data_3ssi_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 3ssi _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 107.695 -1.224 . . . . 58.29 107.695 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -138.3 159.93 40.78 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 105.377 -2.082 . . . . 41.31 105.377 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.68 124.77 90.86 Favored Pre-proline 0 C--O 1.24 0.595 0 N-CA-C 103.44 -2.8 . . . . 28.82 103.44 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -68.8 149.88 73.3 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 N-CA-C 117.306 2.002 . . . . 23.63 117.306 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 20.7 m -142.29 96.89 3.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.093 1.357 . . . . 31.23 107.577 177.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -146.99 127.42 14.03 Favored 'General case' 0 C--O 1.244 0.788 0 N-CA-C 107.462 -1.31 . . . . 24.51 107.462 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.6 mt -136.77 155.24 50.09 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.607 1.163 . . . . 28.54 114.079 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.0 m -125.99 122.04 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 N-CA-C 105.747 -1.946 . . . . 28.08 105.747 174.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.11 136.89 49.49 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 107.764 -1.199 . . . . 23.64 107.764 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.3 p -131.27 142.8 50.19 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.521 -0.548 . . . . 30.21 109.521 178.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 11.2 p -130.82 142.25 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 N-CA-C 108.096 -1.076 . . . . 27.49 108.096 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -156.63 150.66 21.96 Favored Glycine 0 C--O 1.223 -0.537 0 N-CA-C 108.163 -1.975 . . . . 27.6 108.163 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -75.66 126.53 31.19 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 105.666 -1.976 . . . . 49.72 105.666 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 162.18 -167.28 36.74 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.784 -0.927 . . . . 28.8 110.784 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -131.79 -2.53 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 C-N-CA 117.684 -1.606 . . . . 27.68 114.068 -179.394 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.6 p -161.38 156.5 23.88 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 106.413 -1.699 . . . . 45.63 106.413 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 -22.99 61.81 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 113.589 0.959 . . . . 36.29 113.589 -177.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 21.2 m -78.29 -33.53 49.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.812 -0.631 . . . . 46.38 110.263 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 p -108.42 12.01 26.56 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.464 2.394 . . . . 37.85 117.464 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -132.75 105.36 7.12 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 108.909 -0.774 . . . . 33.28 108.909 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.33 140.74 95.41 Favored Pre-proline 0 N--CA 1.443 -0.806 0 CA-C-N 116.717 -0.22 . . . . 25.31 110.918 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.2 104.8 1.85 Allowed 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 120.872 1.048 . . . . 25.8 110.17 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -83.05 -45.71 13.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.978 0.418 . . . . 46.8 112.12 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 -124.92 150.7 46.3 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.358 -0.979 . . . . 41.25 108.358 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -152.45 124.57 8.08 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 122.368 0.267 . . . . 29.15 111.524 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.5 m -124.63 140.56 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 113.61 0.967 . . . . 26.17 113.61 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.2 p -91.4 151.79 20.68 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 106.626 -1.62 . . . . 26.22 106.626 177.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.3 tp -142.45 126.31 17.15 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 120.75 0.309 . . . . 27.85 110.729 179.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.4 m -120.03 133.04 55.65 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.549 -0.908 . . . . 32.09 108.549 179.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -121.93 4.22 9.93 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.079 1.881 . . . . 36.06 116.079 179.557 -61.367 -56.459 -94.528 103.314 2.031 102.091 -53.68 -78.21 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -145.82 130.79 9.04 Favored Pre-proline 0 CA--C 1.502 -0.892 0 N-CA-C 107.451 -1.314 . . . . 35.04 107.451 -179.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.3 -15.67 18.46 Favored 'Cis proline' 0 C--N 1.344 0.299 0 O-C-N 122.586 0.782 . . . . 39.25 113.89 -0.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -146.39 160.2 28.14 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.692 -1.242 . . . . 40.47 110.736 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -69.71 121.83 8.53 Favored 'Trans proline' 0 CA--C 1.517 -0.351 0 C-N-CA 125.009 3.806 . . . . 33.26 112.96 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.6 p -157.84 178.6 10.06 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.122 -1.066 . . . . 25.75 108.122 177.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 123.61 177.9 15.24 Favored Glycine 0 CA--C 1.533 1.165 0 O-C-N 123.354 0.409 . . . . 27.29 113.91 -179.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.7 p -73.01 -14.6 61.46 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.113 0.783 . . . . 32.5 113.113 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 65.2 t-80 -54.37 133.15 62.08 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 109.427 -0.582 . . . . 27.27 109.427 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -56.08 -33.75 90.76 Favored 'Trans proline' 0 C--N 1.349 0.553 1 C-N-CA 125.923 4.415 . . . . 37.1 113.069 -179.911 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -131.89 65.72 1.56 Allowed 'General case' 0 C--O 1.247 0.954 0 CA-C-O 121.542 0.687 . . . . 32.67 111.494 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.07 -49.71 60.09 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.161 -0.927 . . . . 24.87 111.875 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -56.27 -63.68 5.08 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 115.168 0.827 . . . . 31.89 115.168 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -42.11 92.16 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 117.444 0.622 . . . . 43.82 112.308 -179.368 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.73 -54.68 38.72 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 106.178 -1.786 . . . . 34.34 106.178 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 33.8 m -50.2 -43.34 52.51 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 117.699 0.227 . . . . 26.19 111.066 178.896 -78.21 -53.68 -94.528 102.091 2.031 103.314 -56.459 -61.367 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.51 -32.93 74.06 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.076 0.398 . . . . 33.89 112.076 -179.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -66.01 -44.8 83.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.792 0.806 . . . . 35.59 109.306 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.9 mt -66.85 -48.07 69.99 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.533 -0.758 . . . . 26.95 111.843 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.59 63.35 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 116.349 -0.387 . . . . 29.35 110.271 -179.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.87 -39.95 63.03 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 112.625 0.602 . . . . 36.78 112.625 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -89.03 3.52 5.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.426 0.631 . . . . 36.9 112.113 -177.299 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 72.56 29.46 65.72 Favored Glycine 0 CA--C 1.505 -0.561 0 CA-C-N 115.32 -0.854 . . . . 34.66 113.689 178.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 75.76 -3.01 52.3 Favored Glycine 0 C--N 1.334 0.438 0 O-C-N 123.97 0.453 . . . . 39.21 111.971 179.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -80.84 92.94 6.17 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.748 0.309 . . . . 47.29 110.828 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.26 -49.56 42.87 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.376 -0.829 . . . . 34.78 111.459 178.78 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -16.31 4.66 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 116.725 2.12 . . . . 48.91 116.725 -179.164 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -99.65 5.48 45.82 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 114.49 1.292 . . . . 35.77 114.49 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.9 mt -69.47 123.83 22.3 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 106.731 -1.581 . . . . 44.62 106.731 177.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 7.4 p -84.54 157.06 21.37 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 117.775 2.509 . . . . 52.68 117.775 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 15.5 tpt85 -91.56 118.77 30.9 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 113.594 -1.639 . . . . 67.78 108.136 178.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -56.01 105.24 0.43 Allowed Glycine 0 C--N 1.333 0.4 0 CA-C-N 116.0 -0.546 . . . . 63.11 113.805 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -43.58 -41.05 4.35 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 115.514 1.672 . . . . 76.63 115.514 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.74 -28.89 40.43 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.626 0.972 . . . . 76.85 113.626 -179.916 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.56 124.59 10.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.427 0.632 . . . . 60.96 109.714 -179.839 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' MET . . . . . 0.462 ' N ' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -115.41 129.93 56.73 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.685 -0.689 . . . . 62.07 109.398 -177.883 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 31.7 m -122.91 144.38 42.85 Favored Pre-proline 0 CA--C 1.503 -0.844 0 CA-C-N 115.474 -0.785 . . . . 41.85 109.908 -178.125 -78.615 -58.74 -95.229 103.35 2.021 103.589 -77.938 178.577 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -66.01 148.53 85.79 Favored 'Trans proline' 0 N--CA 1.479 0.638 0 C-N-CA 123.541 2.827 . . . . 37.03 107.853 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 25.0 mmt -80.92 63.81 5.44 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 115.257 1.577 . . . . 46.11 115.257 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 71.1 t -95.48 156.8 3.19 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.597 0 N-CA-C 107.682 -1.229 . . . . 26.78 107.682 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -123.79 85.2 2.38 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 105.579 -2.008 . . . . 30.44 105.579 174.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -132.93 80.84 59.5 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 102.38 -3.193 . . . . 27.03 102.38 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.32 149.56 22.41 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 123.687 2.925 . . . . 31.87 116.719 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 1.4 p -142.47 125.1 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 114.006 -1.452 . . . . 30.5 107.69 -179.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.2 tp -91.92 125.5 36.64 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-O 120.94 0.4 . . . . 28.42 110.782 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.6 tp -108.65 127.26 53.81 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.987 -0.745 . . . . 24.96 108.987 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.4 p -121.19 149.41 42.86 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 109.412 -0.588 . . . . 22.87 109.412 175.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.4 t -142.41 123.27 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.194 0.998 . . . . 21.67 108.812 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -134.44 157.98 45.06 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.563 -0.29 . . . . 29.8 111.488 -179.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 129.13 -147.06 17.56 Favored Glycine 0 C--O 1.24 0.499 0 C-N-CA 120.686 -0.769 . . . . 27.95 113.569 179.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.3 m -127.22 132.42 69.66 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 113.759 1.022 . . . . 30.21 113.759 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TRP . . . . . . . . . . . . . 76.3 t-105 -116.71 110.26 18.22 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.164 -1.05 . . . . 28.53 108.164 175.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 51.78 55.28 9.55 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.651 0.611 . . . . 59.86 112.651 -178.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 75.05 -3.98 42.2 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 117.126 1.61 . . . . 21.48 117.126 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.9 ttmm -110.52 133.81 52.95 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.052 -0.659 . . . . 53.3 110.939 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.0 mtt180 -66.68 134.97 53.33 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.085 0.469 . . . . 40.64 111.811 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 33.6 t -116.14 139.91 40.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 114.627 -1.169 . . . . 31.65 110.404 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.5 t -158.93 96.39 1.34 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 104.627 -2.36 . . . . 30.75 104.627 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -133.62 150.0 51.59 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 124.309 1.006 . . . . 31.82 113.253 -175.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -158.61 138.74 12.27 Favored 'General case' 0 CA--C 1.492 -1.28 0 N-CA-C 106.269 -1.752 . . . . 35.38 106.269 178.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 34.2 ttt180 -145.66 142.83 29.4 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 124.474 1.109 . . . . 54.34 109.75 -178.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 10.1 m -101.65 127.5 54.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 107.36 -1.348 . . . . 28.45 107.36 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -101.92 156.71 17.36 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.829 -0.804 . . . . 28.73 108.829 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 95.2 p -67.83 -25.99 65.84 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 120.44 0.162 . . . . 30.73 111.033 -179.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -173.17 153.47 2.49 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 116.169 -0.469 . . . . 42.38 110.091 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -46.31 -41.8 13.76 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 115.721 1.749 . . . . 59.12 115.721 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 44.0 t -57.66 -32.08 66.94 Favored 'General case' 0 CA--C 1.503 -0.848 0 O-C-N 121.966 -0.459 . . . . 36.09 110.575 -179.331 178.577 -77.938 -95.229 103.589 2.021 103.35 -58.74 -78.615 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -75.88 -44.29 41.28 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.757 -1.11 . . . . 50.69 109.372 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 64.2 ttp -58.35 -52.3 66.2 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.125 -0.694 . . . . 32.1 109.125 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -66.0 -3.93 6.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.609 -0.723 . . . . 31.79 112.876 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -98.01 -5.15 34.65 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 112.572 0.582 . . . . 34.56 112.572 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -97.84 105.43 17.57 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 106.914 -1.513 . . . . 46.68 106.914 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.3 129.57 0.42 Allowed Glycine 0 C--O 1.239 0.431 0 N-CA-C 106.913 -2.475 . . . . 51.47 106.913 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.5 p -46.16 -51.16 14.6 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 118.397 2.74 . . . . 48.36 118.397 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.7 m -135.11 1.71 2.99 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 119.895 3.294 . . . . 50.46 119.895 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 2.0 t -56.01 -59.41 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-O 121.548 0.689 . . . . 40.8 110.079 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -91.07 -2.68 57.58 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 115.919 1.822 . . . . 38.76 115.919 -178.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -81.46 79.46 8.06 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.007 -0.677 . . . . 38.99 110.642 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 42.6 p90 . . . . . 0 C--O 1.26 1.615 0 N-CA-C 106.861 -1.533 . . . . 32.8 106.861 178.415 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 107.695 -1.224 . . . . 58.29 107.695 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -138.3 159.93 40.78 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 105.377 -2.082 . . . . 41.31 105.377 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.68 124.77 90.86 Favored Pre-proline 0 C--O 1.24 0.595 0 N-CA-C 103.44 -2.8 . . . . 28.82 103.44 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -68.8 149.88 73.3 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 N-CA-C 117.306 2.002 . . . . 23.63 117.306 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 20.7 m -142.29 96.89 3.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.093 1.357 . . . . 31.23 107.577 177.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -146.99 127.42 14.03 Favored 'General case' 0 C--O 1.244 0.788 0 N-CA-C 107.462 -1.31 . . . . 24.51 107.462 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.6 mt -136.77 155.24 50.09 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.607 1.163 . . . . 28.54 114.079 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . 0.619 HG12 HG22 ' A' ' 32' ' ' THR . 5.0 m -125.99 122.04 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 N-CA-C 105.747 -1.946 . . . . 28.08 105.747 174.3 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.11 136.89 49.49 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 107.764 -1.199 . . . . 23.64 107.764 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.3 p -131.27 142.8 50.19 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.521 -0.548 . . . . 30.21 109.521 178.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . 0.48 HG22 HG22 ' A' ' 78' ' ' VAL . 11.2 p -130.82 142.25 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 N-CA-C 108.096 -1.076 . . . . 27.49 108.096 179.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -156.63 150.66 21.96 Favored Glycine 0 C--O 1.223 -0.537 0 N-CA-C 108.163 -1.975 . . . . 27.6 108.163 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -75.66 126.53 31.19 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 105.666 -1.976 . . . . 49.72 105.666 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . 0.596 ' HA3' ' HB2' ' A' ' 25' ' ' ALA . . . 162.18 -167.28 36.74 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.784 -0.927 . . . . 28.8 110.784 -178.67 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -131.79 -2.53 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 C-N-CA 117.684 -1.606 . . . . 27.68 114.068 -179.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.6 p -161.38 156.5 23.88 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 106.413 -1.699 . . . . 45.63 106.413 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 -22.99 61.81 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 113.589 0.959 . . . . 36.29 113.589 -177.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 21.2 m -78.29 -33.53 49.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.812 -0.631 . . . . 46.38 110.263 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 p -108.42 12.01 26.56 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.464 2.394 . . . . 37.85 117.464 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . 0.596 ' HB2' ' HA3' ' A' ' 19' ' ' GLY . . . -132.75 105.36 7.12 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 108.909 -0.774 . . . . 33.28 108.909 -179.249 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.33 140.74 95.41 Favored Pre-proline 0 N--CA 1.443 -0.806 0 CA-C-N 116.717 -0.22 . . . . 25.31 110.918 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.2 104.8 1.85 Allowed 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 120.872 1.048 . . . . 25.8 110.17 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -83.05 -45.71 13.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.978 0.418 . . . . 46.8 112.12 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 -124.92 150.7 46.3 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.358 -0.979 . . . . 41.25 108.358 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -152.45 124.57 8.08 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 122.368 0.267 . . . . 29.15 111.524 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.5 m -124.63 140.56 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 113.61 0.967 . . . . 26.17 113.61 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . 0.619 HG22 HG12 ' A' ' 13' ' ' VAL . 25.2 p -91.4 151.79 20.68 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 106.626 -1.62 . . . . 26.22 106.626 177.342 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.3 tp -142.45 126.31 17.15 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 120.75 0.309 . . . . 27.85 110.729 179.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . 0.581 ' O ' ' HA ' ' A' ' 39' ' ' PRO . 5.4 m -120.03 133.04 55.65 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.549 -0.908 . . . . 32.09 108.549 179.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -121.93 4.22 9.93 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.079 1.881 . . . . 36.06 116.079 179.557 -61.367 -56.459 -94.528 103.314 2.031 102.091 -53.68 -78.21 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -145.82 130.79 9.04 Favored Pre-proline 0 CA--C 1.502 -0.892 0 N-CA-C 107.451 -1.314 . . . . 35.04 107.451 -179.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.3 -15.67 18.46 Favored 'Cis proline' 0 C--N 1.344 0.299 0 O-C-N 122.586 0.782 . . . . 39.25 113.89 -0.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -146.39 160.2 28.14 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.692 -1.242 . . . . 40.47 110.736 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PRO . . . . . 0.581 ' HA ' ' O ' ' A' ' 34' ' ' THR . 87.9 Cg_endo -69.71 121.83 8.53 Favored 'Trans proline' 0 CA--C 1.517 -0.351 0 C-N-CA 125.009 3.806 . . . . 33.26 112.96 179.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' A' ' 127' ' ' HOH . 24.6 p -157.84 178.6 10.06 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.122 -1.066 . . . . 25.75 108.122 177.663 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 123.61 177.9 15.24 Favored Glycine 0 CA--C 1.533 1.165 0 O-C-N 123.354 0.409 . . . . 27.29 113.91 -179.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.7 p -73.01 -14.6 61.46 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.113 0.783 . . . . 32.5 113.113 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' HIS . . . . . 0.453 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . 65.2 t-80 -54.37 133.15 62.08 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 109.427 -0.582 . . . . 27.27 109.427 179.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 43' ' ' HIS . 71.7 Cg_exo -56.08 -33.75 90.76 Favored 'Trans proline' 0 C--N 1.349 0.553 1 C-N-CA 125.923 4.415 . . . . 37.1 113.069 -179.911 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -131.89 65.72 1.56 Allowed 'General case' 0 C--O 1.247 0.954 0 CA-C-O 121.542 0.687 . . . . 32.67 111.494 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.07 -49.71 60.09 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.161 -0.927 . . . . 24.87 111.875 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -56.27 -63.68 5.08 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 115.168 0.827 . . . . 31.89 115.168 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -42.11 92.16 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 117.444 0.622 . . . . 43.82 112.308 -179.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.73 -54.68 38.72 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 106.178 -1.786 . . . . 34.34 106.178 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 33.8 m -50.2 -43.34 52.51 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 117.699 0.227 . . . . 26.19 111.066 178.896 -78.21 -53.68 -94.528 102.091 2.031 103.314 -56.459 -61.367 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.51 -32.93 74.06 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.076 0.398 . . . . 33.89 112.076 -179.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . 0.458 ' CB ' HG22 ' A' ' 110' ' ' VAL . 30.7 m-20 -66.01 -44.8 83.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.792 0.806 . . . . 35.59 109.306 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.9 mt -66.85 -48.07 69.99 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.533 -0.758 . . . . 26.95 111.843 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.59 63.35 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 116.349 -0.387 . . . . 29.35 110.271 -179.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.87 -39.95 63.03 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 112.625 0.602 . . . . 36.78 112.625 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -89.03 3.52 5.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.426 0.631 . . . . 36.9 112.113 -177.299 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 72.56 29.46 65.72 Favored Glycine 0 CA--C 1.505 -0.561 0 CA-C-N 115.32 -0.854 . . . . 34.66 113.689 178.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . 0.46 ' HA3' ' CD1' ' A' ' 86' ' ' TRP . . . 75.76 -3.01 52.3 Favored Glycine 0 C--N 1.334 0.438 0 O-C-N 123.97 0.453 . . . . 39.21 111.971 179.789 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -80.84 92.94 6.17 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.748 0.309 . . . . 47.29 110.828 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.26 -49.56 42.87 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.376 -0.829 . . . . 34.78 111.459 178.78 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -55.98 -16.31 4.66 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 116.725 2.12 . . . . 48.91 116.725 -179.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -99.65 5.48 45.82 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 114.49 1.292 . . . . 35.77 114.49 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.9 mt -69.47 123.83 22.3 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 106.731 -1.581 . . . . 44.62 106.731 177.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 7.4 p -84.54 157.06 21.37 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 117.775 2.509 . . . . 52.68 117.775 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . 0.468 ' NH1' HG12 ' A' ' 69' ' ' VAL . 15.5 tpt85 -91.56 118.77 30.9 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 113.594 -1.639 . . . . 67.78 108.136 178.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -56.01 105.24 0.43 Allowed Glycine 0 C--N 1.333 0.4 0 CA-C-N 116.0 -0.546 . . . . 63.11 113.805 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -43.58 -41.05 4.35 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 115.514 1.672 . . . . 76.63 115.514 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -79.74 -28.89 40.43 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.626 0.972 . . . . 76.85 113.626 -179.916 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . 0.742 HG11 ' HB1' ' A' ' 105' ' ' ALA . 0.3 OUTLIER -56.56 124.59 10.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.427 0.632 . . . . 60.96 109.714 -179.839 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 70' ' ' MET . . . . . 0.559 ' HB3' ' O ' ' A' ' 135' ' ' HOH . 0.0 OUTLIER -115.41 129.93 56.73 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.685 -0.689 . . . . 62.07 109.398 -177.883 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 31.7 m -122.91 144.38 42.85 Favored Pre-proline 0 CA--C 1.503 -0.844 0 CA-C-N 115.474 -0.785 . . . . 41.85 109.908 -178.125 -78.615 -58.74 -95.229 103.35 2.021 103.589 -77.938 178.577 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -66.01 148.53 85.79 Favored 'Trans proline' 0 N--CA 1.479 0.638 0 C-N-CA 123.541 2.827 . . . . 37.03 107.853 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 25.0 mmt -80.92 63.81 5.44 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 115.257 1.577 . . . . 46.11 115.257 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . 0.426 HG12 ' N ' ' A' ' 75' ' ' TYR . 71.1 t -95.48 156.8 3.19 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.597 0 N-CA-C 107.682 -1.229 . . . . 26.78 107.682 177.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TYR . . . . . 0.426 ' N ' HG12 ' A' ' 74' ' ' VAL . 89.9 t80 -123.79 85.2 2.38 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 105.579 -2.008 . . . . 30.44 105.579 174.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -132.93 80.84 59.5 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 102.38 -3.193 . . . . 27.03 102.38 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.32 149.56 22.41 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 123.687 2.925 . . . . 31.87 116.719 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' VAL . . . . . 0.48 HG22 HG22 ' A' ' 16' ' ' VAL . 1.4 p -142.47 125.1 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 114.006 -1.452 . . . . 30.5 107.69 -179.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.2 tp -91.92 125.5 36.64 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-O 120.94 0.4 . . . . 28.42 110.782 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 94' ' ' GLU . 2.6 tp -108.65 127.26 53.81 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.987 -0.745 . . . . 24.96 108.987 177.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.4 p -121.19 149.41 42.86 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 109.412 -0.588 . . . . 22.87 109.412 175.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.4 t -142.41 123.27 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.194 0.998 . . . . 21.67 108.812 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -134.44 157.98 45.06 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.563 -0.29 . . . . 29.8 111.488 -179.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 129.13 -147.06 17.56 Favored Glycine 0 C--O 1.24 0.499 0 C-N-CA 120.686 -0.769 . . . . 27.95 113.569 179.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.3 m -127.22 132.42 69.66 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 113.759 1.022 . . . . 30.21 113.759 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TRP . . . . . 0.46 ' CD1' ' HA3' ' A' ' 58' ' ' GLY . 76.3 t-105 -116.71 110.26 18.22 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.164 -1.05 . . . . 28.53 108.164 175.607 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 51.78 55.28 9.55 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.651 0.611 . . . . 59.86 112.651 -178.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 75.05 -3.98 42.2 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 117.126 1.61 . . . . 21.48 117.126 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.9 ttmm -110.52 133.81 52.95 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.052 -0.659 . . . . 53.3 110.939 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.0 mtt180 -66.68 134.97 53.33 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.085 0.469 . . . . 40.64 111.811 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 33.6 t -116.14 139.91 40.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 114.627 -1.169 . . . . 31.65 110.404 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.5 t -158.93 96.39 1.34 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 104.627 -2.36 . . . . 30.75 104.627 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -133.62 150.0 51.59 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 124.309 1.006 . . . . 31.82 113.253 -175.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . 0.453 ' HA ' ' O ' ' A' ' 80' ' ' LEU . 9.8 pt-20 -158.61 138.74 12.27 Favored 'General case' 0 CA--C 1.492 -1.28 0 N-CA-C 106.269 -1.752 . . . . 35.38 106.269 178.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ARG . . . . . 0.663 ' HD3' ' CZ ' ' A' ' 97' ' ' PHE . 34.2 ttt180 -145.66 142.83 29.4 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 124.474 1.109 . . . . 54.34 109.75 -178.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 10.1 m -101.65 127.5 54.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 107.36 -1.348 . . . . 28.45 107.36 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PHE . . . . . 0.663 ' CZ ' ' HD3' ' A' ' 95' ' ' ARG . 83.2 m-85 -101.92 156.71 17.36 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.829 -0.804 . . . . 28.73 108.829 177.648 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 95.2 p -67.83 -25.99 65.84 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 120.44 0.162 . . . . 30.73 111.033 -179.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -173.17 153.47 2.49 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 116.169 -0.469 . . . . 42.38 110.091 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -46.31 -41.8 13.76 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 115.721 1.749 . . . . 59.12 115.721 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 44.0 t -57.66 -32.08 66.94 Favored 'General case' 0 CA--C 1.503 -0.848 0 O-C-N 121.966 -0.459 . . . . 36.09 110.575 -179.331 178.577 -77.938 -95.229 103.589 2.021 103.35 -58.74 -78.615 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -75.88 -44.29 41.28 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.757 -1.11 . . . . 50.69 109.372 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 64.2 ttp -58.35 -52.3 66.2 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.125 -0.694 . . . . 32.1 109.125 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -66.0 -3.93 6.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.609 -0.723 . . . . 31.79 112.876 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . 0.742 ' HB1' HG11 ' A' ' 69' ' ' VAL . . . -98.01 -5.15 34.65 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 112.572 0.582 . . . . 34.56 112.572 -179.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HIS . . . . . 0.458 ' ND1' ' HE2' ' A' ' 97' ' ' PHE . 39.9 m80 -97.84 105.43 17.57 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 106.914 -1.513 . . . . 46.68 106.914 178.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.3 129.57 0.42 Allowed Glycine 0 C--O 1.239 0.431 0 N-CA-C 106.913 -2.475 . . . . 51.47 106.913 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.5 p -46.16 -51.16 14.6 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 118.397 2.74 . . . . 48.36 118.397 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.7 m -135.11 1.71 2.99 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 119.895 3.294 . . . . 50.46 119.895 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . 0.458 HG22 ' CB ' ' A' ' 52' ' ' ASP . 2.0 t -56.01 -59.41 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-O 121.548 0.689 . . . . 40.8 110.079 179.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -91.07 -2.68 57.58 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 115.919 1.822 . . . . 38.76 115.919 -178.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -81.46 79.46 8.06 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.007 -0.677 . . . . 38.99 110.642 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 42.6 p90 . . . . . 0 C--O 1.26 1.615 0 N-CA-C 106.861 -1.533 . . . . 32.8 106.861 178.415 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . 0.491 ' O ' ' HA ' ' A' ' 40' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . 0.559 ' O ' ' HB3' ' A' ' 70' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 107.695 -1.224 . . . . 58.289999999999999 107.695 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -138.3 159.93 40.78 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 105.377 -2.082 . . . . 41.310000000000002 105.377 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.68 124.77 90.86 Favored Pre-proline 0 C--O 1.24 0.595 0 N-CA-C 103.44 -2.8 . . . . 28.82 103.44 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -68.8 149.88 73.3 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 N-CA-C 117.306 2.002 . . . . 23.629999999999999 117.306 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 20.7 m -142.29 96.89 3.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.093 1.357 . . . . 31.23 107.577 177.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -146.99 127.42 14.03 Favored 'General case' 0 C--O 1.244 0.788 0 N-CA-C 107.462 -1.31 . . . . 24.510000000000002 107.462 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.6 mt -136.77 155.24 50.09 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.607 1.163 . . . . 28.539999999999999 114.079 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.619 HG12 HG22 ' A' ' 32' ' ' THR . 5.0 m -125.99 122.04 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 N-CA-C 105.747 -1.946 . . . . 28.079999999999998 105.747 174.3 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.11 136.89 49.49 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 107.764 -1.199 . . . . 23.640000000000001 107.764 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.3 p -131.27 142.8 50.19 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.521 -0.548 . . . . 30.210000000000001 109.521 178.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.48 HG22 HG22 ' A' ' 78' ' ' VAL . 11.2 p -130.82 142.25 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 N-CA-C 108.096 -1.076 . . . . 27.489999999999998 108.096 179.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -156.63 150.66 21.96 Favored Glycine 0 C--O 1.223 -0.537 0 N-CA-C 108.163 -1.975 . . . . 27.600000000000001 108.163 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -75.66 126.53 31.19 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 105.666 -1.976 . . . . 49.719999999999999 105.666 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.596 ' HA3' ' HB2' ' A' ' 25' ' ' ALA . . . 162.18 -167.28 36.74 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.784 -0.927 . . . . 28.800000000000001 110.784 -178.67 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -131.79 -2.53 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 C-N-CA 117.684 -1.606 . . . . 27.68 114.068 -179.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.6 p -161.38 156.5 23.88 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 106.413 -1.699 . . . . 45.630000000000003 106.413 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 -22.99 61.81 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 113.589 0.959 . . . . 36.289999999999999 113.589 -177.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 21.2 m -78.29 -33.53 49.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.812 -0.631 . . . . 46.380000000000003 110.263 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 p -108.42 12.01 26.56 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.464 2.394 . . . . 37.850000000000001 117.464 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.596 ' HB2' ' HA3' ' A' ' 19' ' ' GLY . . . -132.75 105.36 7.12 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 108.909 -0.774 . . . . 33.280000000000001 108.909 -179.249 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.33 140.74 95.41 Favored Pre-proline 0 N--CA 1.443 -0.806 0 CA-C-N 116.717 -0.22 . . . . 25.309999999999999 110.918 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.2 104.8 1.85 Allowed 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 120.872 1.048 . . . . 25.800000000000001 110.17 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -83.05 -45.71 13.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.978 0.418 . . . . 46.799999999999997 112.12 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 -124.92 150.7 46.3 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.358 -0.979 . . . . 41.25 108.358 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -152.45 124.57 8.08 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 122.368 0.267 . . . . 29.149999999999999 111.524 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.5 m -124.63 140.56 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 113.61 0.967 . . . . 26.170000000000002 113.61 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . 0.619 HG22 HG12 ' A' ' 13' ' ' VAL . 25.2 p -91.4 151.79 20.68 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 106.626 -1.62 . . . . 26.219999999999999 106.626 177.342 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.3 tp -142.45 126.31 17.15 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 120.75 0.309 . . . . 27.850000000000001 110.729 179.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . 0.581 ' O ' ' HA ' ' A' ' 39' ' ' PRO . 5.4 m -120.03 133.04 55.65 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.549 -0.908 . . . . 32.090000000000003 108.549 179.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -121.93 4.22 9.93 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.079 1.881 . . . . 36.060000000000002 116.079 179.557 -61.367 -56.459 -94.528 103.314 2.031 102.091 -53.68 -78.21 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -145.82 130.79 9.04 Favored Pre-proline 0 CA--C 1.502 -0.892 0 N-CA-C 107.451 -1.314 . . . . 35.039999999999999 107.451 -179.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.3 -15.67 18.46 Favored 'Cis proline' 0 C--N 1.344 0.299 0 O-C-N 122.586 0.782 . . . . 39.25 113.89 -0.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -146.39 160.2 28.14 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.692 -1.242 . . . . 40.469999999999999 110.736 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.581 ' HA ' ' O ' ' A' ' 34' ' ' THR . 87.9 Cg_endo -69.71 121.83 8.53 Favored 'Trans proline' 0 CA--C 1.517 -0.351 0 C-N-CA 125.009 3.806 . . . . 33.259999999999998 112.96 179.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' A' ' 127' ' ' HOH . 24.6 p -157.84 178.6 10.06 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.122 -1.066 . . . . 25.75 108.122 177.663 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 123.61 177.9 15.24 Favored Glycine 0 CA--C 1.533 1.165 0 O-C-N 123.354 0.409 . . . . 27.289999999999999 113.91 -179.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.7 p -73.01 -14.6 61.46 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.113 0.783 . . . . 32.5 113.113 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.453 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . 65.2 t-80 -54.37 133.15 62.08 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 109.427 -0.582 . . . . 27.27 109.427 179.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 43' ' ' HIS . 71.7 Cg_exo -56.08 -33.75 90.76 Favored 'Trans proline' 0 C--N 1.349 0.553 1 C-N-CA 125.923 4.415 . . . . 37.100000000000001 113.069 -179.911 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -131.89 65.72 1.56 Allowed 'General case' 0 C--O 1.247 0.954 0 CA-C-O 121.542 0.687 . . . . 32.670000000000002 111.494 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.07 -49.71 60.09 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.161 -0.927 . . . . 24.870000000000001 111.875 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -56.27 -63.68 5.08 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 115.168 0.827 . . . . 31.890000000000001 115.168 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -42.11 92.16 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 117.444 0.622 . . . . 43.82 112.308 -179.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.73 -54.68 38.72 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 106.178 -1.786 . . . . 34.340000000000003 106.178 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 33.8 m -50.2 -43.34 52.51 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 117.699 0.227 . . . . 26.190000000000001 111.066 178.896 -78.21 -53.68 -94.528 102.091 2.031 103.314 -56.459 -61.367 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.51 -32.93 74.06 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.076 0.398 . . . . 33.890000000000001 112.076 -179.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.458 ' CB ' HG22 ' A' ' 110' ' ' VAL . 30.7 m-20 -66.01 -44.8 83.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.792 0.806 . . . . 35.590000000000003 109.306 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.9 mt -66.85 -48.07 69.99 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.533 -0.758 . . . . 26.949999999999999 111.843 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.59 63.35 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 116.349 -0.387 . . . . 29.350000000000001 110.271 -179.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.87 -39.95 63.03 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 112.625 0.602 . . . . 36.780000000000001 112.625 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -89.03 3.52 5.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.426 0.631 . . . . 36.899999999999999 112.113 -177.299 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 72.56 29.46 65.72 Favored Glycine 0 CA--C 1.505 -0.561 0 CA-C-N 115.32 -0.854 . . . . 34.659999999999997 113.689 178.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.46 ' HA3' ' CD1' ' A' ' 86' ' ' TRP . . . 75.76 -3.01 52.3 Favored Glycine 0 C--N 1.334 0.438 0 O-C-N 123.97 0.453 . . . . 39.210000000000001 111.971 179.789 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -80.84 92.94 6.17 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.748 0.309 . . . . 47.289999999999999 110.828 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.26 -49.56 42.87 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.376 -0.829 . . . . 34.780000000000001 111.459 178.78 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.429 HD22 ' HA ' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -55.98 -16.31 4.66 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 116.725 2.12 . . . . 48.909999999999997 116.725 -179.164 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -99.65 5.48 45.82 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 114.49 1.292 . . . . 35.770000000000003 114.49 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.9 mt -69.47 123.83 22.3 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 106.731 -1.581 . . . . 44.619999999999997 106.731 177.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 7.4 p -84.54 157.06 21.37 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 117.775 2.509 . . . . 52.68 117.775 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.468 ' NH1' HG12 ' A' ' 69' ' ' VAL . 15.5 tpt85 -91.56 118.77 30.9 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 113.594 -1.639 . . . . 67.780000000000001 108.136 178.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -56.01 105.24 0.43 Allowed Glycine 0 C--N 1.333 0.4 0 CA-C-N 116.0 -0.546 . . . . 63.109999999999999 113.805 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -43.58 -41.05 4.35 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 115.514 1.672 . . . . 76.629999999999995 115.514 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -79.74 -28.89 40.43 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.626 0.972 . . . . 76.849999999999994 113.626 -179.916 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.742 HG11 ' HB1' ' A' ' 105' ' ' ALA . 0.3 OUTLIER -56.56 124.59 10.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.427 0.632 . . . . 60.960000000000001 109.714 -179.839 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' MET . . . . . 0.559 ' HB3' ' O ' ' A' ' 135' ' ' HOH . 0.0 OUTLIER -115.41 129.93 56.73 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.685 -0.689 . . . . 62.07 109.398 -177.883 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 31.7 m -122.91 144.38 42.85 Favored Pre-proline 0 CA--C 1.503 -0.844 0 CA-C-N 115.474 -0.785 . . . . 41.850000000000001 109.908 -178.125 -78.615 -58.74 -95.229 103.35 2.021 103.589 -77.938 178.577 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -66.01 148.53 85.79 Favored 'Trans proline' 0 N--CA 1.479 0.638 0 C-N-CA 123.541 2.827 . . . . 37.030000000000001 107.853 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 25.0 mmt -80.92 63.81 5.44 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 115.257 1.577 . . . . 46.109999999999999 115.257 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.426 HG12 ' N ' ' A' ' 75' ' ' TYR . 71.1 t -95.48 156.8 3.19 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.597 0 N-CA-C 107.682 -1.229 . . . . 26.780000000000001 107.682 177.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.426 ' N ' HG12 ' A' ' 74' ' ' VAL . 89.9 t80 -123.79 85.2 2.38 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 105.579 -2.008 . . . . 30.440000000000001 105.579 174.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -132.93 80.84 59.5 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 102.38 -3.193 . . . . 27.030000000000001 102.38 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.32 149.56 22.41 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 123.687 2.925 . . . . 31.870000000000001 116.719 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.48 HG22 HG22 ' A' ' 16' ' ' VAL . 1.4 p -142.47 125.1 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 114.006 -1.452 . . . . 30.5 107.69 -179.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.2 tp -91.92 125.5 36.64 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-O 120.94 0.4 . . . . 28.420000000000002 110.782 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 94' ' ' GLU . 2.6 tp -108.65 127.26 53.81 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.987 -0.745 . . . . 24.960000000000001 108.987 177.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.4 p -121.19 149.41 42.86 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 109.412 -0.588 . . . . 22.870000000000001 109.412 175.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.4 t -142.41 123.27 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.194 0.998 . . . . 21.670000000000002 108.812 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -134.44 157.98 45.06 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.563 -0.29 . . . . 29.800000000000001 111.488 -179.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 129.13 -147.06 17.56 Favored Glycine 0 C--O 1.24 0.499 0 C-N-CA 120.686 -0.769 . . . . 27.949999999999999 113.569 179.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.3 m -127.22 132.42 69.66 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 113.759 1.022 . . . . 30.210000000000001 113.759 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TRP . . . . . 0.46 ' CD1' ' HA3' ' A' ' 58' ' ' GLY . 76.3 t-105 -116.71 110.26 18.22 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.164 -1.05 . . . . 28.530000000000001 108.164 175.607 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 51.78 55.28 9.55 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.651 0.611 . . . . 59.859999999999999 112.651 -178.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 75.05 -3.98 42.2 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 117.126 1.61 . . . . 21.48 117.126 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.9 ttmm -110.52 133.81 52.95 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.052 -0.659 . . . . 53.299999999999997 110.939 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.0 mtt180 -66.68 134.97 53.33 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.085 0.469 . . . . 40.640000000000001 111.811 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 33.6 t -116.14 139.91 40.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 114.627 -1.169 . . . . 31.649999999999999 110.404 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.5 t -158.93 96.39 1.34 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 104.627 -2.36 . . . . 30.75 104.627 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -133.62 150.0 51.59 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 124.309 1.006 . . . . 31.82 113.253 -175.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.453 ' HA ' ' O ' ' A' ' 80' ' ' LEU . 9.8 pt-20 -158.61 138.74 12.27 Favored 'General case' 0 CA--C 1.492 -1.28 0 N-CA-C 106.269 -1.752 . . . . 35.380000000000003 106.269 178.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.663 ' HD3' ' CZ ' ' A' ' 97' ' ' PHE . 34.2 ttt180 -145.66 142.83 29.4 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 124.474 1.109 . . . . 54.340000000000003 109.75 -178.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 10.1 m -101.65 127.5 54.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 107.36 -1.348 . . . . 28.449999999999999 107.36 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.663 ' CZ ' ' HD3' ' A' ' 95' ' ' ARG . 83.2 m-85 -101.92 156.71 17.36 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.829 -0.804 . . . . 28.73 108.829 177.648 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 95.2 p -67.83 -25.99 65.84 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 120.44 0.162 . . . . 30.73 111.033 -179.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -173.17 153.47 2.49 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 116.169 -0.469 . . . . 42.380000000000003 110.091 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -46.31 -41.8 13.76 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 115.721 1.749 . . . . 59.119999999999997 115.721 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 44.0 t -57.66 -32.08 66.94 Favored 'General case' 0 CA--C 1.503 -0.848 0 O-C-N 121.966 -0.459 . . . . 36.090000000000003 110.575 -179.331 178.577 -77.938 -95.229 103.589 2.021 103.35 -58.74 -78.615 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -75.88 -44.29 41.28 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.757 -1.11 . . . . 50.689999999999998 109.372 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 64.2 ttp -58.35 -52.3 66.2 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.125 -0.694 . . . . 32.100000000000001 109.125 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -66.0 -3.93 6.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.609 -0.723 . . . . 31.789999999999999 112.876 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.742 ' HB1' HG11 ' A' ' 69' ' ' VAL . . . -98.01 -5.15 34.65 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 112.572 0.582 . . . . 34.560000000000002 112.572 -179.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.458 ' ND1' ' HE2' ' A' ' 97' ' ' PHE . 39.9 m80 -97.84 105.43 17.57 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 106.914 -1.513 . . . . 46.68 106.914 178.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.3 129.57 0.42 Allowed Glycine 0 C--O 1.239 0.431 0 N-CA-C 106.913 -2.475 . . . . 51.469999999999999 106.913 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.5 p -46.16 -51.16 14.6 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 118.397 2.74 . . . . 48.359999999999999 118.397 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.7 m -135.11 1.71 2.99 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 119.895 3.294 . . . . 50.460000000000001 119.895 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.458 HG22 ' CB ' ' A' ' 52' ' ' ASP . 2.0 t -56.01 -59.41 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-O 121.548 0.689 . . . . 40.799999999999997 110.079 179.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -91.07 -2.68 57.58 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 115.919 1.822 . . . . 38.759999999999998 115.919 -178.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -81.46 79.46 8.06 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.007 -0.677 . . . . 38.990000000000002 110.642 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 42.6 p90 . . . . . 0 C--O 1.26 1.615 0 N-CA-C 106.861 -1.533 . . . . 32.799999999999997 106.861 178.415 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . 0.491 ' O ' ' HA ' ' A' ' 40' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . 0.559 ' O ' ' HB3' ' A' ' 70' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_