data_6jhe_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6jhe _Structure_validation_residue.Date_analyzed 2019-12-27 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 ' 134' ' ' ILE . . . . . . . . . . . . . 30.1 mm . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 108.602 -0.888 . . . . 131.68 108.602 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 62.9 tp -147.06 135.19 21.54 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 118.303 -1.359 . . . . 136.28 112.95 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -109.23 113.86 27.07 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.793 -1.094 . . . . 135.66 108.792 178.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 11.7 mt -118.53 -155.18 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 C-N-CA 125.452 1.501 . . . . 137.44 108.955 -173.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -53.66 149.98 30.11 Favored 'Trans proline' 0 C--O 1.24 0.585 0 CA-C-N 120.348 1.16 . . . . 129.86 113.081 164.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ASP . . . . . 0.495 ' O ' ' OG1' ' A' ' 143' ' ' THR . 4.2 t0 -66.37 -25.69 66.91 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 114.698 -1.137 . . . . 133.08 112.342 179.061 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -72.47 -52.69 14.7 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 120.635 -0.426 . . . . 122.26 110.641 -178.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -50.14 -54.47 20.5 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 111.777 0.288 . . . . 103.64 111.777 177.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ARG . . . . . 0.428 ' CZ ' ' CB ' ' A' ' 142' ' ' ARG . 2.5 mtm-85 -72.93 -33.61 66.05 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 121.78 -0.575 . . . . 127.46 112.468 -163.678 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' THR . . . . . 0.495 ' OG1' ' O ' ' A' ' 139' ' ' ASP . 1.4 m -50.33 -54.4 21.83 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.356 -0.938 . . . . 116.94 110.993 -179.964 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 20.4 m -69.28 -32.84 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 112.88 0.696 . . . . 102.85 112.88 -172.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 4.9 tt -66.83 -43.01 89.94 Favored 'Isoleucine or valine' 0 C--O 1.242 0.684 0 C-N-CA 118.701 -1.2 . . . . 110.45 110.262 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 62.1 t -57.43 -43.32 82.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 CA-C-O 121.328 0.585 . . . . 104.33 111.318 172.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 23.0 mt -65.14 -52.92 52.27 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 122.045 -0.409 . . . . 104.23 111.681 -177.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 12.1 tttm -77.46 -42.09 37.21 Favored 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 119.087 -1.045 . . . . 115.92 112.302 -172.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -76.07 -42.89 46.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 117.428 -1.709 . . . . 115.38 111.023 -171.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 28.7 mt -73.25 -64.06 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.552 0 O-C-N 121.911 -0.493 . . . . 124.87 111.251 -169.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -84.92 21.18 1.65 Allowed 'General case' 0 C--N 1.346 0.439 0 N-CA-C 112.669 0.618 . . . . 140.7 112.669 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 44.7 42.63 6.03 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 118.23 0.468 . . . . 124.62 110.689 -177.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.25 122.82 19.13 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.177 -0.609 . . . . 110.02 109.765 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' SER . . . . . 0.458 ' OG ' ' N ' ' A' ' 155' ' ' LEU . 6.9 t -58.6 174.04 0.35 Allowed 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 122.112 0.958 . . . . 106.07 110.807 174.051 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' LEU . . . . . 0.458 ' N ' ' OG ' ' A' ' 154' ' ' SER . 83.3 mt -78.86 -43.67 24.54 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 114.855 -1.066 . . . . 94.37 110.352 176.236 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 76.1 mt -64.3 -33.1 60.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 117.838 -1.545 . . . . 100.88 110.723 173.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.31 -58.4 7.86 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.852 -0.425 . . . . 125.38 109.852 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 21.0 mt -49.22 -41.62 14.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 CA-C-O 121.03 0.443 . . . . 118.15 111.214 176.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' GLY . . . . . 0.66 ' O ' ' N ' ' A' ' 163' ' ' ASN . . . -64.46 -77.33 0.24 Allowed Glycine 0 N--CA 1.449 -0.477 0 O-C-N 122.097 -0.377 . . . . 117.53 113.51 176.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -47.56 -33.18 6.17 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.841 0.856 . . . . 124.89 113.156 -175.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 36.4 mt -77.84 -51.33 18.17 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 C-N-CA 120.049 -0.66 . . . . 121.44 110.455 176.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 14.9 tp -71.77 -5.7 36.0 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 113.297 0.851 . . . . 118.01 113.297 170.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' ASN . . . . . 0.66 ' N ' ' O ' ' A' ' 159' ' ' GLY . 76.0 m-20 57.39 56.96 4.69 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 121.812 0.815 . . . . 140.44 109.597 176.145 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tp -146.82 148.15 32.1 Favored Pre-proline 0 C--O 1.24 0.575 0 CA-C-N 114.505 -1.225 . . . . 116.59 108.445 -177.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -61.35 147.69 94.88 Favored 'Trans proline' 0 N--CA 1.48 0.716 0 N-CA-C 114.978 1.107 . . . . 100.36 114.978 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.5 -40.75 89.17 Favored 'Isoleucine or valine' 0 C--N 1.345 0.405 0 C-N-CA 119.83 -0.748 . . . . 100.69 111.497 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -52.35 -40.86 54.08 Favored Glycine 0 C--O 1.239 0.46 0 C-N-CA 118.814 -1.66 . . . . 88.94 111.798 175.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 50.2 m -61.92 -40.12 94.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.404 -0.518 . . . . 108.39 111.117 175.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 40.5 t -58.97 -39.97 79.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 119.047 -1.061 . . . . 78.85 109.929 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' LYS . . . . . 0.45 ' NZ ' ' O6 ' ' C' ' 6' ' ' ' DG' . 86.3 mttt -62.42 -42.06 99.16 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 119.855 -0.738 . . . . 85.64 111.151 178.883 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' THR . . . . . . . . . . . . . 1.6 p -73.21 -39.63 65.37 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 117.977 -1.489 . . . . 94.99 111.49 -176.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -59.96 -38.83 83.62 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.344 -0.542 . . . . 106.29 111.064 173.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ILE . . . . . . . . . . . . . 26.8 mt -71.74 -39.55 68.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 C-N-CA 118.147 -1.421 . . . . 85.0 110.339 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -62.53 -40.43 96.77 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 117.619 -1.632 . . . . 107.25 109.671 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -81.47 -31.06 33.13 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 119.577 -0.849 . . . . 101.08 110.536 -172.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' GLY . . . . . . . . . . . . . . . -57.89 -39.03 91.03 Favored Glycine 0 C--N 1.343 0.936 0 C-N-CA 119.817 -1.183 . . . . 91.87 111.318 169.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 33.4 mmm-85 -67.56 -55.11 14.73 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.295 -0.962 . . . . 104.73 110.931 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -62.72 -30.13 71.19 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 119.034 -1.066 . . . . 117.67 110.783 -173.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -72.05 -36.36 69.57 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 120.372 -0.531 . . . . 106.55 111.337 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 3.9 mt -60.81 -52.1 66.5 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 118.104 -1.438 . . . . 114.29 111.255 170.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' ARG . . . . . 0.468 ' O ' ' NH1' ' A' ' 185' ' ' ARG . 33.0 mtp180 -43.35 -62.28 1.11 Allowed 'General case' 0 C--N 1.344 0.367 0 N-CA-C 112.402 0.519 . . . . 126.95 112.402 174.932 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -55.28 -46.83 76.16 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 119.265 -0.974 . . . . 119.55 111.73 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -99.6 28.17 4.84 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 118.878 -1.129 . . . . 141.67 112.062 -175.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 mt -92.37 10.28 30.56 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.717 1.006 . . . . 110.53 113.717 157.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' ARG . . . . . 0.468 ' NH1' ' O ' ' A' ' 181' ' ' ARG . 0.6 OUTLIER -119.07 54.02 0.99 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 118.873 0.761 . . . . 118.87 112.085 -175.31 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.468 0.458 0 C-N-CA 124.177 0.991 . . . . 140.6 113.23 -172.495 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.548 4.629 0 C4'-C3'-C2' 100.756 -2.444 . . . . 136.32 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.535 1.664 0 P-O3'-C3' 123.151 2.876 . . . . 136.35 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ' DG' . . . . . 0.754 ' N2 ' ' O2 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.403 -2.297 0 C4'-C3'-C2' 99.927 -3.273 . . . . 130.64 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ' DA' . . . . . 0.427 ' N1 ' ' N3 ' ' C' ' 9' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.386 -3.371 0 C3'-C2'-C1' 98.394 -3.076 . . . . 121.0 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.539 2.142 0 C4'-C3'-C2' 104.988 1.788 . . . . 124.06 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.406 -1.893 0 O4'-C1'-C2' 107.731 1.482 . . . . 116.87 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.408 -1.802 0 C3'-C2'-C1' 99.777 -2.088 . . . . 127.88 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.404 -2.273 0 P-O5'-C5' 117.731 -1.981 . . . . 112.81 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 O5'--C5' 1.373 -4.178 0 C3'-C2'-C1' 99.523 -2.269 . . . . 89.41 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.388 -3.3 0 N19-C1'-C2' 117.525 2.078 . . . . 90.23 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.622 2.946 0 O4'-C1'-N19 109.711 2.388 . . . . 87.51 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.551 5.006 0 O5'-C5'-C4' 112.863 1.902 . . . . 85.6 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.408 -1.753 0 C3'-C2'-C1' 99.078 -2.587 . . . . 90.06 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.384 -3.515 0 O4'-C1'-N19 105.669 -2.664 . . . . 92.65 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.383 -3.551 1 O4'-C1'-N19 104.387 -4.266 . . . . 82.77 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' ' DG' . . . . . 0.45 ' O6 ' ' NZ ' ' A' ' 170' ' ' LYS . . . . . . . . 1 O5'--C5' 1.355 -5.327 1 P-O3'-C3' 125.512 4.844 . . . . 84.11 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.404 -2.236 0 P-O3'-C3' 116.566 -2.611 . . . . 96.82 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.394 -2.854 0 P-O3'-C3' 123.128 2.857 . . . . 111.41 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' ' DT' . . . . . 0.427 ' N3 ' ' N1 ' ' B' ' 5' ' ' ' DA' . . . . . . . . 1 O3'--C3' 1.373 -4.473 0 P-O3'-C3' 123.331 3.026 . . . . 121.04 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ' DC' . . . . . 0.754 ' O2 ' ' N2 ' ' B' ' 4' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.54 2.2 0 O4'-C1'-C2' 107.832 1.574 . . . . 147.61 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.334 0 P-O3'-C3' 121.801 1.751 . . . . 154.05 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.817 0 O4'-C1'-C2' 107.964 1.694 . . . . 168.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 30.1 mm . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 108.602 -0.888 . . . . 131.68 108.602 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LEU . . . . . 0.718 HD21 ' HB2' ' A' ' 183' ' ' GLN . 62.9 tp -147.06 135.19 21.54 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 118.303 -1.359 . . . . 136.28 112.95 -175.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LYS . . . . . 0.53 ' HA ' ' HD3' ' A' ' 142' ' ' ARG . 28.8 mtmt -109.23 113.86 27.07 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.793 -1.094 . . . . 135.66 108.792 178.141 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . 0.709 ' HB3' ' HD2' ' A' ' 138' ' ' PRO . 11.7 mt -118.53 -155.18 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 C-N-CA 125.452 1.501 . . . . 137.44 108.955 -173.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' PRO . . . . . 0.709 ' HD2' ' HB3' ' A' ' 137' ' ' LEU . 73.2 Cg_exo -53.66 149.98 30.11 Favored 'Trans proline' 0 C--O 1.24 0.585 0 CA-C-N 120.348 1.16 . . . . 129.86 113.081 164.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ASP . . . . . 0.852 ' HA ' HH12 ' A' ' 142' ' ' ARG . 4.2 t0 -66.37 -25.69 66.91 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 114.698 -1.137 . . . . 133.08 112.342 179.061 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -72.47 -52.69 14.7 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 120.635 -0.426 . . . . 122.26 110.641 -178.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -50.14 -54.47 20.5 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 111.777 0.288 . . . . 103.64 111.777 177.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ARG . . . . . 0.852 HH12 ' HA ' ' A' ' 139' ' ' ASP . 2.5 mtm-85 -72.93 -33.61 66.05 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 121.78 -0.575 . . . . 127.46 112.468 -163.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' THR . . . . . 0.727 ' O ' ' HG ' ' A' ' 147' ' ' LEU . 1.4 m -50.33 -54.4 21.83 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.356 -0.938 . . . . 116.94 110.993 -179.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' VAL . . . . . 0.49 ' HA ' HD12 ' A' ' 147' ' ' LEU . 20.4 m -69.28 -32.84 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 112.88 0.696 . . . . 102.85 112.88 -172.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 4.9 tt -66.83 -43.01 89.94 Favored 'Isoleucine or valine' 0 C--O 1.242 0.684 0 C-N-CA 118.701 -1.2 . . . . 110.45 110.262 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' VAL . . . . . 0.539 HG13 HD12 ' A' ' 150' ' ' ILE . 62.1 t -57.43 -43.32 82.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 CA-C-O 121.328 0.585 . . . . 104.33 111.318 172.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 143' ' ' THR . 23.0 mt -65.14 -52.92 52.27 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 122.045 -0.409 . . . . 104.23 111.681 -177.364 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' LYS . . . . . 0.404 ' HB2' HD11 ' A' ' 158' ' ' ILE . 12.1 tttm -77.46 -42.09 37.21 Favored 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 119.087 -1.045 . . . . 115.92 112.302 -172.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -76.07 -42.89 46.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 117.428 -1.709 . . . . 115.38 111.023 -171.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ILE . . . . . 0.539 HD12 HG13 ' A' ' 146' ' ' VAL . 28.7 mt -73.25 -64.06 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.552 0 O-C-N 121.911 -0.493 . . . . 124.87 111.251 -169.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -84.92 21.18 1.65 Allowed 'General case' 0 C--N 1.346 0.439 0 N-CA-C 112.669 0.618 . . . . 140.7 112.669 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 44.7 42.63 6.03 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 118.23 0.468 . . . . 124.62 110.689 -177.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' LEU . . . . . 0.727 HD12 ' HB3' ' A' ' 147' ' ' LEU . 6.9 mt -68.25 122.82 19.13 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.177 -0.609 . . . . 110.02 109.765 179.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' SER . . . . . 0.458 ' OG ' ' N ' ' A' ' 155' ' ' LEU . 6.9 t -58.6 174.04 0.35 Allowed 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 122.112 0.958 . . . . 106.07 110.807 174.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' LEU . . . . . 0.458 ' N ' ' OG ' ' A' ' 154' ' ' SER . 83.3 mt -78.86 -43.67 24.54 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 114.855 -1.066 . . . . 94.37 110.352 176.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 76.1 mt -64.3 -33.1 60.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 117.838 -1.545 . . . . 100.88 110.723 173.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLU . . . . . 0.429 ' HB3' HD22 ' A' ' 153' ' ' LEU . 36.5 mt-10 -62.31 -58.4 7.86 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.852 -0.425 . . . . 125.38 109.852 175.842 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 158' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 154' ' ' SER . 21.0 mt -49.22 -41.62 14.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 CA-C-O 121.03 0.443 . . . . 118.15 111.214 176.684 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 159' ' ' GLY . . . . . 0.66 ' O ' ' N ' ' A' ' 163' ' ' ASN . . . -64.46 -77.33 0.24 Allowed Glycine 0 N--CA 1.449 -0.477 0 O-C-N 122.097 -0.377 . . . . 117.53 113.51 176.43 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -47.56 -33.18 6.17 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.841 0.856 . . . . 124.89 113.156 -175.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 36.4 mt -77.84 -51.33 18.17 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 C-N-CA 120.049 -0.66 . . . . 121.44 110.455 176.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 14.9 tp -71.77 -5.7 36.0 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 113.297 0.851 . . . . 118.01 113.297 170.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' ASN . . . . . 0.66 ' N ' ' O ' ' A' ' 159' ' ' GLY . 76.0 m-20 57.39 56.96 4.69 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 121.812 0.815 . . . . 140.44 109.597 176.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tp -146.82 148.15 32.1 Favored Pre-proline 0 C--O 1.24 0.575 0 CA-C-N 114.505 -1.225 . . . . 116.59 108.445 -177.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -61.35 147.69 94.88 Favored 'Trans proline' 0 N--CA 1.48 0.716 0 N-CA-C 114.978 1.107 . . . . 100.36 114.978 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.5 -40.75 89.17 Favored 'Isoleucine or valine' 0 C--N 1.345 0.405 0 C-N-CA 119.83 -0.748 . . . . 100.69 111.497 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -52.35 -40.86 54.08 Favored Glycine 0 C--O 1.239 0.46 0 C-N-CA 118.814 -1.66 . . . . 88.94 111.798 175.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 50.2 m -61.92 -40.12 94.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.404 -0.518 . . . . 108.39 111.117 175.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 40.5 t -58.97 -39.97 79.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 119.047 -1.061 . . . . 78.85 109.929 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' LYS . . . . . 0.529 ' HD3' ' N7 ' ' C' ' 6' ' ' ' DG' . 86.3 mttt -62.42 -42.06 99.16 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 119.855 -0.738 . . . . 85.64 111.151 178.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 171' ' ' THR . . . . . 0.612 HG21 ' H62' ' B' ' 5' ' ' ' DA' . 1.6 p -73.21 -39.63 65.37 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 117.977 -1.489 . . . . 94.99 111.49 -176.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 172' ' ' ARG . . . . . 0.406 HH21 ' P ' ' B' ' 4' ' ' ' DG' . 23.1 mmt85 -59.96 -38.83 83.62 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.344 -0.542 . . . . 106.29 111.064 173.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ILE . . . . . . . . . . . . . 26.8 mt -71.74 -39.55 68.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 C-N-CA 118.147 -1.421 . . . . 85.0 110.339 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -62.53 -40.43 96.77 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 117.619 -1.632 . . . . 107.25 109.671 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ARG . . . . . 0.476 ' HG2' ' OE2' ' A' ' 178' ' ' GLU . 72.0 mtt180 -81.47 -31.06 33.13 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 119.577 -0.849 . . . . 101.08 110.536 -172.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 176' ' ' GLY . . . . . . . . . . . . . . . -57.89 -39.03 91.03 Favored Glycine 0 C--N 1.343 0.936 0 C-N-CA 119.817 -1.183 . . . . 91.87 111.318 169.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 33.4 mmm-85 -67.56 -55.11 14.73 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.295 -0.962 . . . . 104.73 110.931 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' GLU . . . . . 0.476 ' OE2' ' HG2' ' A' ' 175' ' ' ARG . 18.2 pt-20 -62.72 -30.13 71.19 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 119.034 -1.066 . . . . 117.67 110.783 -173.828 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -72.05 -36.36 69.57 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 120.372 -0.531 . . . . 106.55 111.337 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' LEU . . . . . 0.572 ' HA ' HD23 ' A' ' 135' ' ' LEU . 3.9 mt -60.81 -52.1 66.5 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 118.104 -1.438 . . . . 114.29 111.255 170.599 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 181' ' ' ARG . . . . . 0.468 ' O ' ' NH1' ' A' ' 185' ' ' ARG . 33.0 mtp180 -43.35 -62.28 1.11 Allowed 'General case' 0 C--N 1.344 0.367 0 N-CA-C 112.402 0.519 . . . . 126.95 112.402 174.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -55.28 -46.83 76.16 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 119.265 -0.974 . . . . 119.55 111.73 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' GLN . . . . . 0.718 ' HB2' HD21 ' A' ' 135' ' ' LEU . 3.3 mm-40 -99.6 28.17 4.84 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 118.878 -1.129 . . . . 141.67 112.062 -175.326 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 mt -92.37 10.28 30.56 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.717 1.006 . . . . 110.53 113.717 157.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' ARG . . . . . 0.468 ' NH1' ' O ' ' A' ' 181' ' ' ARG . 0.6 OUTLIER -119.07 54.02 0.99 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 118.873 0.761 . . . . 118.87 112.085 -175.31 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 186' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.468 0.458 0 C-N-CA 124.177 0.991 . . . . 140.6 113.23 -172.495 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ' DT' . . . . . 0.592 " H4'" ' OP1' ' B' ' 3' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.548 4.629 0 C4'-C3'-C2' 100.756 -2.444 . . . . 136.32 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ' DT' . . . . . 0.592 ' OP1' " H4'" ' B' ' 2' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.535 1.664 0 P-O3'-C3' 123.151 2.876 . . . . 136.35 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ' DG' . . . . . 0.6 ' N2 ' ' O2 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.403 -2.297 0 C4'-C3'-C2' 99.927 -3.273 . . . . 130.64 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ' DA' . . . . . 0.612 ' H62' HG21 ' A' ' 171' ' ' THR . . . . . . . . 0 O5'--C5' 1.386 -3.371 0 C3'-C2'-C1' 98.394 -3.076 . . . . 121.0 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ' DA' . . . . . 0.479 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.539 2.142 0 C4'-C3'-C2' 104.988 1.788 . . . . 124.06 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ' DA' . . . . . 0.479 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.406 -1.893 0 O4'-C1'-C2' 107.731 1.482 . . . . 116.87 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.408 -1.802 0 C3'-C2'-C1' 99.777 -2.088 . . . . 127.88 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ' DC' . . . . . 0.721 " H2'" ' H71' ' B' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.404 -2.273 0 P-O5'-C5' 117.731 -1.981 . . . . 112.81 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ' DT' . . . . . 0.721 ' H71' " H2'" ' B' ' 9' ' ' ' DC' . . . . . . . . 1 O5'--C5' 1.373 -4.178 0 C3'-C2'-C1' 99.523 -2.269 . . . . 89.41 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.388 -3.3 0 N19-C1'-C2' 117.525 2.078 . . . . 90.23 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.622 2.946 0 O4'-C1'-N19 109.711 2.388 . . . . 87.51 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.551 5.006 0 O5'-C5'-C4' 112.863 1.902 . . . . 85.6 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.408 -1.753 0 C3'-C2'-C1' 99.078 -2.587 . . . . 90.06 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.384 -3.515 0 O4'-C1'-N19 105.669 -2.664 . . . . 92.65 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ' DG' . . . . . 0.684 H2'' H5'' ' C' ' 6' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.383 -3.551 1 O4'-C1'-N19 104.387 -4.266 . . . . 82.77 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 6' ' ' ' DG' . . . . . 0.684 H5'' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 1 O5'--C5' 1.355 -5.327 1 P-O3'-C3' 125.512 4.844 . . . . 84.11 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' C' C ' 7' ' ' ' DT' . . . . . 0.403 H2'' ' C6 ' ' C' ' 8' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.404 -2.236 0 P-O3'-C3' 116.566 -2.611 . . . . 96.82 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' ' DT' . . . . . 0.403 ' C6 ' H2'' ' C' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.394 -2.854 0 P-O3'-C3' 123.128 2.857 . . . . 111.41 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 O3'--C3' 1.373 -4.473 0 P-O3'-C3' 123.331 3.026 . . . . 121.04 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ' DC' . . . . . 0.6 ' O2 ' ' N2 ' ' B' ' 4' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.54 2.2 0 O4'-C1'-C2' 107.832 1.574 . . . . 147.61 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.334 0 P-O3'-C3' 121.801 1.751 . . . . 154.05 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.817 0 O4'-C1'-C2' 107.964 1.694 . . . . 168.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 30.1 mm . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 108.602 -0.888 . . . . 131.68 108.602 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.718 HD21 ' HB2' ' A' ' 183' ' ' GLN . 62.9 tp -147.06 135.19 21.54 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 118.303 -1.359 . . . . 136.28 112.95 -175.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.53 ' HA ' ' HD3' ' A' ' 142' ' ' ARG . 28.8 mtmt -109.23 113.86 27.07 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.793 -1.094 . . . . 135.66 108.792 178.141 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.709 ' HB3' ' HD2' ' A' ' 138' ' ' PRO . 11.7 mt -118.53 -155.18 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 C-N-CA 125.452 1.501 . . . . 137.44 108.955 -173.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' PRO . . . . . 0.709 ' HD2' ' HB3' ' A' ' 137' ' ' LEU . 73.2 Cg_exo -53.66 149.98 30.11 Favored 'Trans proline' 0 C--O 1.24 0.585 0 CA-C-N 120.348 1.16 . . . . 129.86 113.081 164.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ASP . . . . . 0.852 ' HA ' HH12 ' A' ' 142' ' ' ARG . 4.2 t0 -66.37 -25.69 66.91 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 114.698 -1.137 . . . . 133.08 112.342 179.061 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -72.47 -52.69 14.7 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 120.635 -0.426 . . . . 122.26 110.641 -178.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -50.14 -54.47 20.5 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 111.777 0.288 . . . . 103.64 111.777 177.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.852 HH12 ' HA ' ' A' ' 139' ' ' ASP . 2.5 mtm-85 -72.93 -33.61 66.05 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 121.78 -0.575 . . . . 127.46 112.468 -163.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' THR . . . . . 0.727 ' O ' ' HG ' ' A' ' 147' ' ' LEU . 1.4 m -50.33 -54.4 21.83 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.356 -0.938 . . . . 116.94 110.993 -179.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.49 ' HA ' HD12 ' A' ' 147' ' ' LEU . 20.4 m -69.28 -32.84 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 112.88 0.696 . . . . 102.85 112.88 -172.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 4.9 tt -66.83 -43.01 89.94 Favored 'Isoleucine or valine' 0 C--O 1.242 0.684 0 C-N-CA 118.701 -1.2 . . . . 110.45 110.262 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' VAL . . . . . 0.539 HG13 HD12 ' A' ' 150' ' ' ILE . 62.1 t -57.43 -43.32 82.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 CA-C-O 121.328 0.585 . . . . 104.33 111.318 172.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 143' ' ' THR . 23.0 mt -65.14 -52.92 52.27 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 122.045 -0.409 . . . . 104.23 111.681 -177.364 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.404 ' HB2' HD11 ' A' ' 158' ' ' ILE . 12.1 tttm -77.46 -42.09 37.21 Favored 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 119.087 -1.045 . . . . 115.92 112.302 -172.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -76.07 -42.89 46.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 117.428 -1.709 . . . . 115.38 111.023 -171.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.539 HD12 HG13 ' A' ' 146' ' ' VAL . 28.7 mt -73.25 -64.06 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.552 0 O-C-N 121.911 -0.493 . . . . 124.87 111.251 -169.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -84.92 21.18 1.65 Allowed 'General case' 0 C--N 1.346 0.439 0 N-CA-C 112.669 0.618 . . . . 140.7 112.669 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 44.7 42.63 6.03 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 118.23 0.468 . . . . 124.62 110.689 -177.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.727 HD12 ' HB3' ' A' ' 147' ' ' LEU . 6.9 mt -68.25 122.82 19.13 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.177 -0.609 . . . . 110.02 109.765 179.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' SER . . . . . 0.458 ' OG ' ' N ' ' A' ' 155' ' ' LEU . 6.9 t -58.6 174.04 0.35 Allowed 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 122.112 0.958 . . . . 106.07 110.807 174.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.458 ' N ' ' OG ' ' A' ' 154' ' ' SER . 83.3 mt -78.86 -43.67 24.54 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 114.855 -1.066 . . . . 94.37 110.352 176.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 76.1 mt -64.3 -33.1 60.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 117.838 -1.545 . . . . 100.88 110.723 173.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.429 ' HB3' HD22 ' A' ' 153' ' ' LEU . 36.5 mt-10 -62.31 -58.4 7.86 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.852 -0.425 . . . . 125.38 109.852 175.842 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 154' ' ' SER . 21.0 mt -49.22 -41.62 14.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 CA-C-O 121.03 0.443 . . . . 118.15 111.214 176.684 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' GLY . . . . . 0.66 ' O ' ' N ' ' A' ' 163' ' ' ASN . . . -64.46 -77.33 0.24 Allowed Glycine 0 N--CA 1.449 -0.477 0 O-C-N 122.097 -0.377 . . . . 117.53 113.51 176.43 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -47.56 -33.18 6.17 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.841 0.856 . . . . 124.89 113.156 -175.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 36.4 mt -77.84 -51.33 18.17 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 C-N-CA 120.049 -0.66 . . . . 121.44 110.455 176.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 14.9 tp -71.77 -5.7 36.0 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 113.297 0.851 . . . . 118.01 113.297 170.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' ASN . . . . . 0.66 ' N ' ' O ' ' A' ' 159' ' ' GLY . 76.0 m-20 57.39 56.96 4.69 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 121.812 0.815 . . . . 140.44 109.597 176.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tp -146.82 148.15 32.1 Favored Pre-proline 0 C--O 1.24 0.575 0 CA-C-N 114.505 -1.225 . . . . 116.59 108.445 -177.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -61.35 147.69 94.88 Favored 'Trans proline' 0 N--CA 1.48 0.716 0 N-CA-C 114.978 1.107 . . . . 100.36 114.978 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.5 -40.75 89.17 Favored 'Isoleucine or valine' 0 C--N 1.345 0.405 0 C-N-CA 119.83 -0.748 . . . . 100.69 111.497 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -52.35 -40.86 54.08 Favored Glycine 0 C--O 1.239 0.46 0 C-N-CA 118.814 -1.66 . . . . 88.94 111.798 175.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 50.2 m -61.92 -40.12 94.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.404 -0.518 . . . . 108.39 111.117 175.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 40.5 t -58.97 -39.97 79.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 119.047 -1.061 . . . . 78.85 109.929 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.529 ' HD3' ' N7 ' ' C' ' 6' ' ' ' DG' . 86.3 mttt -62.42 -42.06 99.16 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 119.855 -0.738 . . . . 85.64 111.151 178.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' THR . . . . . 0.612 HG21 ' H62' ' B' ' 5' ' ' ' DA' . 1.6 p -73.21 -39.63 65.37 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 117.977 -1.489 . . . . 94.99 111.49 -176.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' ARG . . . . . 0.406 HH21 ' P ' ' B' ' 4' ' ' ' DG' . 23.1 mmt85 -59.96 -38.83 83.62 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.344 -0.542 . . . . 106.29 111.064 173.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ILE . . . . . . . . . . . . . 26.8 mt -71.74 -39.55 68.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 C-N-CA 118.147 -1.421 . . . . 85.0 110.339 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -62.53 -40.43 96.77 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 117.619 -1.632 . . . . 107.25 109.671 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ARG . . . . . 0.476 ' HG2' ' OE2' ' A' ' 178' ' ' GLU . 72.0 mtt180 -81.47 -31.06 33.13 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 119.577 -0.849 . . . . 101.08 110.536 -172.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' GLY . . . . . . . . . . . . . . . -57.89 -39.03 91.03 Favored Glycine 0 C--N 1.343 0.936 0 C-N-CA 119.817 -1.183 . . . . 91.87 111.318 169.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 33.4 mmm-85 -67.56 -55.11 14.73 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.295 -0.962 . . . . 104.73 110.931 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' GLU . . . . . 0.476 ' OE2' ' HG2' ' A' ' 175' ' ' ARG . 18.2 pt-20 -62.72 -30.13 71.19 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 119.034 -1.066 . . . . 117.67 110.783 -173.828 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -72.05 -36.36 69.57 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 120.372 -0.531 . . . . 106.55 111.337 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.572 ' HA ' HD23 ' A' ' 135' ' ' LEU . 3.9 mt -60.81 -52.1 66.5 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 118.104 -1.438 . . . . 114.29 111.255 170.599 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.468 ' O ' ' NH1' ' A' ' 185' ' ' ARG . 33.0 mtp180 -43.35 -62.28 1.11 Allowed 'General case' 0 C--N 1.344 0.367 0 N-CA-C 112.402 0.519 . . . . 126.95 112.402 174.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -55.28 -46.83 76.16 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 119.265 -0.974 . . . . 119.55 111.73 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.718 ' HB2' HD21 ' A' ' 135' ' ' LEU . 3.3 mm-40 -99.6 28.17 4.84 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 118.878 -1.129 . . . . 141.67 112.062 -175.326 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 1.3 mt -92.37 10.28 30.56 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.717 1.006 . . . . 110.53 113.717 157.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.468 ' NH1' ' O ' ' A' ' 181' ' ' ARG . 0.6 OUTLIER -119.07 54.02 0.99 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 118.873 0.761 . . . . 118.87 112.085 -175.31 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.468 0.458 0 C-N-CA 124.177 0.991 . . . . 140.6 113.23 -172.495 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ' DT' . . . . . 0.592 " H4'" ' OP1' ' B' ' 3' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.548 4.629 0 C4'-C3'-C2' 100.756 -2.444 . . . . 136.32 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ' DT' . . . . . 0.592 ' OP1' " H4'" ' B' ' 2' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.535 1.664 0 P-O3'-C3' 123.151 2.876 . . . . 136.35 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ' DG' . . . . . 0.6 ' N2 ' ' O2 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.403 -2.297 0 C4'-C3'-C2' 99.927 -3.273 . . . . 130.64 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ' DA' . . . . . 0.612 ' H62' HG21 ' A' ' 171' ' ' THR . . . . . . . . 0 O5'--C5' 1.386 -3.371 0 C3'-C2'-C1' 98.394 -3.076 . . . . 121.0 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.479 H2'' ' C8 ' ' B' ' 7' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.539 2.142 0 C4'-C3'-C2' 104.988 1.788 . . . . 124.06 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ' DA' . . . . . 0.479 ' C8 ' H2'' ' B' ' 6' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.406 -1.893 0 O4'-C1'-C2' 107.731 1.482 . . . . 116.87 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.408 -1.802 0 C3'-C2'-C1' 99.777 -2.088 . . . . 127.88 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.721 " H2'" ' H71' ' B' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.404 -2.273 0 P-O5'-C5' 117.731 -1.981 . . . . 112.81 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ' DT' . . . . . 0.721 ' H71' " H2'" ' B' ' 9' ' ' ' DC' . . . . . . . . 1 O5'--C5' 1.373 -4.178 0 C3'-C2'-C1' 99.523 -2.269 . . . . 89.41 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.388 -3.3 0 N19-C1'-C2' 117.525 2.078 . . . . 90.23 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.622 2.946 0 O4'-C1'-N19 109.711 2.388 . . . . 87.51 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.551 5.006 0 O5'-C5'-C4' 112.863 1.902 . . . . 85.6 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.408 -1.753 0 C3'-C2'-C1' 99.078 -2.587 . . . . 90.06 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.384 -3.515 0 O4'-C1'-N19 105.669 -2.664 . . . . 92.65 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.684 H2'' H5'' ' C' ' 6' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.383 -3.551 1 O4'-C1'-N19 104.387 -4.266 . . . . 82.77 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' ' DG' . . . . . 0.684 H5'' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 1 O5'--C5' 1.355 -5.327 1 P-O3'-C3' 125.512 4.844 . . . . 84.11 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' ' DT' . . . . . 0.403 H2'' ' C6 ' ' C' ' 8' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.404 -2.236 0 P-O3'-C3' 116.566 -2.611 . . . . 96.82 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' ' DT' . . . . . 0.403 ' C6 ' H2'' ' C' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.394 -2.854 0 P-O3'-C3' 123.128 2.857 . . . . 111.41 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 O3'--C3' 1.373 -4.473 0 P-O3'-C3' 123.331 3.026 . . . . 121.04 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.6 ' O2 ' ' N2 ' ' B' ' 4' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.54 2.2 0 O4'-C1'-C2' 107.832 1.574 . . . . 147.61 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.334 0 P-O3'-C3' 121.801 1.751 . . . . 154.05 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.817 0 O4'-C1'-C2' 107.964 1.694 . . . . 168.0 . . . . . . . . . . 0 0 . 1 stop_ save_