O4' 111.764 1.478 . . . . 52.7 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.587 -1.649 0 N19-C1'-C2' 116.908 1.693 . . . . 56.62 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.676 0 C5'-C4'-O4' 103.32 -3.8 . . . . 64.4 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.127 0 O4'-C1'-N19 108.816 1.27 . . . . 53.7 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 139' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.784 0 N-CA-C 112.09 -0.404 . . . . 58.9 112.09 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 140' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -92.41 135.6 26.5 Favored Pre-proline 0 N--CA 1.45 -0.456 0 C-N-CA 119.453 -0.899 . . . . 61.89 111.442 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 141' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.36 152.01 83.36 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 120.675 0.916 . . . . 52.6 114.093 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 142' ' ' ARG . . . . . . . . . . . . . 72.1 mtt-85 -70.22 158.07 36.51 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.546 -0.752 . . . . 52.92 109.176 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 143' ' ' ALA . . . . . . . . . . . . . . . -75.34 -37.74 60.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.22 -0.446 . . . . 55.32 110.601 -179.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 144' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -128.01 136.85 59.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.761 -0.654 . . . . 50.68 112.305 -179.49 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 145' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -78.38 173.07 12.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.831 -0.803 . . . . 59.03 108.831 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 146' ' ' LYS . . . . . . . . . . . . . . . -59.62 -30.48 68.73 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 112.681 0.623 . . . . 54.75 112.681 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . . . -63.38 -57.51 10.09 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 107.826 -1.175 . . . . 57.67 107.826 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 148' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -55.82 -32.33 63.48 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.077 -0.965 . . . . 58.43 111.468 -179.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 149' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -65.2 -43.61 91.0 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.67 -0.812 . . . . 60.68 112.279 179.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 150' ' ' GLU . . . . . . . . . . . . . . . -64.33 -43.41 94.69 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 109.259 -0.645 . . . . 58.46 109.259 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 151' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -64.07 -58.48 6.53 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.236 -0.893 . . . . 50.01 110.366 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 152' ' ' ILE . . . . . . . . . . . . . 49.1 mt -53.12 -44.53 51.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 119.841 -0.744 . . . . 51.17 109.177 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 153' ' ' SER . . . . . . . . . . . . . 35.2 t -51.77 -43.62 63.06 Favored 'General case' 0 C--O 1.248 0.98 0 N-CA-C 109.421 -0.585 . . . . 59.88 109.421 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 154' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -64.81 -56.38 13.83 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.908 -1.042 . . . . 60.49 109.768 -179.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 155' ' ' LEU . . . . . . . . . . . . . 94.5 mt -48.89 -45.0 40.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.937 -0.574 . . . . 48.83 110.154 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 156' ' ' LEU . . . . . . . . . . . . . 25.1 mt -60.8 -40.08 91.33 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.851 0.686 . . . . 51.37 112.851 -179.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -70.94 -28.97 64.88 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.122 -0.696 . . . . 95.0 109.122 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 158' ' ' LYS . . . . . . . . . . . . . . . -77.45 -2.58 36.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 120.02 -0.672 . . . . 61.07 110.51 178.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 159' ' ' GLY . . . . . . . . . . . . . . . 99.79 13.71 36.6 Favored Glycine 0 C--N 1.333 0.383 0 N-CA-C 119.265 2.466 . . . . 56.47 119.265 178.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 160' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -76.88 128.11 82.28 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 118.096 0.948 . . . . 66.23 113.087 178.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -60.01 123.52 13.37 Favored 'Trans proline' 0 C--O 1.239 0.562 1 C-N-CA 125.375 4.05 . . . . 55.7 112.895 -180.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 162' ' ' ARG . . . . . . . . . . . . . 40.4 mtt85 -51.15 -31.69 20.64 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 112.934 0.716 . . . . 57.61 112.934 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 163' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -65.25 -43.8 90.18 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 119.171 -1.012 . . . . 82.47 109.346 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 164' ' ' GLN . . . . . . . . . . . . . . . -62.26 -47.5 84.1 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 119.986 -0.686 . . . . 69.71 110.845 179.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 165' ' ' LEU . . . . . . . . . . . . . 18.3 mt -61.94 -37.59 85.29 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 120.303 -0.559 . . . . 50.81 110.909 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 166' ' ' ALA . . . . . . . . . . . . . . . -57.62 -60.99 2.84 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 108.281 -1.007 . . . . 48.42 108.281 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 167' ' ' ILE . . . . . . . . . . . . . 66.4 mt -48.32 -53.3 6.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 113.555 0.946 . . . . 55.34 113.555 -179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 168' ' ' ILE . . . . . . . . . . . . . 65.4 mt -59.33 -52.18 63.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.768 -0.651 . . . . 57.26 111.855 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 169' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -75.89 -3.9 37.87 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 118.573 -1.251 . . . . 52.72 113.252 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 170' ' ' GLY . . . . . . . . . . . . . . . 61.32 53.77 41.68 Favored Glycine 0 C--O 1.221 -0.676 0 O-C-N 123.934 0.771 . . . . 59.78 112.252 179.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 171' ' ' ILE . . . . . . . . . . . . . 46.6 pt -144.37 178.78 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 107.174 -1.417 . . . . 49.63 107.174 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 172' ' ' GLY . . . . . . . . . . . . . . . -95.2 144.67 17.34 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 118.796 2.278 . . . . 41.04 118.796 -177.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 173' ' ' VAL . . . . . . . . . . . . . 69.5 t -53.25 -41.23 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 114.909 -0.646 . . . . 30.89 110.924 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 174' ' ' SER . . . . . . . . . . . . . 89.4 p -60.34 -34.51 73.93 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 119.146 -1.021 . . . . 37.13 112.28 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 175' ' ' THR . . . . . . . . . . . . . 40.9 m -63.85 -44.54 92.84 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.3 -0.63 . . . . 41.31 109.3 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 176' ' ' LEU . . . . . . . . . . . . . 74.6 mt -61.13 -49.24 78.07 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.125 -0.63 . . . . 40.95 109.839 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 177' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -57.3 -25.91 60.04 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 119.417 -0.913 . . . . 39.01 110.73 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 178' ' ' ARG . . . . . 0.644 ' NH1' ' N7 ' ' A' ' 9' ' ' ' DG' . 18.9 ttm180 -78.97 -47.31 16.55 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 119.81 -0.756 . . . . 47.28 110.146 179.351 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 179' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -66.28 -37.79 86.26 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 120.26 -0.576 . . . . 43.15 110.536 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 180' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -133.82 88.43 32.85 Favored Pre-proline 0 C--O 1.218 -0.561 0 N-CA-C 113.107 0.78 . . . . 48.35 113.107 -179.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 181' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.61 144.55 74.34 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 123.21 2.607 . . . . 47.33 109.571 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 182' ' ' ALA . . . . . 0.427 ' O ' ' N ' ' C' ' 184' ' ' SER . . . -55.64 -46.93 77.36 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 104.105 -2.554 . . . . 49.23 104.105 179.177 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 183' ' ' SER . . . . . . . . . . . . . 5.8 p -67.11 61.65 0.05 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.708 -1.133 . . . . 59.61 109.9 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 184' ' ' SER . . . . . 0.427 ' N ' ' O ' ' C' ' 182' ' ' ALA . 1.5 p -176.91 12.53 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.948 0.722 . . . . 67.37 112.948 179.407 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 185' ' ' ILE . . . . . . . . . . . . . 46.6 mm . . . . . 0 C--O 1.254 1.303 0 CA-C-O 117.038 -1.458 . . . . 76.44 112.142 -179.012 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' TRS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' TRS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ' DT' . . . . . 0.416 H2'' ' OP2' ' A' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.531 0.34 0 O5'-C5'-C4' 112.434 1.596 . . . . 88.629999999999995 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ' DG' . . . . . 0.432 " C2'" ' H72' ' A' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.421 -1.161 0 C5'-C4'-C3' 110.548 -2.768 . . . . 95.0 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ' DT' . . . . . 0.432 ' H72' " C2'" ' A' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.411 -1.826 0 O4'-C1'-N19 106.421 -1.723 . . . . 67.609999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ' DT' . . . . . 0.401 ' O2 ' ' HA2' ' C' ' 139' ' ' GLY . . . . . . . . 0 O5'--C5' 1.415 -1.548 0 P-O5'-C5' 118.524 -1.485 . . . . 49.93 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.414 -1.299 0 C5'-C4'-O4' 112.667 2.042 . . . . 61.509999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.562 0 P-O5'-C5' 118.112 -1.742 . . . . 56.950000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ' DT' . . . . . 0.548 ' OP2' ' NH2' ' C' ' 178' ' ' ARG . . . . . . . . 0 O5'--C5' 1.409 -1.918 0 O3'-P-O5' 100.48 -1.853 . . . . 50.729999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ' DG' . . . . . 0.644 ' N7 ' ' NH1' ' C' ' 178' ' ' ARG . . . . . . . . 0 O3'--C3' 1.408 -1.768 0 C3'-C2'-C1' 100.18 -1.8 . . . . 44.700000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.581 -2.176 0 C5'-C4'-O4' 112.747 2.092 . . . . 49.840000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.565 0 C5'-C4'-O4' 113.733 2.708 . . . . 53.390000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.636 0 O3'-P-O5' 101.496 -1.318 . . . . 62.909999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.414 -1.284 0 C5'-C4'-O4' 111.625 1.391 . . . . 71.579999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.587 -1.65 0 C3'-C2'-C1' 99.913 -1.99 . . . . 75.950000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.417 -1.416 0 O4'-C1'-N19 109.607 2.258 . . . . 80.859999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ' DA' . . . . . 0.77 H2'' " O5'" ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.534 1.635 3 C5'-C4'-C3' 125.903 7.469 . . . . 68.019999999999996 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ' DT' . . . . . 0.77 " O5'" H2'' ' B' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.401 -2.418 0 N19-C1'-C2' 108.169 -3.769 . . . . 64.5 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' CBR . . . . . 0.517 H2'' " H5'" ' B' ' 19' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.383 -3.692 0 C4'-C3'-O3' 116.422 2.783 . . . . 73.769999999999996 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ' DT' . . . . . 0.517 " H5'" H2'' ' B' ' 18' ' ' CBR . . . . . . . . 3 C4'--C3' 1.428 -9.968 3 P-O3'-C3' 141.148 17.873 . . . . 53.590000000000003 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ' DT' . . . . . 0.462 H2'' ' C8 ' ' B' ' 21' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.416 -1.181 0 C4'-C3'-C2' 105.197 1.997 . . . . 44.020000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ' DA' . . . . . 0.462 ' C8 ' H2'' ' B' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.421 -1.186 0 O3'-P-O5' 101.269 -1.437 . . . . 53.990000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.556 0 C4'-C3'-O3' 107.396 -1.32 . . . . 59.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.418 -1.398 0 C3'-C2'-C1' 99.259 -2.458 . . . . 46.229999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C5'-C4'-C3' 116.608 1.272 . . . . 44.890000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.704 0 C3'-C2'-C1' 99.486 -2.295 . . . . 55.039999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.536 0 C5'-C4'-O4' 111.764 1.478 . . . . 52.700000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ' DA' . . . . . 0.545 H2'' " H5'" ' B' ' 28' ' ' ' DA' . . . . . . . . 0 P--O3' 1.587 -1.649 0 N19-C1'-C2' 116.908 1.693 . . . . 56.619999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ' DA' . . . . . 0.545 " H5'" H2'' ' B' ' 27' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.413 -1.676 0 C5'-C4'-O4' 103.32 -3.8 . . . . 64.400000000000006 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.127 0 O4'-C1'-N19 108.816 1.27 . . . . 53.700000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 139' ' ' GLY . . . . . 0.401 ' HA2' ' O2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 N--CA 1.498 2.784 0 N-CA-C 112.09 -0.404 . . . . 58.899999999999999 112.09 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 140' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -92.41 135.6 26.5 Favored Pre-proline 0 N--CA 1.45 -0.456 0 C-N-CA 119.453 -0.899 . . . . 61.890000000000001 111.442 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 141' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.36 152.01 83.36 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 120.675 0.916 . . . . 52.600000000000001 114.093 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 142' ' ' ARG . . . . . . . . . . . . . 72.1 mtt-85 -70.22 158.07 36.51 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.546 -0.752 . . . . 52.920000000000002 109.176 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 143' ' ' ALA . . . . . . . . . . . . . . . -75.34 -37.74 60.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.22 -0.446 . . . . 55.32 110.601 -179.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 144' ' ' ILE . . . . . 0.514 HD11 ' CE2' ' C' ' 179' ' ' TYR . 0.2 OUTLIER -128.01 136.85 59.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.761 -0.654 . . . . 50.68 112.305 -179.49 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 145' ' ' ASN . . . . . 0.609 ' OD1' ' HG3' ' C' ' 148' ' ' GLU . 13.3 p30 -78.38 173.07 12.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.831 -0.803 . . . . 59.030000000000001 108.831 178.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 146' ' ' LYS . . . . . . . . . . . . . . . -59.62 -30.48 68.73 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 112.681 0.623 . . . . 54.75 112.681 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . . . -63.38 -57.51 10.09 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 107.826 -1.175 . . . . 57.670000000000002 107.826 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 148' ' ' GLU . . . . . 0.609 ' HG3' ' OD1' ' C' ' 145' ' ' ASN . 51.9 mt-10 -55.82 -32.33 63.48 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.077 -0.965 . . . . 58.43 111.468 -179.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 149' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -65.2 -43.61 91.0 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.67 -0.812 . . . . 60.68 112.279 179.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 150' ' ' GLU . . . . . . . . . . . . . . . -64.33 -43.41 94.69 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 109.259 -0.645 . . . . 58.460000000000001 109.259 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 151' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -64.07 -58.48 6.53 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.236 -0.893 . . . . 50.009999999999998 110.366 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 152' ' ' ILE . . . . . . . . . . . . . 49.1 mt -53.12 -44.53 51.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 119.841 -0.744 . . . . 51.170000000000002 109.177 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 153' ' ' SER . . . . . . . . . . . . . 35.2 t -51.77 -43.62 63.06 Favored 'General case' 0 C--O 1.248 0.98 0 N-CA-C 109.421 -0.585 . . . . 59.880000000000003 109.421 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 154' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -64.81 -56.38 13.83 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.908 -1.042 . . . . 60.490000000000002 109.768 -179.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 155' ' ' LEU . . . . . . . . . . . . . 94.5 mt -48.89 -45.0 40.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.937 -0.574 . . . . 48.829999999999998 110.154 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 156' ' ' LEU . . . . . . . . . . . . . 25.1 mt -60.8 -40.08 91.33 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.851 0.686 . . . . 51.369999999999997 112.851 -179.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -70.94 -28.97 64.88 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.122 -0.696 . . . . 95.0 109.122 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 158' ' ' LYS . . . . . . . . . . . . . . . -77.45 -2.58 36.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 120.02 -0.672 . . . . 61.07 110.51 178.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 159' ' ' GLY . . . . . . . . . . . . . . . 99.79 13.71 36.6 Favored Glycine 0 C--N 1.333 0.383 0 N-CA-C 119.265 2.466 . . . . 56.469999999999999 119.265 178.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 160' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -76.88 128.11 82.28 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 118.096 0.948 . . . . 66.230000000000004 113.087 178.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 161' ' ' PRO . . . . . 0.462 ' HG2' ' CB ' ' C' ' 164' ' ' GLN . 84.0 Cg_endo -60.01 123.52 13.37 Favored 'Trans proline' 0 C--O 1.239 0.562 1 C-N-CA 125.375 4.05 . . . . 55.700000000000003 112.895 -180.0 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 162' ' ' ARG . . . . . . . . . . . . . 40.4 mtt85 -51.15 -31.69 20.64 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 112.934 0.716 . . . . 57.609999999999999 112.934 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 163' ' ' GLN . . . . . 0.433 ' O ' HG13 ' C' ' 167' ' ' ILE . 38.1 mt-30 -65.25 -43.8 90.18 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 119.171 -1.012 . . . . 82.469999999999999 109.346 179.284 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 164' ' ' GLN . . . . . 0.462 ' CB ' ' HG2' ' C' ' 161' ' ' PRO . . . -62.26 -47.5 84.1 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 119.986 -0.686 . . . . 69.709999999999994 110.845 179.29 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 165' ' ' LEU . . . . . . . . . . . . . 18.3 mt -61.94 -37.59 85.29 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 120.303 -0.559 . . . . 50.810000000000002 110.909 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 166' ' ' ALA . . . . . . . . . . . . . . . -57.62 -60.99 2.84 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 108.281 -1.007 . . . . 48.420000000000002 108.281 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 167' ' ' ILE . . . . . 0.433 HG13 ' O ' ' C' ' 163' ' ' GLN . 66.4 mt -48.32 -53.3 6.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 113.555 0.946 . . . . 55.340000000000003 113.555 -179.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 168' ' ' ILE . . . . . . . . . . . . . 65.4 mt -59.33 -52.18 63.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.768 -0.651 . . . . 57.259999999999998 111.855 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 169' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -75.89 -3.9 37.87 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 118.573 -1.251 . . . . 52.719999999999999 113.252 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 170' ' ' GLY . . . . . 0.604 ' O ' ' H12' ' C' ' 203' ' ' TRS . . . 61.32 53.77 41.68 Favored Glycine 0 C--O 1.221 -0.676 0 O-C-N 123.934 0.771 . . . . 59.780000000000001 112.252 179.406 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 171' ' ' ILE . . . . . . . . . . . . . 46.6 pt -144.37 178.78 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 107.174 -1.417 . . . . 49.630000000000003 107.174 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 172' ' ' GLY . . . . . . . . . . . . . . . -95.2 144.67 17.34 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 118.796 2.278 . . . . 41.039999999999999 118.796 -177.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 173' ' ' VAL . . . . . . . . . . . . . 69.5 t -53.25 -41.23 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 114.909 -0.646 . . . . 30.890000000000001 110.924 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 174' ' ' SER . . . . . . . . . . . . . 89.4 p -60.34 -34.51 73.93 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 119.146 -1.021 . . . . 37.130000000000003 112.28 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 175' ' ' THR . . . . . . . . . . . . . 40.9 m -63.85 -44.54 92.84 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.3 -0.63 . . . . 41.310000000000002 109.3 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 176' ' ' LEU . . . . . . . . . . . . . 74.6 mt -61.13 -49.24 78.07 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.125 -0.63 . . . . 40.950000000000003 109.839 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 177' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -57.3 -25.91 60.04 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 119.417 -0.913 . . . . 39.009999999999998 110.73 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 178' ' ' ARG . . . . . 0.644 ' NH1' ' N7 ' ' A' ' 9' ' ' ' DG' . 18.9 ttm180 -78.97 -47.31 16.55 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 119.81 -0.756 . . . . 47.280000000000001 110.146 179.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 179' ' ' TYR . . . . . 0.514 ' CE2' HD11 ' C' ' 144' ' ' ILE . 35.2 m-85 -66.28 -37.79 86.26 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 120.26 -0.576 . . . . 43.149999999999999 110.536 177.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 180' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -133.82 88.43 32.85 Favored Pre-proline 0 C--O 1.218 -0.561 0 N-CA-C 113.107 0.78 . . . . 48.350000000000001 113.107 -179.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 181' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.61 144.55 74.34 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 123.21 2.607 . . . . 47.329999999999998 109.571 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 182' ' ' ALA . . . . . 0.41 ' O ' ' N ' ' C' ' 184' ' ' SER . . . -55.64 -46.93 77.36 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 104.105 -2.554 . . . . 49.229999999999997 104.105 179.177 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 183' ' ' SER . . . . . . . . . . . . . 5.8 p -67.11 61.65 0.05 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.708 -1.133 . . . . 59.609999999999999 109.9 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 184' ' ' SER . . . . . 0.41 ' N ' ' O ' ' C' ' 182' ' ' ALA . 1.5 p -176.91 12.53 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.948 0.722 . . . . 67.370000000000005 112.948 179.407 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 185' ' ' ILE . . . . . . . . . . . . . 46.6 mm . . . . . 0 C--O 1.254 1.303 0 CA-C-O 117.038 -1.458 . . . . 76.439999999999998 112.142 -179.012 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' TRS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' TRS . . . . . 0.604 ' H12' ' O ' ' C' ' 170' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ' DT' . . . . . 0.416 H2'' ' OP2' ' A' ' 3' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.531 0.34 0 O5'-C5'-C4' 112.434 1.596 . . . . 88.629999999999995 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ' DG' . . . . . 0.432 " C2'" ' H72' ' A' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.421 -1.161 0 C5'-C4'-C3' 110.548 -2.768 . . . . 95.0 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ' DT' . . . . . 0.432 ' H72' " C2'" ' A' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.411 -1.826 0 O4'-C1'-N19 106.421 -1.723 . . . . 67.609999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.401 ' O2 ' ' HA2' ' C' ' 139' ' ' GLY . . . . . . . . 0 O5'--C5' 1.415 -1.548 0 P-O5'-C5' 118.524 -1.485 . . . . 49.93 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.414 -1.299 0 C5'-C4'-O4' 112.667 2.042 . . . . 61.509999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.562 0 P-O5'-C5' 118.112 -1.742 . . . . 56.950000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ' DT' . . . . . 0.548 ' OP2' ' NH2' ' C' ' 178' ' ' ARG . . . . . . . . 0 O5'--C5' 1.409 -1.918 0 O3'-P-O5' 100.48 -1.853 . . . . 50.729999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.644 ' N7 ' ' NH1' ' C' ' 178' ' ' ARG . . . . . . . . 0 O3'--C3' 1.408 -1.768 0 C3'-C2'-C1' 100.18 -1.8 . . . . 44.700000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.581 -2.176 0 C5'-C4'-O4' 112.747 2.092 . . . . 49.840000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.565 0 C5'-C4'-O4' 113.733 2.708 . . . . 53.390000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.636 0 O3'-P-O5' 101.496 -1.318 . . . . 62.909999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.414 -1.284 0 C5'-C4'-O4' 111.625 1.391 . . . . 71.579999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.587 -1.65 0 C3'-C2'-C1' 99.913 -1.99 . . . . 75.950000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.417 -1.416 0 O4'-C1'-N19 109.607 2.258 . . . . 80.859999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ' DA' . . . . . 0.77 H2'' " O5'" ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.534 1.635 3 C5'-C4'-C3' 125.903 7.469 . . . . 68.019999999999996 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.77 " O5'" H2'' ' B' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.401 -2.418 0 N19-C1'-C2' 108.169 -3.769 . . . . 64.5 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' CBR . . . . . 0.517 H2'' " H5'" ' B' ' 19' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.383 -3.692 0 C4'-C3'-O3' 116.422 2.783 . . . . 73.769999999999996 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ' DT' . . . . . 0.517 " H5'" H2'' ' B' ' 18' ' ' CBR . . . . . . . . 3 C4'--C3' 1.428 -9.968 3 P-O3'-C3' 141.148 17.873 . . . . 53.590000000000003 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ' DT' . . . . . 0.462 H2'' ' C8 ' ' B' ' 21' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.416 -1.181 0 C4'-C3'-C2' 105.197 1.997 . . . . 44.020000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ' DA' . . . . . 0.462 ' C8 ' H2'' ' B' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.421 -1.186 0 O3'-P-O5' 101.269 -1.437 . . . . 53.990000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.556 0 C4'-C3'-O3' 107.396 -1.32 . . . . 59.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.418 -1.398 0 C3'-C2'-C1' 99.259 -2.458 . . . . 46.229999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C5'-C4'-C3' 116.608 1.272 . . . . 44.890000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.704 0 C3'-C2'-C1' 99.486 -2.295 . . . . 55.039999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.536 0 C5'-C4'-O4' 111.764 1.478 . . . . 52.700000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ' DA' . . . . . 0.545 H2'' " H5'" ' B' ' 28' ' ' ' DA' . . . . . . . . 0 P--O3' 1.587 -1.649 0 N19-C1'-C2' 116.908 1.693 . . . . 56.619999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.545 " H5'" H2'' ' B' ' 27' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.413 -1.676 0 C5'-C4'-O4' 103.32 -3.8 . . . . 64.400000000000006 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.127 0 O4'-C1'-N19 108.816 1.27 . . . . 53.700000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 139' ' ' GLY . . . . . 0.401 ' HA2' ' O2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 N--CA 1.498 2.784 0 N-CA-C 112.09 -0.404 . . . . 58.899999999999999 112.09 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 140' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -92.41 135.6 26.5 Favored Pre-proline 0 N--CA 1.45 -0.456 0 C-N-CA 119.453 -0.899 . . . . 61.890000000000001 111.442 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 141' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.36 152.01 83.36 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 120.675 0.916 . . . . 52.600000000000001 114.093 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 142' ' ' ARG . . . . . . . . . . . . . 72.1 mtt-85 -70.22 158.07 36.51 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.546 -0.752 . . . . 52.920000000000002 109.176 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 143' ' ' ALA . . . . . . . . . . . . . . . -75.34 -37.74 60.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.22 -0.446 . . . . 55.32 110.601 -179.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 144' ' ' ILE . . . . . 0.514 HD11 ' CE2' ' C' ' 179' ' ' TYR . 0.2 OUTLIER -128.01 136.85 59.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.761 -0.654 . . . . 50.68 112.305 -179.49 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 145' ' ' ASN . . . . . 0.609 ' OD1' ' HG3' ' C' ' 148' ' ' GLU . 13.3 p30 -78.38 173.07 12.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.831 -0.803 . . . . 59.030000000000001 108.831 178.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 146' ' ' LYS . . . . . . . . . . . . . . . -59.62 -30.48 68.73 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 112.681 0.623 . . . . 54.75 112.681 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . . . -63.38 -57.51 10.09 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 107.826 -1.175 . . . . 57.670000000000002 107.826 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 148' ' ' GLU . . . . . 0.609 ' HG3' ' OD1' ' C' ' 145' ' ' ASN . 51.9 mt-10 -55.82 -32.33 63.48 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.077 -0.965 . . . . 58.43 111.468 -179.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 149' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -65.2 -43.61 91.0 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.67 -0.812 . . . . 60.68 112.279 179.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 150' ' ' GLU . . . . . . . . . . . . . . . -64.33 -43.41 94.69 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 109.259 -0.645 . . . . 58.460000000000001 109.259 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 151' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -64.07 -58.48 6.53 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.236 -0.893 . . . . 50.009999999999998 110.366 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 152' ' ' ILE . . . . . . . . . . . . . 49.1 mt -53.12 -44.53 51.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 119.841 -0.744 . . . . 51.170000000000002 109.177 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 153' ' ' SER . . . . . . . . . . . . . 35.2 t -51.77 -43.62 63.06 Favored 'General case' 0 C--O 1.248 0.98 0 N-CA-C 109.421 -0.585 . . . . 59.880000000000003 109.421 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 154' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -64.81 -56.38 13.83 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.908 -1.042 . . . . 60.490000000000002 109.768 -179.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 155' ' ' LEU . . . . . . . . . . . . . 94.5 mt -48.89 -45.0 40.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.937 -0.574 . . . . 48.829999999999998 110.154 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 156' ' ' LEU . . . . . . . . . . . . . 25.1 mt -60.8 -40.08 91.33 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.851 0.686 . . . . 51.369999999999997 112.851 -179.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -70.94 -28.97 64.88 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.122 -0.696 . . . . 95.0 109.122 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 158' ' ' LYS . . . . . . . . . . . . . . . -77.45 -2.58 36.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 120.02 -0.672 . . . . 61.07 110.51 178.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 159' ' ' GLY . . . . . . . . . . . . . . . 99.79 13.71 36.6 Favored Glycine 0 C--N 1.333 0.383 0 N-CA-C 119.265 2.466 . . . . 56.469999999999999 119.265 178.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 160' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -76.88 128.11 82.28 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 118.096 0.948 . . . . 66.230000000000004 113.087 178.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 161' ' ' PRO . . . . . 0.462 ' HG2' ' CB ' ' C' ' 164' ' ' GLN . 84.0 Cg_endo -60.01 123.52 13.37 Favored 'Trans proline' 0 C--O 1.239 0.562 1 C-N-CA 125.375 4.05 . . . . 55.700000000000003 112.895 -180.0 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 162' ' ' ARG . . . . . . . . . . . . . 40.4 mtt85 -51.15 -31.69 20.64 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 112.934 0.716 . . . . 57.609999999999999 112.934 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 163' ' ' GLN . . . . . 0.433 ' O ' HG13 ' C' ' 167' ' ' ILE . 38.1 mt-30 -65.25 -43.8 90.18 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 119.171 -1.012 . . . . 82.469999999999999 109.346 179.284 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 164' ' ' GLN . . . . . 0.462 ' CB ' ' HG2' ' C' ' 161' ' ' PRO . . . -62.26 -47.5 84.1 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 119.986 -0.686 . . . . 69.709999999999994 110.845 179.29 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 165' ' ' LEU . . . . . . . . . . . . . 18.3 mt -61.94 -37.59 85.29 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 120.303 -0.559 . . . . 50.810000000000002 110.909 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 166' ' ' ALA . . . . . . . . . . . . . . . -57.62 -60.99 2.84 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 108.281 -1.007 . . . . 48.420000000000002 108.281 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 167' ' ' ILE . . . . . 0.433 HG13 ' O ' ' C' ' 163' ' ' GLN . 66.4 mt -48.32 -53.3 6.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 113.555 0.946 . . . . 55.340000000000003 113.555 -179.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 168' ' ' ILE . . . . . . . . . . . . . 65.4 mt -59.33 -52.18 63.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.768 -0.651 . . . . 57.259999999999998 111.855 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 169' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -75.89 -3.9 37.87 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 118.573 -1.251 . . . . 52.719999999999999 113.252 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 170' ' ' GLY . . . . . 0.604 ' O ' ' H12' ' C' ' 203' ' ' TRS . . . 61.32 53.77 41.68 Favored Glycine 0 C--O 1.221 -0.676 0 O-C-N 123.934 0.771 . . . . 59.780000000000001 112.252 179.406 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 171' ' ' ILE . . . . . . . . . . . . . 46.6 pt -144.37 178.78 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 107.174 -1.417 . . . . 49.630000000000003 107.174 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 172' ' ' GLY . . . . . . . . . . . . . . . -95.2 144.67 17.34 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 118.796 2.278 . . . . 41.039999999999999 118.796 -177.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 173' ' ' VAL . . . . . . . . . . . . . 69.5 t -53.25 -41.23 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 114.909 -0.646 . . . . 30.890000000000001 110.924 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 174' ' ' SER . . . . . . . . . . . . . 89.4 p -60.34 -34.51 73.93 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 119.146 -1.021 . . . . 37.130000000000003 112.28 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 175' ' ' THR . . . . . . . . . . . . . 40.9 m -63.85 -44.54 92.84 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.3 -0.63 . . . . 41.310000000000002 109.3 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 176' ' ' LEU . . . . . . . . . . . . . 74.6 mt -61.13 -49.24 78.07 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.125 -0.63 . . . . 40.950000000000003 109.839 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 177' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -57.3 -25.91 60.04 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 119.417 -0.913 . . . . 39.009999999999998 110.73 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 178' ' ' ARG . . . . . 0.644 ' NH1' ' N7 ' ' A' ' 9' ' ' ' DG' . 18.9 ttm180 -78.97 -47.31 16.55 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 119.81 -0.756 . . . . 47.280000000000001 110.146 179.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 179' ' ' TYR . . . . . 0.514 ' CE2' HD11 ' C' ' 144' ' ' ILE . 35.2 m-85 -66.28 -37.79 86.26 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 120.26 -0.576 . . . . 43.149999999999999 110.536 177.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 180' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -133.82 88.43 32.85 Favored Pre-proline 0 C--O 1.218 -0.561 0 N-CA-C 113.107 0.78 . . . . 48.350000000000001 113.107 -179.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 181' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.61 144.55 74.34 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 123.21 2.607 . . . . 47.329999999999998 109.571 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 182' ' ' ALA . . . . . 0.41 ' O ' ' N ' ' C' ' 184' ' ' SER . . . -55.64 -46.93 77.36 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 104.105 -2.554 . . . . 49.229999999999997 104.105 179.177 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 183' ' ' SER . . . . . . . . . . . . . 5.8 p -67.11 61.65 0.05 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.708 -1.133 . . . . 59.609999999999999 109.9 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 184' ' ' SER . . . . . 0.41 ' N ' ' O ' ' C' ' 182' ' ' ALA . 1.5 p -176.91 12.53 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.948 0.722 . . . . 67.370000000000005 112.948 179.407 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 185' ' ' ILE . . . . . . . . . . . . . 46.6 mm . . . . . 0 C--O 1.254 1.303 0 CA-C-O 117.038 -1.458 . . . . 76.439999999999998 112.142 -179.012 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' TRS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' TRS . . . . . 0.604 ' H12' ' O ' ' C' ' 170' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_