data_1jj8_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 1jj8 _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 O5'--C5' 1.399 -2.561 0 O5'-C5'-C4' 105.7 -3.214 . . . . 42.48 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.405 -2.182 0 N19-C1'-C2' 107.912 -3.93 . . . . 49.04 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' 5IU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.439 ' N3 ' ' N1 ' ' B' ' 27' ' ' ' DA' . . . . . . . . 1 P--O3' 1.809 16.857 2 O3'-P-O5' 91.334 -6.666 . . . . 44.83 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.408 -1.984 0 N19-C1'-C2' 117.455 2.034 . . . . 46.51 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ' DT' . . . . . 0.446 ' O4 ' ' N6 ' ' B' ' 25' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.412 -1.732 0 O4'-C1'-N19 109.964 2.705 . . . . 40.99 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.406 -2.12 0 O3'-P-O5' 99.586 -2.323 . . . . 40.33 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.418 -1.371 0 N19-C1'-C2' 116.543 1.464 . . . . 36.8 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O3'-P-O5' 101.577 -1.275 . . . . 47.33 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.416 -1.489 0 C5'-C4'-O4' 111.884 1.553 . . . . 54.89 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 O3'-P-O5' 99.324 -2.461 . . . . 66.8 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.021 0 N19-C1'-C2' 115.777 0.986 . . . . 81.5 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--OP1 1.495 0.599 0 N19-C1'-C2' 116.3 1.312 . . . . 94.47 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.85 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.514 -0.496 0 C3'-C2'-C1' 100.8 -1.357 . . . . 66.75 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.204 0 N19-C1'-C2' 110.448 -2.345 . . . . 68.97 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.9 0 C4'-C3'-O3' 107.192 -1.413 . . . . 54.5 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.404 -2.22 0 C5'-C4'-O4' 104.136 -3.29 . . . . 47.81 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.565 0 O4'-C4'-C3' 106.812 1.212 . . . . 48.11 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.42 -1.221 0 C5'-C4'-O4' 111.268 1.168 . . . . 56.09 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.417 -1.417 0 C5'-C4'-O4' 112.471 1.919 . . . . 60.5 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.976 0 C3'-C2'-C1' 100.331 -1.692 . . . . 61.92 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.208 0 C4'-C3'-O3' 107.969 -1.06 . . . . 59.3 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ' DA' . . . . . 0.446 ' N6 ' ' O4 ' ' A' ' 7' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.318 0 C3'-C2'-C1' 98.443 -3.04 . . . . 62.36 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.538 0 C5'-C4'-O4' 112.322 1.826 . . . . 59.49 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ' DA' . . . . . 0.439 ' N1 ' ' N3 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.412 -1.761 0 C5'-C4'-O4' 112.3 1.812 . . . . 47.89 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.395 -1.888 0 O4'-C1'-N19 110.164 2.955 . . . . 45.22 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.123 0 C2'-C3'-O3' 106.096 -1.668 . . . . 50.42 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 139' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.966 0 N-CA-C 117.13 1.612 . . . . 46.5 117.13 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 140' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -62.41 156.87 59.35 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 112.764 0.653 . . . . 42.48 112.764 179.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 141' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -89.62 142.92 4.26 Favored 'Trans proline' 0 C--O 1.24 0.583 0 N-CA-C 115.732 1.397 . . . . 41.19 115.732 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 142' ' ' ARG . . . . . . . . . . . . . 41.5 mtt-85 -55.6 144.91 24.9 Favored 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 107.368 -1.345 . . . . 50.16 107.368 178.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 143' ' ' ALA . . . . . . . . . . . . . . . -83.79 -4.57 58.76 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 113.044 0.757 . . . . 46.35 113.044 -178.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 144' ' ' ILE . . . . . . . . . . . . . 6.3 pt -153.58 126.32 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 115.872 1.804 . . . . 53.49 115.872 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 145' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -72.86 179.02 3.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.556 -1.202 . . . . 64.45 109.65 178.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 146' ' ' LYS . . . . . . . . . . . . . . . -59.81 -50.64 73.02 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.89 0.7 . . . . 67.66 112.89 -179.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 147' ' ' HIS . . . . . 0.492 ' CE1' ' OE1' ' C' ' 151' ' ' GLN . 26.5 t-80 -51.5 -45.93 63.02 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 112.662 0.616 . . . . 73.07 112.662 -179.185 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 148' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -64.4 -42.57 96.03 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.56 0.537 . . . . 69.72 111.39 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 149' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -54.62 -65.85 0.51 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 115.517 1.673 . . . . 61.89 115.517 -178.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 150' ' ' GLU . . . . . . . . . . . . . . . -58.45 -27.7 64.61 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.945 0.402 . . . . 63.46 110.234 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 151' ' ' GLN . . . . . 0.492 ' OE1' ' CE1' ' C' ' 147' ' ' HIS . 36.1 tt0 -68.79 -51.56 39.69 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.178 -1.045 . . . . 61.88 108.178 179.242 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 152' ' ' ILE . . . . . . . . . . . . . 34.9 mt -64.79 -37.9 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.766 0 N-CA-C 107.236 -1.394 . . . . 50.48 107.236 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 153' ' ' SER . . . . . . . . . . . . . 30.4 t -54.66 -46.68 74.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.058 -0.974 . . . . 48.28 111.031 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 154' ' ' ARG . . . . . . . . . . . . . . . -69.4 -36.33 76.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.767 -0.651 . . . . 56.71 111.178 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 155' ' ' LEU . . . . . . . . . . . . . 94.1 mt -64.37 -45.23 88.63 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.028 -0.73 . . . . 46.63 109.028 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 156' ' ' LEU . . . . . . . . . . . . . 13.3 mt -59.55 -21.64 60.55 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.243 -0.583 . . . . 46.54 112.541 -179.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -103.47 63.58 0.8 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 106.656 -1.609 . . . . 61.28 106.656 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 158' ' ' LYS . . . . . . . . . . . . . . . -169.06 -1.92 0.02 OUTLIER 'General case' 0 C--O 1.245 0.862 0 N-CA-C 101.248 -3.612 . . . . 54.53 101.248 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 159' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.92 61.57 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 113.834 -1.53 . . . . 51.94 114.646 178.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 160' ' ' HIS . . . . . 0.547 ' CD2' ' OE1' ' C' ' 164' ' ' GLN . 6.9 m80 -68.73 121.06 79.79 Favored Pre-proline 0 CA--C 1.51 -0.588 0 N-CA-C 108.457 -0.942 . . . . 44.76 108.457 179.774 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -58.07 135.23 67.25 Favored 'Trans proline' 0 CA--C 1.515 -0.456 0 C-N-CA 122.856 2.371 . . . . 38.95 111.525 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 162' ' ' ARG . . . . . 0.435 ' NH1' ' O ' ' C' ' 180' ' ' PHE . 26.0 mtt85 -60.06 -30.62 69.32 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 119.836 -0.746 . . . . 40.23 110.227 179.684 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 163' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -60.31 -35.15 74.93 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.667 -0.413 . . . . 54.84 110.683 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 164' ' ' GLN . . . . . 0.547 ' OE1' ' CD2' ' C' ' 160' ' ' HIS . 39.0 tt0 -71.56 -48.53 47.93 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 113.428 0.899 . . . . 44.34 113.428 179.627 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 165' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.17 -15.55 63.43 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.844 1.424 . . . . 38.53 114.844 -179.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 166' ' ' ALA . . . . . . . . . . . . . . . -75.02 -43.26 54.74 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 105.289 -2.115 . . . . 38.06 105.289 178.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 167' ' ' ILE . . . . . . . . . . . . . 3.3 mt -65.86 -53.94 32.79 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.032 0 CA-C-N 115.025 -0.989 . . . . 38.51 111.082 -179.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 168' ' ' ILE . . . . . . . . . . . . . 28.8 mt -55.25 -42.72 67.67 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 N-CA-C 112.939 0.718 . . . . 36.21 112.939 179.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 169' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -97.18 -6.26 35.2 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 114.383 1.253 . . . . 40.89 114.383 -177.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 170' ' ' GLY . . . . . . . . . . . . . . . 68.7 54.25 16.12 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 119.304 -1.426 . . . . 29.92 115.067 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 171' ' ' ILE . . . . . 0.455 ' CD1' ' CD2' ' C' ' 176' ' ' LEU . 11.1 pt -146.28 148.92 16.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 117.684 0.742 . . . . 29.77 109.94 178.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 172' ' ' GLY . . . . . . . . . . . . . . . -60.4 143.9 47.61 Favored Glycine 0 C--O 1.203 -1.823 0 C-N-CA 120.05 -1.071 . . . . 31.79 115.037 -178.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 173' ' ' VAL . . . . . . . . . . . . . 73.4 t -58.32 -47.72 86.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 117.92 0.86 . . . . 31.52 109.791 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 174' ' ' SER . . . . . . . . . . . . . 19.8 p -54.47 -34.64 61.91 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 119.902 -0.719 . . . . 28.27 111.246 -176.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 175' ' ' THR . . . . . . . . . . . . . 98.5 m -64.08 -26.95 68.78 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.489 1.116 . . . . 28.51 111.039 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 176' ' ' LEU . . . . . 0.455 ' CD2' ' CD1' ' C' ' 171' ' ' ILE . 15.3 mt -76.72 -34.2 58.13 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-O 120.923 0.392 . . . . 35.5 110.192 179.441 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 177' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -72.03 -31.05 65.81 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 119.398 -0.921 . . . . 34.23 110.942 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 10.8 ttp85 -71.62 -51.06 25.2 Favored 'General case' 0 C--O 1.212 -0.885 0 C-N-CA 120.461 -0.496 . . . . 37.44 110.862 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 179' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -64.71 -46.08 83.85 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.38 -0.528 . . . . 35.76 110.321 178.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 180' ' ' PHE . . . . . 0.435 ' O ' ' NH1' ' C' ' 162' ' ' ARG . 23.6 m-85 -123.07 72.82 46.42 Favored Pre-proline 0 C--O 1.238 0.456 0 N-CA-C 115.523 1.675 . . . . 37.44 115.523 -177.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 181' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -48.27 149.38 6.41 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.633 2.222 . . . . 41.59 110.301 -179.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 182' ' ' ALA . . . . . . . . . . . . . . . -66.23 -24.35 66.58 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.622 -0.51 . . . . 46.57 109.622 -179.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 183' ' ' SER . . . . . . . . . . . . . 53.5 p -72.02 -23.15 61.35 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.255 -0.884 . . . . 49.67 111.971 -179.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 184' ' ' SER . . . . . . . . . . . . . 54.3 p -102.38 14.52 31.74 Favored 'General case' 0 CA--C 1.508 -0.668 0 C-N-CA 120.543 -0.463 . . . . 48.62 111.766 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 185' ' ' ILE . . . . . 0.522 ' C ' ' N ' ' C' ' 187' ' ' LYS . 0.5 OUTLIER -117.98 -34.29 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 C-N-CA 121.079 -0.248 . . . . 58.69 111.116 179.465 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 186' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -53.33 -5.15 0.05 OUTLIER 'General case' 0 C--O 1.247 0.951 0 CA-C-O 121.911 0.862 . . . . 66.87 108.841 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 187' ' ' LYS . . . . . 0.522 ' N ' ' C ' ' C' ' 185' ' ' ILE . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-N 114.452 -1.249 . . . . 62.97 110.028 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ' DT' . . . . . 0.646 H2'' H5'' ' A' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.399 -2.561 0 O5'-C5'-C4' 105.7 -3.214 . . . . 42.479999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ' DG' . . . . . 0.701 " H2'" ' I5 ' ' A' ' 4' ' ' 5IU . . . . . . . . 0 O5'--C5' 1.405 -2.182 0 N19-C1'-C2' 107.912 -3.93 . . . . 49.039999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' 5IU . . . . . 0.701 ' I5 ' " H2'" ' A' ' 3' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ' DT' . . . . . 0.596 ' O2 ' ' HA2' ' C' ' 139' ' ' GLY . . . . . . . . 1 P--O3' 1.809 16.857 2 O3'-P-O5' 91.334 -6.666 . . . . 44.829999999999998 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.408 -1.984 0 N19-C1'-C2' 117.455 2.034 . . . . 46.509999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.412 -1.732 0 O4'-C1'-N19 109.964 2.705 . . . . 40.990000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.406 -2.12 0 O3'-P-O5' 99.586 -2.323 . . . . 40.329999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.418 -1.371 0 N19-C1'-C2' 116.543 1.464 . . . . 36.799999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O3'-P-O5' 101.577 -1.275 . . . . 47.329999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.416 -1.489 0 C5'-C4'-O4' 111.884 1.553 . . . . 54.890000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 O3'-P-O5' 99.324 -2.461 . . . . 66.799999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.021 0 N19-C1'-C2' 115.777 0.986 . . . . 81.5 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--OP1 1.495 0.599 0 N19-C1'-C2' 116.3 1.312 . . . . 94.469999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.849999999999994 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ' DA' . . . . . 0.593 H2'' " O5'" ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.514 -0.496 0 C3'-C2'-C1' 100.8 -1.357 . . . . 66.75 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ' DT' . . . . . 0.593 " O5'" H2'' ' B' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.421 -1.204 0 N19-C1'-C2' 110.448 -2.345 . . . . 68.969999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ' DC' . . . . . 0.668 H2'' " H5'" ' B' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.41 -1.9 0 C4'-C3'-O3' 107.192 -1.413 . . . . 54.5 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ' DT' . . . . . 0.668 " H5'" H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.404 -2.22 0 C5'-C4'-O4' 104.136 -3.29 . . . . 47.810000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.565 0 O4'-C4'-C3' 106.812 1.212 . . . . 48.109999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.42 -1.221 0 C5'-C4'-O4' 111.268 1.168 . . . . 56.090000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.417 -1.417 0 C5'-C4'-O4' 112.471 1.919 . . . . 60.5 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.976 0 C3'-C2'-C1' 100.331 -1.692 . . . . 61.920000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.208 0 C4'-C3'-O3' 107.969 -1.06 . . . . 59.299999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.318 0 C3'-C2'-C1' 98.443 -3.04 . . . . 62.359999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.538 0 C5'-C4'-O4' 112.322 1.826 . . . . 59.490000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.412 -1.761 0 C5'-C4'-O4' 112.3 1.812 . . . . 47.890000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ' DA' . . . . . 0.848 " H5'" ' HD3' ' C' ' 141' ' ' PRO . . . . . . . . 0 O4'--C1' 1.395 -1.888 0 O4'-C1'-N19 110.164 2.955 . . . . 45.219999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ' DC' . . . . . 0.534 ' OP2' H2'' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.422 -1.123 0 C2'-C3'-O3' 106.096 -1.668 . . . . 50.420000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 139' ' ' GLY . . . . . 0.596 ' HA2' ' O2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 N--CA 1.5 2.966 0 N-CA-C 117.13 1.612 . . . . 46.5 117.13 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 140' ' ' ARG . . . . . 0.514 ' HG3' ' HD2' ' C' ' 141' ' ' PRO . 64.5 ttt180 -62.41 156.87 59.35 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 112.764 0.653 . . . . 42.479999999999997 112.764 179.093 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 141' ' ' PRO . . . . . 0.848 ' HD3' " H5'" ' B' ' 28' ' ' ' DA' . 66.9 Cg_endo -89.62 142.92 4.26 Favored 'Trans proline' 0 C--O 1.24 0.583 0 N-CA-C 115.732 1.397 . . . . 41.189999999999998 115.732 179.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 142' ' ' ARG . . . . . . . . . . . . . 41.5 mtt-85 -55.6 144.91 24.9 Favored 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 107.368 -1.345 . . . . 50.159999999999997 107.368 178.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 143' ' ' ALA . . . . . 0.412 ' O ' HG23 ' C' ' 144' ' ' ILE . . . -83.79 -4.57 58.76 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 113.044 0.757 . . . . 46.350000000000001 113.044 -178.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 144' ' ' ILE . . . . . 0.412 HG23 ' O ' ' C' ' 143' ' ' ALA . 6.3 pt -153.58 126.32 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 115.872 1.804 . . . . 53.490000000000002 115.872 -179.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 145' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -72.86 179.02 3.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.556 -1.202 . . . . 64.450000000000003 109.65 178.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 146' ' ' LYS . . . . . . . . . . . . . . . -59.81 -50.64 73.02 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.89 0.7 . . . . 67.659999999999997 112.89 -179.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -51.5 -45.93 63.02 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 112.662 0.616 . . . . 73.069999999999993 112.662 -179.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 148' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -64.4 -42.57 96.03 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.56 0.537 . . . . 69.719999999999999 111.39 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 149' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -54.62 -65.85 0.51 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 115.517 1.673 . . . . 61.890000000000001 115.517 -178.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 150' ' ' GLU . . . . . 0.414 ' HA ' ' HB3' ' C' ' 153' ' ' SER . . . -58.45 -27.7 64.61 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.945 0.402 . . . . 63.460000000000001 110.234 -179.445 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 151' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -68.79 -51.56 39.69 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.178 -1.045 . . . . 61.880000000000003 108.178 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 152' ' ' ILE . . . . . . . . . . . . . 34.9 mt -64.79 -37.9 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.766 0 N-CA-C 107.236 -1.394 . . . . 50.479999999999997 107.236 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 153' ' ' SER . . . . . 0.654 ' O ' ' HG3' ' C' ' 157' ' ' GLU . 30.4 t -54.66 -46.68 74.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.058 -0.974 . . . . 48.280000000000001 111.031 179.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 154' ' ' ARG . . . . . . . . . . . . . . . -69.4 -36.33 76.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.767 -0.651 . . . . 56.710000000000001 111.178 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 155' ' ' LEU . . . . . 0.501 HD13 HD21 ' C' ' 165' ' ' LEU . 94.1 mt -64.37 -45.23 88.63 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.028 -0.73 . . . . 46.630000000000003 109.028 178.515 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 156' ' ' LEU . . . . . 0.69 HD21 ' HG2' ' C' ' 162' ' ' ARG . 13.3 mt -59.55 -21.64 60.55 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.243 -0.583 . . . . 46.539999999999999 112.541 -179.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 157' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' C' ' 153' ' ' SER . 2.4 mt-10 -103.47 63.58 0.8 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 106.656 -1.609 . . . . 61.280000000000001 106.656 178.946 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 158' ' ' LYS . . . . . . . . . . . . . . . -169.06 -1.92 0.02 OUTLIER 'General case' 0 C--O 1.245 0.862 0 N-CA-C 101.248 -3.612 . . . . 54.530000000000001 101.248 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 159' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.92 61.57 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 113.834 -1.53 . . . . 51.939999999999998 114.646 178.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 160' ' ' HIS . . . . . . . . . . . . . 23.4 m-70 -68.73 121.06 79.79 Favored Pre-proline 0 CA--C 1.51 -0.588 0 N-CA-C 108.457 -0.942 . . . . 44.759999999999998 108.457 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -58.07 135.23 67.25 Favored 'Trans proline' 0 CA--C 1.515 -0.456 0 C-N-CA 122.856 2.371 . . . . 38.950000000000003 111.525 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 162' ' ' ARG . . . . . 0.69 ' HG2' HD21 ' C' ' 156' ' ' LEU . 26.0 mtt85 -60.06 -30.62 69.32 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 119.836 -0.746 . . . . 40.229999999999997 110.227 179.684 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 163' ' ' GLN . . . . . 0.536 ' O ' HG13 ' C' ' 167' ' ' ILE . 9.0 tp-100 -60.31 -35.15 74.93 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.667 -0.413 . . . . 54.840000000000003 110.683 179.669 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 164' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -71.56 -48.53 47.93 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 113.428 0.899 . . . . 44.340000000000003 113.428 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 165' ' ' LEU . . . . . 0.501 HD21 HD13 ' C' ' 155' ' ' LEU . 95.4 mt -69.17 -15.55 63.43 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.844 1.424 . . . . 38.530000000000001 114.844 -179.447 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 166' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' C' ' 171' ' ' ILE . . . -75.02 -43.26 54.74 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 105.289 -2.115 . . . . 38.060000000000002 105.289 178.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 167' ' ' ILE . . . . . 0.536 HG13 ' O ' ' C' ' 163' ' ' GLN . 3.3 mt -65.86 -53.94 32.79 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.032 0 CA-C-N 115.025 -0.989 . . . . 38.509999999999998 111.082 -179.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 168' ' ' ILE . . . . . . . . . . . . . 28.8 mt -55.25 -42.72 67.67 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 N-CA-C 112.939 0.718 . . . . 36.210000000000001 112.939 179.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 169' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -97.18 -6.26 35.2 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 114.383 1.253 . . . . 40.890000000000001 114.383 -177.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 170' ' ' GLY . . . . . . . . . . . . . . . 68.7 54.25 16.12 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 119.304 -1.426 . . . . 29.920000000000002 115.067 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 171' ' ' ILE . . . . . 1.162 HD11 HD21 ' C' ' 176' ' ' LEU . 11.1 pt -146.28 148.92 16.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 117.684 0.742 . . . . 29.77 109.94 178.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 172' ' ' GLY . . . . . . . . . . . . . . . -60.4 143.9 47.61 Favored Glycine 0 C--O 1.203 -1.823 0 C-N-CA 120.05 -1.071 . . . . 31.789999999999999 115.037 -178.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 173' ' ' VAL . . . . . 0.526 HG23 ' O ' ' C' ' 203' ' ' HOH . 73.4 t -58.32 -47.72 86.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 117.92 0.86 . . . . 31.52 109.791 178.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 174' ' ' SER . . . . . . . . . . . . . 19.8 p -54.47 -34.64 61.91 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 119.902 -0.719 . . . . 28.27 111.246 -176.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 175' ' ' THR . . . . . . . . . . . . . 98.5 m -64.08 -26.95 68.78 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.489 1.116 . . . . 28.510000000000002 111.039 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 176' ' ' LEU . . . . . 1.162 HD21 HD11 ' C' ' 171' ' ' ILE . 15.3 mt -76.72 -34.2 58.13 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-O 120.923 0.392 . . . . 35.5 110.192 179.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 177' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -72.03 -31.05 65.81 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 119.398 -0.921 . . . . 34.229999999999997 110.942 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 10.8 ttp85 -71.62 -51.06 25.2 Favored 'General case' 0 C--O 1.212 -0.885 0 C-N-CA 120.461 -0.496 . . . . 37.439999999999998 110.862 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 179' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -64.71 -46.08 83.85 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.38 -0.528 . . . . 35.759999999999998 110.321 178.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 180' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -123.07 72.82 46.42 Favored Pre-proline 0 C--O 1.238 0.456 0 N-CA-C 115.523 1.675 . . . . 37.439999999999998 115.523 -177.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 181' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -48.27 149.38 6.41 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.633 2.222 . . . . 41.590000000000003 110.301 -179.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 182' ' ' ALA . . . . . 0.572 ' O ' ' HG3' ' C' ' 186' ' ' LYS . . . -66.23 -24.35 66.58 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.622 -0.51 . . . . 46.57 109.622 -179.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 183' ' ' SER . . . . . . . . . . . . . 53.5 p -72.02 -23.15 61.35 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.255 -0.884 . . . . 49.670000000000002 111.971 -179.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 184' ' ' SER . . . . . . . . . . . . . 54.3 p -102.38 14.52 31.74 Favored 'General case' 0 CA--C 1.508 -0.668 0 C-N-CA 120.543 -0.463 . . . . 48.619999999999997 111.766 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 185' ' ' ILE . . . . . 0.593 ' C ' ' H ' ' C' ' 187' ' ' LYS . 0.5 OUTLIER -117.98 -34.29 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 C-N-CA 121.079 -0.248 . . . . 58.689999999999998 111.116 179.465 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 186' ' ' LYS . . . . . 0.572 ' HG3' ' O ' ' C' ' 182' ' ' ALA . 88.1 mttt -53.33 -5.15 0.05 OUTLIER 'General case' 0 C--O 1.247 0.951 0 CA-C-O 121.911 0.862 . . . . 66.870000000000005 108.841 178.561 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 187' ' ' LYS . . . . . 0.593 ' H ' ' C ' ' C' ' 185' ' ' ILE . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-N 114.452 -1.249 . . . . 62.969999999999999 110.028 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' HOH . . . . . 0.526 ' O ' HG23 ' C' ' 173' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ' DT' . . . . . 0.646 H2'' H5'' ' A' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.399 -2.561 0 O5'-C5'-C4' 105.7 -3.214 . . . . 42.479999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ' DG' . . . . . 0.701 " H2'" ' I5 ' ' A' ' 4' ' ' 5IU . . . . . . . . 0 O5'--C5' 1.405 -2.182 0 N19-C1'-C2' 107.912 -3.93 . . . . 49.039999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' 5IU . . . . . 0.701 ' I5 ' " H2'" ' A' ' 3' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.596 ' O2 ' ' HA2' ' C' ' 139' ' ' GLY . . . . . . . . 1 P--O3' 1.809 16.857 2 O3'-P-O5' 91.334 -6.666 . . . . 44.829999999999998 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.408 -1.984 0 N19-C1'-C2' 117.455 2.034 . . . . 46.509999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.412 -1.732 0 O4'-C1'-N19 109.964 2.705 . . . . 40.990000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.406 -2.12 0 O3'-P-O5' 99.586 -2.323 . . . . 40.329999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.418 -1.371 0 N19-C1'-C2' 116.543 1.464 . . . . 36.799999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O3'-P-O5' 101.577 -1.275 . . . . 47.329999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.416 -1.489 0 C5'-C4'-O4' 111.884 1.553 . . . . 54.890000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 O3'-P-O5' 99.324 -2.461 . . . . 66.799999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.021 0 N19-C1'-C2' 115.777 0.986 . . . . 81.5 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--OP1 1.495 0.599 0 N19-C1'-C2' 116.3 1.312 . . . . 94.469999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.849999999999994 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ' DA' . . . . . 0.593 H2'' " O5'" ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.514 -0.496 0 C3'-C2'-C1' 100.8 -1.357 . . . . 66.75 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.593 " O5'" H2'' ' B' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.421 -1.204 0 N19-C1'-C2' 110.448 -2.345 . . . . 68.969999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.668 H2'' " H5'" ' B' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.41 -1.9 0 C4'-C3'-O3' 107.192 -1.413 . . . . 54.5 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ' DT' . . . . . 0.668 " H5'" H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.404 -2.22 0 C5'-C4'-O4' 104.136 -3.29 . . . . 47.810000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.565 0 O4'-C4'-C3' 106.812 1.212 . . . . 48.109999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.42 -1.221 0 C5'-C4'-O4' 111.268 1.168 . . . . 56.090000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.417 -1.417 0 C5'-C4'-O4' 112.471 1.919 . . . . 60.5 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.976 0 C3'-C2'-C1' 100.331 -1.692 . . . . 61.920000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.208 0 C4'-C3'-O3' 107.969 -1.06 . . . . 59.299999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.318 0 C3'-C2'-C1' 98.443 -3.04 . . . . 62.359999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.538 0 C5'-C4'-O4' 112.322 1.826 . . . . 59.490000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.412 -1.761 0 C5'-C4'-O4' 112.3 1.812 . . . . 47.890000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.848 " H5'" ' HD3' ' C' ' 141' ' ' PRO . . . . . . . . 0 O4'--C1' 1.395 -1.888 0 O4'-C1'-N19 110.164 2.955 . . . . 45.219999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.534 ' OP2' H2'' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.422 -1.123 0 C2'-C3'-O3' 106.096 -1.668 . . . . 50.420000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 139' ' ' GLY . . . . . 0.596 ' HA2' ' O2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 N--CA 1.5 2.966 0 N-CA-C 117.13 1.612 . . . . 46.5 117.13 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 140' ' ' ARG . . . . . 0.514 ' HG3' ' HD2' ' C' ' 141' ' ' PRO . 64.5 ttt180 -62.41 156.87 59.35 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 112.764 0.653 . . . . 42.479999999999997 112.764 179.093 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 141' ' ' PRO . . . . . 0.848 ' HD3' " H5'" ' B' ' 28' ' ' ' DA' . 66.9 Cg_endo -89.62 142.92 4.26 Favored 'Trans proline' 0 C--O 1.24 0.583 0 N-CA-C 115.732 1.397 . . . . 41.189999999999998 115.732 179.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 142' ' ' ARG . . . . . . . . . . . . . 41.5 mtt-85 -55.6 144.91 24.9 Favored 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 107.368 -1.345 . . . . 50.159999999999997 107.368 178.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 143' ' ' ALA . . . . . 0.412 ' O ' HG23 ' C' ' 144' ' ' ILE . . . -83.79 -4.57 58.76 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 113.044 0.757 . . . . 46.350000000000001 113.044 -178.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 144' ' ' ILE . . . . . 0.412 HG23 ' O ' ' C' ' 143' ' ' ALA . 6.3 pt -153.58 126.32 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 115.872 1.804 . . . . 53.490000000000002 115.872 -179.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 145' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -72.86 179.02 3.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.556 -1.202 . . . . 64.450000000000003 109.65 178.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 146' ' ' LYS . . . . . . . . . . . . . . . -59.81 -50.64 73.02 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.89 0.7 . . . . 67.659999999999997 112.89 -179.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 147' ' ' HIS . . . . . 0.492 ' CE1' ' OE1' ' C' ' 151' ' ' GLN . 26.5 t-80 -51.5 -45.93 63.02 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 112.662 0.616 . . . . 73.069999999999993 112.662 -179.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 148' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -64.4 -42.57 96.03 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.56 0.537 . . . . 69.719999999999999 111.39 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 149' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -54.62 -65.85 0.51 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 115.517 1.673 . . . . 61.890000000000001 115.517 -178.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 150' ' ' GLU . . . . . 0.414 ' HA ' ' HB3' ' C' ' 153' ' ' SER . . . -58.45 -27.7 64.61 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.945 0.402 . . . . 63.460000000000001 110.234 -179.445 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 151' ' ' GLN . . . . . 0.492 ' OE1' ' CE1' ' C' ' 147' ' ' HIS . 36.1 tt0 -68.79 -51.56 39.69 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.178 -1.045 . . . . 61.880000000000003 108.178 179.242 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 152' ' ' ILE . . . . . . . . . . . . . 34.9 mt -64.79 -37.9 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.766 0 N-CA-C 107.236 -1.394 . . . . 50.479999999999997 107.236 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 153' ' ' SER . . . . . 0.654 ' O ' ' HG3' ' C' ' 157' ' ' GLU . 30.4 t -54.66 -46.68 74.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.058 -0.974 . . . . 48.280000000000001 111.031 179.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 154' ' ' ARG . . . . . . . . . . . . . . . -69.4 -36.33 76.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.767 -0.651 . . . . 56.710000000000001 111.178 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 155' ' ' LEU . . . . . 0.501 HD13 HD21 ' C' ' 165' ' ' LEU . 94.1 mt -64.37 -45.23 88.63 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.028 -0.73 . . . . 46.630000000000003 109.028 178.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 156' ' ' LEU . . . . . 0.69 HD21 ' HG2' ' C' ' 162' ' ' ARG . 13.3 mt -59.55 -21.64 60.55 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.243 -0.583 . . . . 46.539999999999999 112.541 -179.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 157' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' C' ' 153' ' ' SER . 2.4 mt-10 -103.47 63.58 0.8 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 106.656 -1.609 . . . . 61.280000000000001 106.656 178.946 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 158' ' ' LYS . . . . . . . . . . . . . . . -169.06 -1.92 0.02 OUTLIER 'General case' 0 C--O 1.245 0.862 0 N-CA-C 101.248 -3.612 . . . . 54.530000000000001 101.248 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 159' ' ' GLY . . . . . . . . . . . . . . . 88.16 14.92 61.57 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 113.834 -1.53 . . . . 51.939999999999998 114.646 178.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 160' ' ' HIS . . . . . 0.555 ' HD2' ' OE1' ' C' ' 164' ' ' GLN . 6.9 m80 -68.73 121.06 79.79 Favored Pre-proline 0 CA--C 1.51 -0.588 0 N-CA-C 108.457 -0.942 . . . . 44.759999999999998 108.457 179.774 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -58.07 135.23 67.25 Favored 'Trans proline' 0 CA--C 1.515 -0.456 0 C-N-CA 122.856 2.371 . . . . 38.950000000000003 111.525 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 162' ' ' ARG . . . . . 0.69 ' HG2' HD21 ' C' ' 156' ' ' LEU . 26.0 mtt85 -60.06 -30.62 69.32 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 119.836 -0.746 . . . . 40.229999999999997 110.227 179.684 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 163' ' ' GLN . . . . . 0.536 ' O ' HG13 ' C' ' 167' ' ' ILE . 53.1 tp60 -60.31 -35.15 74.93 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.667 -0.413 . . . . 54.840000000000003 110.683 179.669 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 164' ' ' GLN . . . . . 0.555 ' OE1' ' HD2' ' C' ' 160' ' ' HIS . 39.0 tt0 -71.56 -48.53 47.93 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 113.428 0.899 . . . . 44.340000000000003 113.428 179.627 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 165' ' ' LEU . . . . . 0.501 HD21 HD13 ' C' ' 155' ' ' LEU . 95.4 mt -69.17 -15.55 63.43 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.844 1.424 . . . . 38.530000000000001 114.844 -179.447 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 166' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' C' ' 171' ' ' ILE . . . -75.02 -43.26 54.74 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 105.289 -2.115 . . . . 38.060000000000002 105.289 178.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 167' ' ' ILE . . . . . 0.536 HG13 ' O ' ' C' ' 163' ' ' GLN . 3.3 mt -65.86 -53.94 32.79 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.032 0 CA-C-N 115.025 -0.989 . . . . 38.509999999999998 111.082 -179.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 168' ' ' ILE . . . . . . . . . . . . . 28.8 mt -55.25 -42.72 67.67 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 N-CA-C 112.939 0.718 . . . . 36.210000000000001 112.939 179.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 169' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -97.18 -6.26 35.2 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 114.383 1.253 . . . . 40.890000000000001 114.383 -177.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 170' ' ' GLY . . . . . . . . . . . . . . . 68.7 54.25 16.12 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 119.304 -1.426 . . . . 29.920000000000002 115.067 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 171' ' ' ILE . . . . . 1.162 HD11 HD21 ' C' ' 176' ' ' LEU . 11.1 pt -146.28 148.92 16.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 117.684 0.742 . . . . 29.77 109.94 178.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 172' ' ' GLY . . . . . . . . . . . . . . . -60.4 143.9 47.61 Favored Glycine 0 C--O 1.203 -1.823 0 C-N-CA 120.05 -1.071 . . . . 31.789999999999999 115.037 -178.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 173' ' ' VAL . . . . . 0.526 HG23 ' O ' ' C' ' 203' ' ' HOH . 73.4 t -58.32 -47.72 86.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 117.92 0.86 . . . . 31.52 109.791 178.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 174' ' ' SER . . . . . . . . . . . . . 19.8 p -54.47 -34.64 61.91 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 119.902 -0.719 . . . . 28.27 111.246 -176.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 175' ' ' THR . . . . . . . . . . . . . 98.5 m -64.08 -26.95 68.78 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.489 1.116 . . . . 28.510000000000002 111.039 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 176' ' ' LEU . . . . . 1.162 HD21 HD11 ' C' ' 171' ' ' ILE . 15.3 mt -76.72 -34.2 58.13 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-O 120.923 0.392 . . . . 35.5 110.192 179.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 177' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -72.03 -31.05 65.81 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 119.398 -0.921 . . . . 34.229999999999997 110.942 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . . 10.8 ttp85 -71.62 -51.06 25.2 Favored 'General case' 0 C--O 1.212 -0.885 0 C-N-CA 120.461 -0.496 . . . . 37.439999999999998 110.862 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 179' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -64.71 -46.08 83.85 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.38 -0.528 . . . . 35.759999999999998 110.321 178.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 180' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -123.07 72.82 46.42 Favored Pre-proline 0 C--O 1.238 0.456 0 N-CA-C 115.523 1.675 . . . . 37.439999999999998 115.523 -177.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 181' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -48.27 149.38 6.41 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.633 2.222 . . . . 41.590000000000003 110.301 -179.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 182' ' ' ALA . . . . . 0.572 ' O ' ' HG3' ' C' ' 186' ' ' LYS . . . -66.23 -24.35 66.58 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.622 -0.51 . . . . 46.57 109.622 -179.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 183' ' ' SER . . . . . . . . . . . . . 53.5 p -72.02 -23.15 61.35 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.255 -0.884 . . . . 49.670000000000002 111.971 -179.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 184' ' ' SER . . . . . . . . . . . . . 54.3 p -102.38 14.52 31.74 Favored 'General case' 0 CA--C 1.508 -0.668 0 C-N-CA 120.543 -0.463 . . . . 48.619999999999997 111.766 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 185' ' ' ILE . . . . . 0.593 ' C ' ' H ' ' C' ' 187' ' ' LYS . 0.5 OUTLIER -117.98 -34.29 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 C-N-CA 121.079 -0.248 . . . . 58.689999999999998 111.116 179.465 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 186' ' ' LYS . . . . . 0.572 ' HG3' ' O ' ' C' ' 182' ' ' ALA . 88.1 mttt -53.33 -5.15 0.05 OUTLIER 'General case' 0 C--O 1.247 0.951 0 CA-C-O 121.911 0.862 . . . . 66.870000000000005 108.841 178.561 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 187' ' ' LYS . . . . . 0.593 ' H ' ' C ' ' C' ' 185' ' ' ILE . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-N 114.452 -1.249 . . . . 62.969999999999999 110.028 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' HOH . . . . . 0.526 ' O ' HG23 ' C' ' 173' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_