data_5ucl_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 5ucl _Structure_validation_residue.Date_analyzed 2017-03-17 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 ' 1' ' ' MET . . . . . . . . . . . . . 10.8 ptt? . . . . . 0 N--CA 1.505 2.283 0 N-CA-C 116.055 1.872 . . . . 94.88 116.055 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLN . . . . . 0.427 ' O ' ' N ' ' A' ' 64' ' ' ASP . . . -86.21 121.21 28.47 Favored 'General case' 0 C--O 1.247 0.973 0 N-CA-C 107.346 -1.353 . . . . 84.05 107.346 173.398 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 pt -106.72 160.44 6.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-O 121.558 0.694 . . . . 68.1 111.687 163.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -118.99 131.43 56.01 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.938 -1.028 . . . . 73.98 108.305 -176.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 18.8 t -115.69 119.37 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 109.955 -0.387 . . . . 54.92 109.955 172.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -89.63 102.81 15.49 Favored 'General case' 0 C--O 1.209 -1.069 0 O-C-N 124.616 1.198 . . . . 69.75 108.078 173.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 74.5 p -93.33 138.08 32.03 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.099 -0.704 . . . . 54.66 109.099 -171.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 89.6 mt . . . . . 0 CA--C 1.555 1.16 0 C-N-CA 123.164 0.586 . . . . 50.07 112.241 -179.839 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.522 3.143 0 N-CA-C 119.978 3.325 . . . . 54.11 119.978 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 30.6 ttp -155.04 135.05 12.97 Favored 'General case' 0 C--O 1.202 -1.403 0 C-N-CA 124.424 1.089 . . . . 70.6 111.197 177.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.86 129.77 53.12 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.344 -0.984 . . . . 87.54 108.344 -173.613 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.6 pt -121.94 153.8 26.22 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.157 0 N-CA-C 108.484 -0.932 . . . . 58.95 108.484 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -108.27 146.96 32.1 Favored 'General case' 0 C--O 1.213 -0.822 0 N-CA-C 105.901 -1.888 . . . . 67.67 105.901 173.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 94.6 mt -131.7 140.11 49.21 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 118.389 0.54 . . . . 70.18 110.981 176.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . . . -92.07 113.45 25.72 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.459 1.104 . . . . 96.81 109.253 175.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.2 m -135.95 168.15 23.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-N 115.566 -0.743 . . . . 86.74 112.005 -170.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . . . -112.91 141.95 26.41 Favored Pre-proline 0 CA--C 1.548 0.884 0 N-CA-C 107.56 -1.274 . . . . 90.0 107.56 165.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -54.74 -24.41 37.69 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 118.957 0.663 . . . . 92.47 112.713 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.0 t -62.86 -15.03 53.01 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 117.011 2.226 . . . . 98.53 117.011 173.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -73.78 139.73 45.39 Favored 'General case' 0 C--O 1.211 -0.96 0 C-N-CA 123.38 0.672 . . . . 91.17 112.608 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.7 p -79.73 163.25 24.64 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 109.391 -0.596 . . . . 85.37 109.391 176.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 14.6 mm -60.85 -41.99 90.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 O-C-N 123.822 0.701 . . . . 65.41 110.657 176.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -56.72 -38.84 72.9 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.162 0.585 . . . . 101.17 111.69 176.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -61.06 -48.37 82.04 Favored 'General case' 0 CA--C 1.492 -1.273 0 O-C-N 124.474 1.109 . . . . 91.58 108.29 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 53.4 t -63.36 -39.59 85.87 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.723 -0.671 . . . . 65.98 111.749 -177.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -66.45 -30.25 70.57 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 120.274 -0.57 . . . . 61.34 110.57 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.3 -38.47 78.3 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.828 1.048 . . . . 75.77 113.828 170.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . . . -62.85 -36.84 84.56 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.193 -0.669 . . . . 71.61 109.193 175.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 88.3 mt -71.67 -39.73 69.59 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.161 0 O-C-N 122.051 -0.406 . . . . 67.29 110.911 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -61.56 -48.37 81.28 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.238 0.542 . . . . 81.74 111.385 175.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -56.4 -48.43 76.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.732 -1.122 . . . . 97.42 108.226 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -75.65 -42.71 50.72 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 115.966 1.839 . . . . 92.0 115.966 -177.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -116.65 -5.05 11.64 Favored 'General case' 0 N--CA 1.506 2.332 0 N-CA-C 119.396 3.11 . . . . 81.45 119.396 -174.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.58 6.71 87.1 Favored Glycine 0 CA--C 1.499 -0.95 0 CA-C-O 118.552 -1.138 . . . . 66.72 113.47 173.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.2 mt -80.79 123.69 82.21 Favored Pre-proline 0 C--O 1.244 0.783 0 CA-C-N 117.981 0.891 . . . . 61.64 109.296 -179.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.44 137.13 63.11 Favored 'Trans proline' 0 C--N 1.355 0.916 0 CA-C-O 118.167 -0.847 . . . . 69.45 112.552 177.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -60.34 -31.51 92.88 Favored 'Trans proline' 0 C--N 1.359 1.13 0 C-N-CA 123.037 2.492 . . . . 69.1 114.216 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.53 -9.58 58.83 Favored 'General case' 0 C--O 1.203 -1.361 0 O-C-N 125.136 1.522 . . . . 88.8 114.645 177.235 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -103.36 4.62 36.54 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 123.547 0.739 . . . . 70.84 112.942 171.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -100.58 130.96 46.71 Favored 'General case' 0 CA--C 1.482 -1.637 0 N-CA-C 107.717 -1.216 . . . . 54.47 107.717 -171.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mtm180 -120.67 108.64 14.26 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 105.196 -2.149 . . . . 80.59 105.196 172.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.8 mt -91.87 140.35 29.76 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 121.667 -0.646 . . . . 53.31 110.09 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.4 mt -135.64 129.89 49.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 O-C-N 125.028 1.455 . . . . 47.78 108.836 -168.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -147.25 139.66 24.66 Favored 'General case' 0 C--O 1.204 -1.3 0 O-C-N 124.386 1.054 . . . . 54.97 109.417 173.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.29 47.11 13.66 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 115.138 1.532 . . . . 55.39 115.138 173.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.66 3.69 88.04 Favored Glycine 0 C--O 1.215 -1.034 0 N-CA-C 115.759 1.064 . . . . 52.27 115.759 172.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 30.6 mtp -128.6 148.28 50.78 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 117.275 0.538 . . . . 61.51 110.301 -173.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -81.12 134.44 35.64 Favored 'General case' 0 CA--C 1.485 -1.531 0 O-C-N 124.682 1.239 . . . . 63.85 108.384 161.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.6 mt -95.29 144.31 25.97 Favored 'General case' 0 C--O 1.211 -0.96 0 C-N-CA 119.304 -0.958 . . . . 55.15 109.528 -168.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -101.02 134.94 43.26 Favored 'General case' 0 CA--C 1.503 -0.849 0 C-N-CA 122.95 0.5 . . . . 83.45 111.724 -171.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -51.74 -36.45 47.23 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 116.62 2.082 . . . . 77.14 116.62 -162.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -99.78 27.74 18.79 Favored Glycine 0 N--CA 1.476 1.335 0 N-CA-C 115.042 0.777 . . . . 77.35 115.042 -174.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.9 153.1 27.2 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 104.692 -2.336 . . . . 78.03 104.692 175.895 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.7 p -97.61 169.12 9.93 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.673 -0.642 . . . . 73.67 111.45 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 87.5 mt -65.46 -36.85 85.13 Favored 'General case' 0 C--O 1.215 -0.717 0 N-CA-C 112.635 0.605 . . . . 68.39 112.635 -178.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . . . -65.13 -28.62 69.55 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.579 0.955 . . . . 72.14 113.579 175.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -58.4 -33.19 69.36 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 122.485 0.314 . . . . 74.93 111.103 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -104.81 11.66 33.54 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 124.356 1.035 . . . . 61.27 110.605 -174.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 51.28 38.64 21.96 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 123.914 0.886 . . . . 66.81 112.516 -177.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.2 mt -77.59 109.36 12.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 N-CA-C 104.541 -2.392 . . . . 69.04 104.541 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . . . -105.38 177.88 4.72 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 116.285 -0.416 . . . . 75.18 110.014 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.95 139.76 13.24 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 121.835 0.826 . . . . 102.47 112.152 170.84 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 2' ' ' GLN . 36.0 m-20 53.67 30.99 11.89 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.734 -1.121 . . . . 97.16 112.773 -174.32 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.1 m -77.85 153.81 32.36 Favored 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 104.087 -2.56 . . . . 68.19 104.087 170.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.02 109.1 15.09 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 125.886 1.991 . . . . 76.04 110.682 -172.394 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -104.86 164.0 12.11 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 124.01 0.819 . . . . 52.81 109.753 -179.944 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -115.09 148.89 38.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.014 -0.539 . . . . 57.22 109.943 167.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.0 tp -128.38 137.87 52.08 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 108.172 -1.047 . . . . 53.01 108.172 170.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.1 t -122.42 125.35 72.62 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.462 0 O-C-N 124.24 0.963 . . . . 54.77 109.034 169.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -137.82 156.28 48.11 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 114.269 -1.332 . . . . 58.73 109.028 -179.149 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . 0.519 ' OG ' ' OE2' ' B' ' 259' ' ' GLU . 37.7 m -109.79 137.95 46.85 Favored 'General case' 0 C--O 1.209 -1.055 0 C-N-CA 125.698 1.599 . . . . 64.1 109.233 165.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 30.8 mt -126.32 152.33 46.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.339 1.056 . . . . 71.03 110.226 174.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . -77.1 -43.88 32.58 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 123.345 0.403 . . . . 75.49 109.972 171.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . . . -145.58 161.81 38.94 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.239 -1.023 . . . . 78.88 108.239 171.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.3 mt . . . . . 0 N--CA 1.48 1.043 0 O-C-N 123.847 0.717 . . . . 98.57 112.421 -179.862 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 255' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 . . . . . 1 N--CA 1.557 4.894 0 N-CA-C 115.488 1.662 . . . . 29.24 115.488 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 256' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -66.64 -41.36 11.35 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 N-CA-C 115.408 1.272 . . . . 29.83 115.408 -155.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 257' ' ' GLU . . . . . . . . . . . . . . . -63.15 -43.24 98.85 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 119.218 0.917 . . . . 29.47 112.107 -177.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 258' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -71.02 -36.34 72.37 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.585 0.957 . . . . 60.18 113.585 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 259' ' ' GLU . . . . . 0.519 ' OE2' ' OG ' ' A' ' 72' ' ' SER . 9.7 mt-10 -59.38 -47.53 85.09 Favored 'General case' 0 C--O 1.203 -1.372 0 O-C-N 124.052 0.845 . . . . 62.79 111.577 176.753 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 260' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -60.59 -40.64 92.53 Favored 'General case' 0 CA--C 1.488 -1.405 0 CA-C-O 121.622 0.725 . . . . 68.02 111.01 -179.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 261' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.3 -42.52 88.19 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 114.318 1.229 . . . . 75.84 114.318 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 262' ' ' LEU . . . . . . . . . . . . . 65.1 mt -69.16 -31.4 70.02 Favored 'General case' 0 C--O 1.207 -1.18 0 N-CA-C 112.481 0.548 . . . . 65.2 112.481 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 263' ' ' ILE . . . . . . . . . . . . . 41.2 mt -63.81 -47.86 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.027 0 O-C-N 124.19 0.931 . . . . 54.84 110.496 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 264' ' ' ARG . . . . . . . . . . . . . 36.2 ttm105 -58.37 -42.69 87.53 Favored 'General case' 0 C--O 1.206 -1.199 0 O-C-N 124.739 1.275 . . . . 72.9 108.323 176.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -65.45 -38.79 90.89 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 116.899 2.185 . . . . 56.76 116.899 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 266' ' ' ALA . . . . . . . . . . . . . . . -73.04 -33.63 65.82 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 124.555 1.142 . . . . 50.75 111.935 -179.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 267' ' ' ILE . . . . . . . . . . . . . 19.0 mt -60.15 -47.98 89.88 Favored 'Isoleucine or valine' 0 C--O 1.248 0.988 0 C-N-CA 124.082 0.953 . . . . 58.97 110.714 168.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 268' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -57.04 -52.35 65.61 Favored 'General case' 0 C--O 1.207 -1.179 0 CA-C-N 115.525 -0.761 . . . . 61.38 110.005 171.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 269' ' ' LEU . . . . . . . . . . . . . 66.3 mt -57.95 -29.79 65.46 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.833 1.049 . . . . 59.63 113.833 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 270' ' ' SER . . . . . . . . . . . . . 86.5 p -72.3 -3.84 26.19 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.671 1.36 . . . . 59.43 114.671 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 271' ' ' LEU . . . . . . . . . . . . . 66.5 mt . . . . . 0 CA--C 1.55 0.959 0 N-CA-C 113.592 0.96 . . . . 66.12 113.592 -178.414 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.8 ptt? . . . . . 0 N--CA 1.505 2.283 0 N-CA-C 116.055 1.872 . . . . 94.88 116.055 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . . . -86.21 121.21 28.47 Favored 'General case' 0 C--O 1.247 0.973 0 N-CA-C 107.346 -1.353 . . . . 84.05 107.346 173.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 pt -106.72 160.44 6.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-O 121.558 0.694 . . . . 68.1 111.687 163.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -118.99 131.43 56.01 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.938 -1.028 . . . . 73.98 108.305 -176.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 18.8 t -115.69 119.37 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 109.955 -0.387 . . . . 54.92 109.955 172.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -89.63 102.81 15.49 Favored 'General case' 0 C--O 1.209 -1.069 0 O-C-N 124.616 1.198 . . . . 69.75 108.078 173.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 74.5 p -93.33 138.08 32.03 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.099 -0.704 . . . . 54.66 109.099 -171.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 89.6 mt . . . . . 0 CA--C 1.555 1.16 0 C-N-CA 123.164 0.586 . . . . 50.07 112.241 -179.839 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.522 3.143 0 N-CA-C 119.978 3.325 . . . . 54.11 119.978 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 30.6 ttp -155.04 135.05 12.97 Favored 'General case' 0 C--O 1.202 -1.403 0 C-N-CA 124.424 1.089 . . . . 70.6 111.197 177.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.86 129.77 53.12 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.344 -0.984 . . . . 87.54 108.344 -173.613 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.6 pt -121.94 153.8 26.22 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.157 0 N-CA-C 108.484 -0.932 . . . . 58.95 108.484 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -108.27 146.96 32.1 Favored 'General case' 0 C--O 1.213 -0.822 0 N-CA-C 105.901 -1.888 . . . . 67.67 105.901 173.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 94.6 mt -131.7 140.11 49.21 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 118.389 0.54 . . . . 70.18 110.981 176.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . . . -92.07 113.45 25.72 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.459 1.104 . . . . 96.81 109.253 175.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.2 m -135.95 168.15 23.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-N 115.566 -0.743 . . . . 86.74 112.005 -170.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . . . -112.91 141.95 26.41 Favored Pre-proline 0 CA--C 1.548 0.884 0 N-CA-C 107.56 -1.274 . . . . 90.0 107.56 165.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -54.74 -24.41 37.69 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 118.957 0.663 . . . . 92.47 112.713 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.0 t -62.86 -15.03 53.01 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 117.011 2.226 . . . . 98.53 117.011 173.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -73.78 139.73 45.39 Favored 'General case' 0 C--O 1.211 -0.96 0 C-N-CA 123.38 0.672 . . . . 91.17 112.608 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.7 p -79.73 163.25 24.64 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 109.391 -0.596 . . . . 85.37 109.391 176.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . 0.483 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 14.6 mm -60.85 -41.99 90.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 O-C-N 123.822 0.701 . . . . 65.41 110.657 176.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -56.72 -38.84 72.9 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.162 0.585 . . . . 101.17 111.69 176.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -61.06 -48.37 82.04 Favored 'General case' 0 CA--C 1.492 -1.273 0 O-C-N 124.474 1.109 . . . . 91.58 108.29 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 53.4 t -63.36 -39.59 85.87 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.723 -0.671 . . . . 65.98 111.749 -177.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -66.45 -30.25 70.57 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 120.274 -0.57 . . . . 61.34 110.57 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.3 -38.47 78.3 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.828 1.048 . . . . 75.77 113.828 170.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . . . -62.85 -36.84 84.56 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.193 -0.669 . . . . 71.61 109.193 175.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 88.3 mt -71.67 -39.73 69.59 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.161 0 O-C-N 122.051 -0.406 . . . . 67.29 110.911 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -61.56 -48.37 81.28 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.238 0.542 . . . . 81.74 111.385 175.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -56.4 -48.43 76.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.732 -1.122 . . . . 97.42 108.226 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -75.65 -42.71 50.72 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 115.966 1.839 . . . . 92.0 115.966 -177.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -116.65 -5.05 11.64 Favored 'General case' 0 N--CA 1.506 2.332 0 N-CA-C 119.396 3.11 . . . . 81.45 119.396 -174.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.58 6.71 87.1 Favored Glycine 0 CA--C 1.499 -0.95 0 CA-C-O 118.552 -1.138 . . . . 66.72 113.47 173.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.2 mt -80.79 123.69 82.21 Favored Pre-proline 0 C--O 1.244 0.783 0 CA-C-N 117.981 0.891 . . . . 61.64 109.296 -179.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.44 137.13 63.11 Favored 'Trans proline' 0 C--N 1.355 0.916 0 CA-C-O 118.167 -0.847 . . . . 69.45 112.552 177.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -60.34 -31.51 92.88 Favored 'Trans proline' 0 C--N 1.359 1.13 0 C-N-CA 123.037 2.492 . . . . 69.1 114.216 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.53 -9.58 58.83 Favored 'General case' 0 C--O 1.203 -1.361 0 O-C-N 125.136 1.522 . . . . 88.8 114.645 177.235 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -103.36 4.62 36.54 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 123.547 0.739 . . . . 70.84 112.942 171.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . 0.463 ' HB3' HD11 ' A' ' 69' ' ' LEU . 65.7 mt-30 -100.58 130.96 46.71 Favored 'General case' 0 CA--C 1.482 -1.637 0 N-CA-C 107.717 -1.216 . . . . 54.47 107.717 -171.934 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mtm180 -120.67 108.64 14.26 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 105.196 -2.149 . . . . 80.59 105.196 172.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.8 mt -91.87 140.35 29.76 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 121.667 -0.646 . . . . 53.31 110.09 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.4 mt -135.64 129.89 49.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 O-C-N 125.028 1.455 . . . . 47.78 108.836 -168.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -147.25 139.66 24.66 Favored 'General case' 0 C--O 1.204 -1.3 0 O-C-N 124.386 1.054 . . . . 54.97 109.417 173.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.29 47.11 13.66 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 115.138 1.532 . . . . 55.39 115.138 173.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.66 3.69 88.04 Favored Glycine 0 C--O 1.215 -1.034 0 N-CA-C 115.759 1.064 . . . . 52.27 115.759 172.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 30.6 mtp -128.6 148.28 50.78 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 117.275 0.538 . . . . 61.51 110.301 -173.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -81.12 134.44 35.64 Favored 'General case' 0 CA--C 1.485 -1.531 0 O-C-N 124.682 1.239 . . . . 63.85 108.384 161.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.6 mt -95.29 144.31 25.97 Favored 'General case' 0 C--O 1.211 -0.96 0 C-N-CA 119.304 -0.958 . . . . 55.15 109.528 -168.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -101.02 134.94 43.26 Favored 'General case' 0 CA--C 1.503 -0.849 0 C-N-CA 122.95 0.5 . . . . 83.45 111.724 -171.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . 0.483 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 8.6 m-20 -51.74 -36.45 47.23 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 116.62 2.082 . . . . 77.14 116.62 -162.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -99.78 27.74 18.79 Favored Glycine 0 N--CA 1.476 1.335 0 N-CA-C 115.042 0.777 . . . . 77.35 115.042 -174.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ARG . . . . . 0.511 ' HG3' ' OD2' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -111.9 153.1 27.2 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 104.692 -2.336 . . . . 78.03 104.692 175.895 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.7 p -97.61 169.12 9.93 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.673 -0.642 . . . . 73.67 111.45 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 87.5 mt -65.46 -36.85 85.13 Favored 'General case' 0 C--O 1.215 -0.717 0 N-CA-C 112.635 0.605 . . . . 68.39 112.635 -178.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . . . -65.13 -28.62 69.55 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.579 0.955 . . . . 72.14 113.579 175.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . 0.511 ' OD2' ' HG3' ' A' ' 54' ' ' ARG . 68.6 m-20 -58.4 -33.19 69.36 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 122.485 0.314 . . . . 74.93 111.103 176.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -104.81 11.66 33.54 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 124.356 1.035 . . . . 61.27 110.605 -174.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 51.28 38.64 21.96 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 123.914 0.886 . . . . 66.81 112.516 -177.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.2 mt -77.59 109.36 12.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 N-CA-C 104.541 -2.392 . . . . 69.04 104.541 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . . . -105.38 177.88 4.72 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 116.285 -0.416 . . . . 75.18 110.014 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.95 139.76 13.24 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 121.835 0.826 . . . . 102.47 112.152 170.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 53.67 30.99 11.89 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.734 -1.121 . . . . 97.16 112.773 -174.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.1 m -77.85 153.81 32.36 Favored 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 104.087 -2.56 . . . . 68.19 104.087 170.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.02 109.1 15.09 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 125.886 1.991 . . . . 76.04 110.682 -172.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -104.86 164.0 12.11 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 124.01 0.819 . . . . 52.81 109.753 -179.944 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -115.09 148.89 38.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.014 -0.539 . . . . 57.22 109.943 167.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' A' ' 41' ' ' GLN . 9.0 tp -128.38 137.87 52.08 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 108.172 -1.047 . . . . 53.01 108.172 170.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.1 t -122.42 125.35 72.62 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.462 0 O-C-N 124.24 0.963 . . . . 54.77 109.034 169.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -137.82 156.28 48.11 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 114.269 -1.332 . . . . 58.73 109.028 -179.149 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . 0.485 ' OG ' ' OE2' ' B' ' 259' ' ' GLU . 37.7 m -109.79 137.95 46.85 Favored 'General case' 0 C--O 1.209 -1.055 0 C-N-CA 125.698 1.599 . . . . 64.1 109.233 165.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 30.8 mt -126.32 152.33 46.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.339 1.056 . . . . 71.03 110.226 174.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . -77.1 -43.88 32.58 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 123.345 0.403 . . . . 75.49 109.972 171.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . . . -145.58 161.81 38.94 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.239 -1.023 . . . . 78.88 108.239 171.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.3 mt . . . . . 0 N--CA 1.48 1.043 0 O-C-N 123.847 0.717 . . . . 98.57 112.421 -179.862 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 255' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 . . . . . 1 N--CA 1.557 4.894 0 N-CA-C 115.488 1.662 . . . . 29.24 115.488 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 256' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -66.64 -41.36 11.35 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 N-CA-C 115.408 1.272 . . . . 29.83 115.408 -155.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 257' ' ' GLU . . . . . . . . . . . . . . . -63.15 -43.24 98.85 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 119.218 0.917 . . . . 29.47 112.107 -177.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 258' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -71.02 -36.34 72.37 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.585 0.957 . . . . 60.18 113.585 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 259' ' ' GLU . . . . . 0.485 ' OE2' ' OG ' ' A' ' 72' ' ' SER . 9.7 mt-10 -59.38 -47.53 85.09 Favored 'General case' 0 C--O 1.203 -1.372 0 O-C-N 124.052 0.845 . . . . 62.79 111.577 176.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 260' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -60.59 -40.64 92.53 Favored 'General case' 0 CA--C 1.488 -1.405 0 CA-C-O 121.622 0.725 . . . . 68.02 111.01 -179.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 261' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.3 -42.52 88.19 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 114.318 1.229 . . . . 75.84 114.318 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 262' ' ' LEU . . . . . . . . . . . . . 65.1 mt -69.16 -31.4 70.02 Favored 'General case' 0 C--O 1.207 -1.18 0 N-CA-C 112.481 0.548 . . . . 65.2 112.481 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 263' ' ' ILE . . . . . . . . . . . . . 41.2 mt -63.81 -47.86 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.027 0 O-C-N 124.19 0.931 . . . . 54.84 110.496 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 264' ' ' ARG . . . . . . . . . . . . . 36.2 ttm105 -58.37 -42.69 87.53 Favored 'General case' 0 C--O 1.206 -1.199 0 O-C-N 124.739 1.275 . . . . 72.9 108.323 176.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -65.45 -38.79 90.89 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 116.899 2.185 . . . . 56.76 116.899 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 266' ' ' ALA . . . . . . . . . . . . . . . -73.04 -33.63 65.82 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 124.555 1.142 . . . . 50.75 111.935 -179.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 267' ' ' ILE . . . . . . . . . . . . . 19.0 mt -60.15 -47.98 89.88 Favored 'Isoleucine or valine' 0 C--O 1.248 0.988 0 C-N-CA 124.082 0.953 . . . . 58.97 110.714 168.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 268' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -57.04 -52.35 65.61 Favored 'General case' 0 C--O 1.207 -1.179 0 CA-C-N 115.525 -0.761 . . . . 61.38 110.005 171.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 269' ' ' LEU . . . . . . . . . . . . . 66.3 mt -57.95 -29.79 65.46 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.833 1.049 . . . . 59.63 113.833 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 270' ' ' SER . . . . . . . . . . . . . 86.5 p -72.3 -3.84 26.19 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.671 1.36 . . . . 59.43 114.671 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 271' ' ' LEU . . . . . . . . . . . . . 66.5 mt . . . . . 0 CA--C 1.55 0.959 0 N-CA-C 113.592 0.96 . . . . 66.12 113.592 -178.414 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.8 ptt? . . . . . 0 N--CA 1.505 2.283 0 N-CA-C 116.055 1.872 . . . . 94.88 116.055 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . . . -86.21 121.21 28.47 Favored 'General case' 0 C--O 1.247 0.973 0 N-CA-C 107.346 -1.353 . . . . 84.05 107.346 173.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 pt -106.72 160.44 6.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-O 121.558 0.694 . . . . 68.1 111.687 163.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -118.99 131.43 56.01 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.938 -1.028 . . . . 73.98 108.305 -176.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 18.8 t -115.69 119.37 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 109.955 -0.387 . . . . 54.92 109.955 172.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -89.63 102.81 15.49 Favored 'General case' 0 C--O 1.209 -1.069 0 O-C-N 124.616 1.198 . . . . 69.75 108.078 173.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 74.5 p -93.33 138.08 32.03 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.099 -0.704 . . . . 54.66 109.099 -171.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 89.6 mt . . . . . 0 CA--C 1.555 1.16 0 C-N-CA 123.164 0.586 . . . . 50.07 112.241 -179.839 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.522 3.143 0 N-CA-C 119.978 3.325 . . . . 54.11 119.978 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 30.6 ttp -155.04 135.05 12.97 Favored 'General case' 0 C--O 1.202 -1.403 0 C-N-CA 124.424 1.089 . . . . 70.6 111.197 177.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.86 129.77 53.12 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.344 -0.984 . . . . 87.54 108.344 -173.613 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.6 pt -121.94 153.8 26.22 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.157 0 N-CA-C 108.484 -0.932 . . . . 58.95 108.484 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -108.27 146.96 32.1 Favored 'General case' 0 C--O 1.213 -0.822 0 N-CA-C 105.901 -1.888 . . . . 67.67 105.901 173.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 94.6 mt -131.7 140.11 49.21 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 118.389 0.54 . . . . 70.18 110.981 176.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . . . -92.07 113.45 25.72 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.459 1.104 . . . . 96.81 109.253 175.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.2 m -135.95 168.15 23.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-N 115.566 -0.743 . . . . 86.74 112.005 -170.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . . . -112.91 141.95 26.41 Favored Pre-proline 0 CA--C 1.548 0.884 0 N-CA-C 107.56 -1.274 . . . . 90.0 107.56 165.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -54.74 -24.41 37.69 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 118.957 0.663 . . . . 92.47 112.713 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.0 t -62.86 -15.03 53.01 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 117.011 2.226 . . . . 98.53 117.011 173.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -73.78 139.73 45.39 Favored 'General case' 0 C--O 1.211 -0.96 0 C-N-CA 123.38 0.672 . . . . 91.17 112.608 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.7 p -79.73 163.25 24.64 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 109.391 -0.596 . . . . 85.37 109.391 176.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.483 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 14.6 mm -60.85 -41.99 90.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 O-C-N 123.822 0.701 . . . . 65.41 110.657 176.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -56.72 -38.84 72.9 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.162 0.585 . . . . 101.17 111.69 176.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -61.06 -48.37 82.04 Favored 'General case' 0 CA--C 1.492 -1.273 0 O-C-N 124.474 1.109 . . . . 91.58 108.29 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 53.4 t -63.36 -39.59 85.87 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.723 -0.671 . . . . 65.98 111.749 -177.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -66.45 -30.25 70.57 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 120.274 -0.57 . . . . 61.34 110.57 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.3 -38.47 78.3 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.828 1.048 . . . . 75.77 113.828 170.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . . . -62.85 -36.84 84.56 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.193 -0.669 . . . . 71.61 109.193 175.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 88.3 mt -71.67 -39.73 69.59 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.161 0 O-C-N 122.051 -0.406 . . . . 67.29 110.911 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -61.56 -48.37 81.28 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.238 0.542 . . . . 81.74 111.385 175.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -56.4 -48.43 76.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.732 -1.122 . . . . 97.42 108.226 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -75.65 -42.71 50.72 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 115.966 1.839 . . . . 92.0 115.966 -177.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -116.65 -5.05 11.64 Favored 'General case' 0 N--CA 1.506 2.332 0 N-CA-C 119.396 3.11 . . . . 81.45 119.396 -174.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.58 6.71 87.1 Favored Glycine 0 CA--C 1.499 -0.95 0 CA-C-O 118.552 -1.138 . . . . 66.72 113.47 173.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.2 mt -80.79 123.69 82.21 Favored Pre-proline 0 C--O 1.244 0.783 0 CA-C-N 117.981 0.891 . . . . 61.64 109.296 -179.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.44 137.13 63.11 Favored 'Trans proline' 0 C--N 1.355 0.916 0 CA-C-O 118.167 -0.847 . . . . 69.45 112.552 177.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -60.34 -31.51 92.88 Favored 'Trans proline' 0 C--N 1.359 1.13 0 C-N-CA 123.037 2.492 . . . . 69.1 114.216 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.53 -9.58 58.83 Favored 'General case' 0 C--O 1.203 -1.361 0 O-C-N 125.136 1.522 . . . . 88.8 114.645 177.235 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -103.36 4.62 36.54 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 123.547 0.739 . . . . 70.84 112.942 171.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.463 ' HB3' HD11 ' A' ' 69' ' ' LEU . 65.7 mt-30 -100.58 130.96 46.71 Favored 'General case' 0 CA--C 1.482 -1.637 0 N-CA-C 107.717 -1.216 . . . . 54.47 107.717 -171.934 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mtm180 -120.67 108.64 14.26 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 105.196 -2.149 . . . . 80.59 105.196 172.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.8 mt -91.87 140.35 29.76 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 121.667 -0.646 . . . . 53.31 110.09 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.4 mt -135.64 129.89 49.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 O-C-N 125.028 1.455 . . . . 47.78 108.836 -168.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -147.25 139.66 24.66 Favored 'General case' 0 C--O 1.204 -1.3 0 O-C-N 124.386 1.054 . . . . 54.97 109.417 173.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.29 47.11 13.66 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 115.138 1.532 . . . . 55.39 115.138 173.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.66 3.69 88.04 Favored Glycine 0 C--O 1.215 -1.034 0 N-CA-C 115.759 1.064 . . . . 52.27 115.759 172.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 30.6 mtp -128.6 148.28 50.78 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 117.275 0.538 . . . . 61.51 110.301 -173.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -81.12 134.44 35.64 Favored 'General case' 0 CA--C 1.485 -1.531 0 O-C-N 124.682 1.239 . . . . 63.85 108.384 161.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.6 mt -95.29 144.31 25.97 Favored 'General case' 0 C--O 1.211 -0.96 0 C-N-CA 119.304 -0.958 . . . . 55.15 109.528 -168.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -101.02 134.94 43.26 Favored 'General case' 0 CA--C 1.503 -0.849 0 C-N-CA 122.95 0.5 . . . . 83.45 111.724 -171.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.483 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 8.6 m-20 -51.74 -36.45 47.23 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 116.62 2.082 . . . . 77.14 116.62 -162.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -99.78 27.74 18.79 Favored Glycine 0 N--CA 1.476 1.335 0 N-CA-C 115.042 0.777 . . . . 77.35 115.042 -174.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.511 ' HG3' ' OD2' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -111.9 153.1 27.2 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 104.692 -2.336 . . . . 78.03 104.692 175.895 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.7 p -97.61 169.12 9.93 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.673 -0.642 . . . . 73.67 111.45 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 87.5 mt -65.46 -36.85 85.13 Favored 'General case' 0 C--O 1.215 -0.717 0 N-CA-C 112.635 0.605 . . . . 68.39 112.635 -178.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . . . -65.13 -28.62 69.55 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.579 0.955 . . . . 72.14 113.579 175.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.511 ' OD2' ' HG3' ' A' ' 54' ' ' ARG . 68.6 m-20 -58.4 -33.19 69.36 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 122.485 0.314 . . . . 74.93 111.103 176.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -104.81 11.66 33.54 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 124.356 1.035 . . . . 61.27 110.605 -174.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 51.28 38.64 21.96 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 123.914 0.886 . . . . 66.81 112.516 -177.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.2 mt -77.59 109.36 12.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 N-CA-C 104.541 -2.392 . . . . 69.04 104.541 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . . . -105.38 177.88 4.72 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 116.285 -0.416 . . . . 75.18 110.014 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.95 139.76 13.24 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 121.835 0.826 . . . . 102.47 112.152 170.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 53.67 30.99 11.89 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.734 -1.121 . . . . 97.16 112.773 -174.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.1 m -77.85 153.81 32.36 Favored 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 104.087 -2.56 . . . . 68.19 104.087 170.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.02 109.1 15.09 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 125.886 1.991 . . . . 76.04 110.682 -172.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -104.86 164.0 12.11 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 124.01 0.819 . . . . 52.81 109.753 -179.944 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -115.09 148.89 38.35 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.014 -0.539 . . . . 57.22 109.943 167.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' A' ' 41' ' ' GLN . 9.0 tp -128.38 137.87 52.08 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 108.172 -1.047 . . . . 53.01 108.172 170.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.1 t -122.42 125.35 72.62 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.462 0 O-C-N 124.24 0.963 . . . . 54.77 109.034 169.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -137.82 156.28 48.11 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 114.269 -1.332 . . . . 58.73 109.028 -179.149 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . 0.485 ' OG ' ' OE2' ' B' ' 259' ' ' GLU . 37.7 m -109.79 137.95 46.85 Favored 'General case' 0 C--O 1.209 -1.055 0 C-N-CA 125.698 1.599 . . . . 64.1 109.233 165.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 30.8 mt -126.32 152.33 46.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.339 1.056 . . . . 71.03 110.226 174.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . -77.1 -43.88 32.58 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 123.345 0.403 . . . . 75.49 109.972 171.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . . . -145.58 161.81 38.94 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.239 -1.023 . . . . 78.88 108.239 171.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.3 mt . . . . . 0 N--CA 1.48 1.043 0 O-C-N 123.847 0.717 . . . . 98.57 112.421 -179.862 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 255' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 . . . . . 1 N--CA 1.557 4.894 0 N-CA-C 115.488 1.662 . . . . 29.24 115.488 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 256' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -66.64 -41.36 11.35 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 N-CA-C 115.408 1.272 . . . . 29.83 115.408 -155.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 257' ' ' GLU . . . . . . . . . . . . . . . -63.15 -43.24 98.85 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 119.218 0.917 . . . . 29.47 112.107 -177.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 258' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -71.02 -36.34 72.37 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.585 0.957 . . . . 60.18 113.585 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 259' ' ' GLU . . . . . 0.485 ' OE2' ' OG ' ' A' ' 72' ' ' SER . 9.7 mt-10 -59.38 -47.53 85.09 Favored 'General case' 0 C--O 1.203 -1.372 0 O-C-N 124.052 0.845 . . . . 62.79 111.577 176.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 260' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -60.59 -40.64 92.53 Favored 'General case' 0 CA--C 1.488 -1.405 0 CA-C-O 121.622 0.725 . . . . 68.02 111.01 -179.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 261' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.3 -42.52 88.19 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 114.318 1.229 . . . . 75.84 114.318 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 262' ' ' LEU . . . . . . . . . . . . . 65.1 mt -69.16 -31.4 70.02 Favored 'General case' 0 C--O 1.207 -1.18 0 N-CA-C 112.481 0.548 . . . . 65.2 112.481 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 263' ' ' ILE . . . . . . . . . . . . . 41.2 mt -63.81 -47.86 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.027 0 O-C-N 124.19 0.931 . . . . 54.84 110.496 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 264' ' ' ARG . . . . . . . . . . . . . 36.2 ttm105 -58.37 -42.69 87.53 Favored 'General case' 0 C--O 1.206 -1.199 0 O-C-N 124.739 1.275 . . . . 72.9 108.323 176.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -65.45 -38.79 90.89 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 116.899 2.185 . . . . 56.76 116.899 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 266' ' ' ALA . . . . . . . . . . . . . . . -73.04 -33.63 65.82 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 124.555 1.142 . . . . 50.75 111.935 -179.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 267' ' ' ILE . . . . . . . . . . . . . 19.0 mt -60.15 -47.98 89.88 Favored 'Isoleucine or valine' 0 C--O 1.248 0.988 0 C-N-CA 124.082 0.953 . . . . 58.97 110.714 168.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 268' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -57.04 -52.35 65.61 Favored 'General case' 0 C--O 1.207 -1.179 0 CA-C-N 115.525 -0.761 . . . . 61.38 110.005 171.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 269' ' ' LEU . . . . . . . . . . . . . 66.3 mt -57.95 -29.79 65.46 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.833 1.049 . . . . 59.63 113.833 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 270' ' ' SER . . . . . . . . . . . . . 86.5 p -72.3 -3.84 26.19 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.671 1.36 . . . . 59.43 114.671 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 271' ' ' LEU . . . . . . . . . . . . . 66.5 mt . . . . . 0 CA--C 1.55 0.959 0 N-CA-C 113.592 0.96 . . . . 66.12 113.592 -178.414 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_