data_6jza_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6jza _Structure_validation_residue.Date_analyzed 2019-08-16 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 ' 18' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo . . . . . 0 C--O 1.24 0.614 0 N-CA-C 111.262 -0.322 . . . . 66.05 111.262 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 p90 -110.49 160.67 16.41 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 124.499 1.12 . . . . 71.38 111.116 173.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.15 131.64 51.14 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.27 1.028 . . . . 77.74 110.608 176.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 -87.75 139.51 31.27 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 110.409 -0.219 . . . . 104.57 110.409 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -45.13 142.33 5.85 Favored 'Trans proline' 0 C--N 1.358 1.056 1 C-N-CA 125.48 4.12 . . . . 57.97 115.273 -169.572 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.53 155.81 23.13 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 118.04 0.382 . . . . 53.06 110.868 176.446 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.1 t -105.24 156.39 18.17 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.952 1.093 . . . . 59.36 113.952 176.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LYS . . . . . 0.503 ' NZ ' ' O ' ' A' ' 40' ' ' CYS . 46.5 pttt -90.95 -6.81 53.57 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 115.505 -0.771 . . . . 51.32 112.742 175.404 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 60.5 p -45.93 -42.22 12.54 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 122.398 0.279 . . . . 67.74 111.459 178.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -65.2 -50.47 65.77 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.107 0.41 . . . . 79.45 112.107 179.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.2 mm -66.76 -30.6 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 109.835 -0.431 . . . . 46.34 109.835 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.6 m -100.26 14.57 30.49 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 115.417 1.636 . . . . 48.53 115.417 -174.061 -82.769 -72.506 -79.508 114.893 2.028 100.122 -97.37 179.576 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . 0.802 ' O ' ' O ' ' A' ' 101' ' ' HOH . . . -100.88 141.11 34.22 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 106.802 -1.555 . . . . 53.11 106.802 167.655 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -106.29 99.95 9.51 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 102.137 -3.282 . . . . 61.3 102.137 -18.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 55.0 t -94.13 138.74 19.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.716 -1.129 . . . . 43.97 109.776 -173.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -107.17 116.37 31.81 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 119.047 -1.061 . . . . 44.21 110.715 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.2 m -117.43 133.89 55.46 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 107.804 -1.184 . . . . 45.23 107.804 169.903 -55.152 -66.727 -80.37 99.497 2.043 106.357 -70.414 -56.955 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.12 179.25 1.19 Allowed Glycine 0 C--O 1.245 0.804 0 CA-C-O 122.087 0.826 . . . . 56.65 114.7 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.48 137.64 57.56 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 109.248 -0.649 . . . . 49.08 109.248 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.54 -4.78 85.8 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.68 -0.772 . . . . 41.64 111.777 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.1 152.78 43.92 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.438 -0.578 . . . . 47.5 109.438 176.301 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -138.48 179.34 6.52 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.585 -0.895 . . . . 60.51 108.585 175.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' CYS . . . . . 0.503 ' O ' ' NZ ' ' A' ' 25' ' ' LYS . 50.6 t -104.21 136.9 42.95 Favored 'General case' 0 C--O 1.248 0.994 0 C-N-CA 118.48 -1.288 . . . . 45.17 113.003 -177.315 179.576 -97.37 -79.508 100.122 2.028 114.893 -72.506 -82.769 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -137.89 175.84 9.24 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.407 -0.815 . . . . 39.54 108.824 178.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.2 t -110.84 123.85 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 O-C-N 123.282 0.364 . . . . 39.17 111.193 -174.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.8 p -71.48 175.6 5.38 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 119.398 -0.334 . . . . 46.31 110.225 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -64.33 -18.84 65.02 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 121.128 0.49 . . . . 57.37 112.078 177.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . 0.652 ' NZ ' ' O ' ' A' ' 104' ' ' HOH . 50.3 mttt -88.62 5.02 44.93 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.019 0.748 . . . . 63.45 113.019 178.598 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 76.15 19.12 78.86 Favored Glycine 0 C--N 1.337 0.594 0 N-CA-C 115.801 1.08 . . . . 57.05 115.801 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -118.55 152.49 51.2 Favored Pre-proline 0 N--CA 1.465 0.312 0 CA-C-N 117.091 0.446 . . . . 71.08 110.585 -177.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -73.26 140.4 30.63 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.752 2.301 . . . . 41.57 115.593 -175.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.308 0.0 OUTLIER -135.78 167.01 21.95 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 108.115 -1.069 . . . . 41.95 108.115 169.094 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 63.1 m -101.77 133.44 46.5 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.382 -1.281 . . . . 43.05 109.253 166.901 -56.955 -70.414 -80.37 106.357 2.043 99.497 -66.727 -55.152 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -135.18 166.25 23.53 Favored 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 106.773 -1.566 . . . . 48.63 106.773 171.95 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 64.0 m -51.77 140.56 18.98 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 115.727 -0.67 . . . . 41.13 110.501 176.136 -57.279 -40.044 -85.249 112.846 2.029 105.14 -85.652 -174.314 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 5.2 mt -67.88 134.56 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 107.975 -1.121 . . . . 41.15 107.975 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.8 tp10 -63.54 -60.19 3.66 Favored 'General case' 0 C--O 1.241 0.636 0 O-C-N 123.355 0.409 . . . . 45.06 111.174 -177.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 108' ' ' HOH . 8.6 tp-100 -133.1 128.99 37.36 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 108.885 -0.784 . . . . 56.6 108.885 176.507 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 91.1 m -79.2 144.06 34.77 Favored 'General case' 0 C--O 1.242 0.696 0 N-CA-C 107.862 -1.162 . . . . 37.71 107.862 175.719 -70.181 -75.162 -78.574 99.59 2.039 109.975 -77.515 172.407 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -61.83 125.61 85.31 Favored Pre-proline 0 C--O 1.242 0.659 0 N-CA-C 107.433 -1.321 . . . . 49.32 107.433 171.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -81.11 53.21 4.66 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.977 2.451 . . . . 41.91 110.981 -172.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HIS . . . . . 0.74 ' ND1' ' O ' ' A' ' 102' ' ' HOH . 31.5 m80 -72.15 141.1 49.12 Favored 'General case' 0 C--O 1.241 0.644 0 N-CA-C 107.319 -1.363 . . . . 38.74 107.319 167.907 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -88.98 101.42 14.07 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.458 -0.941 . . . . 66.07 108.458 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.4 mpp_? -145.39 64.5 10.76 Favored Pre-proline 0 CA--C 1.505 -0.753 0 N-CA-C 108.53 -0.915 . . . . 39.6 108.53 -177.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -52.53 157.58 6.95 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.767 1.645 . . . . 33.92 112.225 -166.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -155.39 145.5 12.86 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 109.027 -0.731 . . . . 49.65 109.027 -173.856 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.4 t -107.16 127.46 53.52 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.221 0.823 . . . . 53.89 113.221 -179.313 175.777 80.148 92.679 100.13 2.045 114.799 -48.372 -72.997 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -91.59 158.15 25.08 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.087 -0.577 . . . . 50.43 113.217 -173.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.5 p -55.82 -34.36 65.29 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.45 -0.574 . . . . 57.33 109.45 173.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 46.1 p-10 -67.36 3.16 1.35 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.538 0.94 . . . . 59.3 113.538 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.65 4.26 89.26 Favored Glycine 0 C--O 1.242 0.634 0 C-N-CA 120.967 -0.635 . . . . 51.18 114.552 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -97.31 154.1 17.64 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.069 -0.652 . . . . 65.58 112.102 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.2 m -100.22 130.95 46.4 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.6 -0.518 . . . . 52.51 109.6 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -115.38 152.79 32.19 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 117.925 0.33 . . . . 48.0 111.71 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 40.6 tp -59.99 -32.56 70.96 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 116.321 -0.4 . . . . 38.17 111.698 -177.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -165.18 178.91 6.64 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.332 -0.547 . . . . 38.91 111.81 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -62.24 -50.31 72.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.952 -0.567 . . . . 41.54 110.168 -175.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 27.6 t -51.61 -45.11 63.1 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.7 1.0 . . . . 39.91 113.7 177.826 172.407 -77.515 -78.574 109.975 2.039 99.59 -75.162 -70.181 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -62.71 -33.26 74.74 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.65 0.982 . . . . 45.28 113.65 -177.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.5 tt -67.73 -41.35 83.6 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.166 0.508 . . . . 37.24 110.046 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -84.43 -27.77 27.32 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 120.418 -0.513 . . . . 41.29 111.03 -174.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 69.7 ttt-85 -64.01 -43.12 96.59 Favored 'General case' 0 C--O 1.241 0.605 0 N-CA-C 108.205 -1.035 . . . . 42.75 108.205 175.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -61.39 -41.55 97.3 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 109.199 -0.667 . . . . 51.66 109.199 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.16 -41.38 92.68 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.463 0.649 . . . . 44.86 109.586 -178.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 48.7 t -68.89 -31.38 70.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.446 -1.252 . . . . 46.18 113.31 -179.362 -174.314 -85.652 -85.249 105.14 2.029 112.846 -40.044 -57.279 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 60.6 mt -80.07 -23.46 41.33 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 120.865 -0.334 . . . . 40.58 111.465 -177.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' THR . . . . . 0.402 ' OG1' ' OG ' ' A' ' 86' ' ' SER . 71.4 p -110.04 -5.27 15.46 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.958 -0.565 . . . . 49.94 110.974 -172.809 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 61.7 17.1 53.33 Favored Glycine 0 CA--C 1.523 0.563 0 O-C-N 123.356 0.41 . . . . 52.43 113.091 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . 0.402 ' OG ' ' OG1' ' A' ' 84' ' ' THR . 14.6 p -91.49 177.33 6.26 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 112.709 0.633 . . . . 66.84 112.709 -178.967 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -107.2 72.39 0.87 Allowed 'General case' 0 C--O 1.238 0.499 0 CA-C-N 114.671 -1.149 . . . . 87.93 111.746 -174.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -98.02 140.62 17.63 Favored 'Isoleucine or valine' 0 C--O 1.245 0.838 0 CA-C-O 121.247 0.546 . . . . 57.85 109.995 176.254 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -141.32 161.46 37.83 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 106.978 -1.49 . . . . 63.43 106.978 168.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.5 t -73.62 125.29 32.47 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 N-CA-C 108.302 -0.999 . . . . 52.82 108.302 173.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.2 p30 -96.5 -31.3 12.86 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 118.071 -1.451 . . . . 85.1 113.489 168.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -156.36 155.46 32.24 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.595 0.591 . . . . 57.48 112.595 170.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.1 p30 -86.8 170.99 11.22 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.763 1.764 . . . . 47.74 115.763 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 79.03 -177.91 53.93 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 109.585 -1.406 . . . . 46.28 109.585 -170.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -68.82 154.38 42.09 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.274 1.037 . . . . 51.12 111.46 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 64.9 m -59.67 165.02 3.22 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.039 0.212 . . . . 59.14 111.034 172.357 -72.997 -48.372 92.679 114.799 2.045 100.13 80.148 175.777 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 162.92 9.3 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.765 1.394 . . . . 96.41 114.765 -177.131 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 113.628 0.973 . . . . 96.2 113.628 174.895 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . 0.802 ' O ' ' O ' ' A' ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . 0.74 ' O ' ' ND1' ' A' ' 59' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . 0.652 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.445 ' O ' ' NE2' ' A' ' 55' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo . . . . . 0 C--O 1.24 0.614 0 N-CA-C 111.262 -0.322 . . . . 66.05 111.262 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 p90 -110.49 160.67 16.41 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 124.499 1.12 . . . . 71.38 111.116 173.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.15 131.64 51.14 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.27 1.028 . . . . 77.74 110.608 176.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 -87.75 139.51 31.27 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 110.409 -0.219 . . . . 104.57 110.409 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -45.13 142.33 5.85 Favored 'Trans proline' 0 C--N 1.358 1.056 1 C-N-CA 125.48 4.12 . . . . 57.97 115.273 -169.572 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.53 155.81 23.13 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 118.04 0.382 . . . . 53.06 110.868 176.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.1 t -105.24 156.39 18.17 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.952 1.093 . . . . 59.36 113.952 176.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -90.95 -6.81 53.57 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 115.505 -0.771 . . . . 51.32 112.742 175.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 60.5 p -45.93 -42.22 12.54 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 122.398 0.279 . . . . 67.74 111.459 178.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -65.2 -50.47 65.77 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.107 0.41 . . . . 79.45 112.107 179.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.2 mm -66.76 -30.6 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 109.835 -0.431 . . . . 46.34 109.835 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.6 m -100.26 14.57 30.49 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 115.417 1.636 . . . . 48.53 115.417 -174.061 -82.769 -72.506 -79.508 114.893 2.028 100.122 -97.37 179.576 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . 0.802 ' O ' ' O ' ' A' ' 101' ' ' HOH . . . -100.88 141.11 34.22 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 106.802 -1.555 . . . . 53.11 106.802 167.655 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASN . . . . . 0.423 ' HA ' ' HA ' ' A' ' 30' ' ' ALA . 4.2 p-10 -106.29 99.95 9.51 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 102.137 -3.282 . . . . 61.3 102.137 -18.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 55.0 t -94.13 138.74 19.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.716 -1.129 . . . . 43.97 109.776 -173.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -107.17 116.37 31.81 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 119.047 -1.061 . . . . 44.21 110.715 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.2 m -117.43 133.89 55.46 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 107.804 -1.184 . . . . 45.23 107.804 169.903 -55.152 -66.727 -80.37 99.497 2.043 106.357 -70.414 -56.955 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.12 179.25 1.19 Allowed Glycine 0 C--O 1.245 0.804 0 CA-C-O 122.087 0.826 . . . . 56.65 114.7 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.48 137.64 57.56 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 109.248 -0.649 . . . . 49.08 109.248 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.54 -4.78 85.8 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.68 -0.772 . . . . 41.64 111.777 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.1 152.78 43.92 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.438 -0.578 . . . . 47.5 109.438 176.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -138.48 179.34 6.52 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.585 -0.895 . . . . 60.51 108.585 175.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 50.6 t -104.21 136.9 42.95 Favored 'General case' 0 C--O 1.248 0.994 0 C-N-CA 118.48 -1.288 . . . . 45.17 113.003 -177.315 179.576 -97.37 -79.508 100.122 2.028 114.893 -72.506 -82.769 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . 0.776 ' HB3' HD21 ' A' ' 51' ' ' LEU . . . -137.89 175.84 9.24 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.407 -0.815 . . . . 39.54 108.824 178.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.2 t -110.84 123.85 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 O-C-N 123.282 0.364 . . . . 39.17 111.193 -174.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.8 p -71.48 175.6 5.38 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 119.398 -0.334 . . . . 46.31 110.225 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -64.33 -18.84 65.02 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 121.128 0.49 . . . . 57.37 112.078 177.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . 0.652 ' NZ ' ' O ' ' A' ' 104' ' ' HOH . 50.3 mttt -88.62 5.02 44.93 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.019 0.748 . . . . 63.45 113.019 178.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 76.15 19.12 78.86 Favored Glycine 0 C--N 1.337 0.594 0 N-CA-C 115.801 1.08 . . . . 57.05 115.801 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -118.55 152.49 51.2 Favored Pre-proline 0 N--CA 1.465 0.312 0 CA-C-N 117.091 0.446 . . . . 71.08 110.585 -177.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -73.26 140.4 30.63 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.752 2.301 . . . . 41.57 115.593 -175.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.308 0.0 OUTLIER -135.78 167.01 21.95 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 108.115 -1.069 . . . . 41.95 108.115 169.094 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 63.1 m -101.77 133.44 46.5 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.382 -1.281 . . . . 43.05 109.253 166.901 -56.955 -70.414 -80.37 106.357 2.043 99.497 -66.727 -55.152 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . 0.776 HD21 ' HB3' ' A' ' 41' ' ' ALA . 0.2 OUTLIER -135.18 166.25 23.53 Favored 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 106.773 -1.566 . . . . 48.63 106.773 171.95 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 64.0 m -51.77 140.56 18.98 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 115.727 -0.67 . . . . 41.13 110.501 176.136 -57.279 -40.044 -85.249 112.846 2.029 105.14 -85.652 -174.314 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 5.2 mt -67.88 134.56 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 107.975 -1.121 . . . . 41.15 107.975 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.8 tp10 -63.54 -60.19 3.66 Favored 'General case' 0 C--O 1.241 0.636 0 O-C-N 123.355 0.409 . . . . 45.06 111.174 -177.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 108' ' ' HOH . 8.6 tp-100 -133.1 128.99 37.36 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 108.885 -0.784 . . . . 56.6 108.885 176.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 91.1 m -79.2 144.06 34.77 Favored 'General case' 0 C--O 1.242 0.696 0 N-CA-C 107.862 -1.162 . . . . 37.71 107.862 175.719 -70.181 -75.162 -78.574 99.59 2.039 109.975 -77.515 172.407 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -61.83 125.61 85.31 Favored Pre-proline 0 C--O 1.242 0.659 0 N-CA-C 107.433 -1.321 . . . . 49.32 107.433 171.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -81.11 53.21 4.66 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.977 2.451 . . . . 41.91 110.981 -172.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HIS . . . . . 0.74 ' ND1' ' O ' ' A' ' 102' ' ' HOH . 31.5 m80 -72.15 141.1 49.12 Favored 'General case' 0 C--O 1.241 0.644 0 N-CA-C 107.319 -1.363 . . . . 38.74 107.319 167.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -88.98 101.42 14.07 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.458 -0.941 . . . . 66.07 108.458 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.4 mpp_? -145.39 64.5 10.76 Favored Pre-proline 0 CA--C 1.505 -0.753 0 N-CA-C 108.53 -0.915 . . . . 39.6 108.53 -177.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -52.53 157.58 6.95 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.767 1.645 . . . . 33.92 112.225 -166.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -155.39 145.5 12.86 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 109.027 -0.731 . . . . 49.65 109.027 -173.856 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.4 t -107.16 127.46 53.52 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.221 0.823 . . . . 53.89 113.221 -179.313 175.777 80.148 92.679 100.13 2.045 114.799 -48.372 -72.997 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -91.59 158.15 25.08 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.087 -0.577 . . . . 50.43 113.217 -173.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.5 p -55.82 -34.36 65.29 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.45 -0.574 . . . . 57.33 109.45 173.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 46.1 p-10 -67.36 3.16 1.35 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.538 0.94 . . . . 59.3 113.538 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.65 4.26 89.26 Favored Glycine 0 C--O 1.242 0.634 0 C-N-CA 120.967 -0.635 . . . . 51.18 114.552 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -97.31 154.1 17.64 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.069 -0.652 . . . . 65.58 112.102 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.2 m -100.22 130.95 46.4 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.6 -0.518 . . . . 52.51 109.6 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -115.38 152.79 32.19 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 117.925 0.33 . . . . 48.0 111.71 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 40.6 tp -59.99 -32.56 70.96 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 116.321 -0.4 . . . . 38.17 111.698 -177.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -165.18 178.91 6.64 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.332 -0.547 . . . . 38.91 111.81 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -62.24 -50.31 72.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.952 -0.567 . . . . 41.54 110.168 -175.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 27.6 t -51.61 -45.11 63.1 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.7 1.0 . . . . 39.91 113.7 177.826 172.407 -77.515 -78.574 109.975 2.039 99.59 -75.162 -70.181 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -62.71 -33.26 74.74 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.65 0.982 . . . . 45.28 113.65 -177.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.5 tt -67.73 -41.35 83.6 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.166 0.508 . . . . 37.24 110.046 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -84.43 -27.77 27.32 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 120.418 -0.513 . . . . 41.29 111.03 -174.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 69.7 ttt-85 -64.01 -43.12 96.59 Favored 'General case' 0 C--O 1.241 0.605 0 N-CA-C 108.205 -1.035 . . . . 42.75 108.205 175.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -61.39 -41.55 97.3 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 109.199 -0.667 . . . . 51.66 109.199 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.16 -41.38 92.68 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.463 0.649 . . . . 44.86 109.586 -178.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 48.7 t -68.89 -31.38 70.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.446 -1.252 . . . . 46.18 113.31 -179.362 -174.314 -85.652 -85.249 105.14 2.029 112.846 -40.044 -57.279 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 60.6 mt -80.07 -23.46 41.33 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 120.865 -0.334 . . . . 40.58 111.465 -177.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 71.4 p -110.04 -5.27 15.46 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.958 -0.565 . . . . 49.94 110.974 -172.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 61.7 17.1 53.33 Favored Glycine 0 CA--C 1.523 0.563 0 O-C-N 123.356 0.41 . . . . 52.43 113.091 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.6 p -91.49 177.33 6.26 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 112.709 0.633 . . . . 66.84 112.709 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -107.2 72.39 0.87 Allowed 'General case' 0 C--O 1.238 0.499 0 CA-C-N 114.671 -1.149 . . . . 87.93 111.746 -174.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -98.02 140.62 17.63 Favored 'Isoleucine or valine' 0 C--O 1.245 0.838 0 CA-C-O 121.247 0.546 . . . . 57.85 109.995 176.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -141.32 161.46 37.83 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 106.978 -1.49 . . . . 63.43 106.978 168.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.5 t -73.62 125.29 32.47 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 N-CA-C 108.302 -0.999 . . . . 52.82 108.302 173.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASP . . . . . 0.666 ' HB3' ' O ' ' A' ' 110' ' ' HOH . 8.2 p30 -96.5 -31.3 12.86 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 118.071 -1.451 . . . . 85.1 113.489 168.721 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -156.36 155.46 32.24 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.595 0.591 . . . . 57.48 112.595 170.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.1 p30 -86.8 170.99 11.22 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.763 1.764 . . . . 47.74 115.763 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 79.03 -177.91 53.93 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 109.585 -1.406 . . . . 46.28 109.585 -170.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -68.82 154.38 42.09 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.274 1.037 . . . . 51.12 111.46 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 64.9 m -59.67 165.02 3.22 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.039 0.212 . . . . 59.14 111.034 172.357 -72.997 -48.372 92.679 114.799 2.045 100.13 80.148 175.777 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 162.92 9.3 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.765 1.394 . . . . 96.41 114.765 -177.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 113.628 0.973 . . . . 96.2 113.628 174.895 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . 0.802 ' O ' ' O ' ' A' ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . 0.74 ' O ' ' ND1' ' A' ' 59' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . 0.652 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.445 ' O ' ' NE2' ' A' ' 55' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . 0.666 ' O ' ' HB3' ' A' ' 91' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 0 . 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 nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo . . . . . 0 C--O 1.24 0.614 0 N-CA-C 111.262 -0.322 . . . . 66.049999999999997 111.262 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 p90 -110.49 160.67 16.41 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 124.499 1.12 . . . . 71.379999999999995 111.116 173.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.15 131.64 51.14 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.27 1.028 . . . . 77.739999999999995 110.608 176.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 -87.75 139.51 31.27 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 110.409 -0.219 . . . . 104.56999999999999 110.409 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -45.13 142.33 5.85 Favored 'Trans proline' 0 C--N 1.358 1.056 1 C-N-CA 125.48 4.12 . . . . 57.969999999999999 115.273 -169.572 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.53 155.81 23.13 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 118.04 0.382 . . . . 53.060000000000002 110.868 176.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.1 t -105.24 156.39 18.17 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.952 1.093 . . . . 59.359999999999999 113.952 176.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -90.95 -6.81 53.57 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 115.505 -0.771 . . . . 51.32 112.742 175.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 60.5 p -45.93 -42.22 12.54 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 122.398 0.279 . . . . 67.739999999999995 111.459 178.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -65.2 -50.47 65.77 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.107 0.41 . . . . 79.450000000000003 112.107 179.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.2 mm -66.76 -30.6 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 109.835 -0.431 . . . . 46.340000000000003 109.835 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.6 m -100.26 14.57 30.49 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 115.417 1.636 . . . . 48.530000000000001 115.417 -174.061 -82.769 -72.506 -79.508 114.893 2.028 100.122 -97.37 179.576 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.802 ' O ' ' O ' ' A' ' 101' ' ' HOH . . . -100.88 141.11 34.22 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 106.802 -1.555 . . . . 53.109999999999999 106.802 167.655 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.423 ' HA ' ' HA ' ' A' ' 30' ' ' ALA . 4.2 p-10 -106.29 99.95 9.51 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 102.137 -3.282 . . . . 61.299999999999997 102.137 -18.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 55.0 t -94.13 138.74 19.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.716 -1.129 . . . . 43.969999999999999 109.776 -173.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -107.17 116.37 31.81 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 119.047 -1.061 . . . . 44.210000000000001 110.715 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.2 m -117.43 133.89 55.46 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 107.804 -1.184 . . . . 45.229999999999997 107.804 169.903 -55.152 -66.727 -80.37 99.497 2.043 106.357 -70.414 -56.955 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.12 179.25 1.19 Allowed Glycine 0 C--O 1.245 0.804 0 CA-C-O 122.087 0.826 . . . . 56.649999999999999 114.7 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.48 137.64 57.56 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 109.248 -0.649 . . . . 49.079999999999998 109.248 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.54 -4.78 85.8 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.68 -0.772 . . . . 41.640000000000001 111.777 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.1 152.78 43.92 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.438 -0.578 . . . . 47.5 109.438 176.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -138.48 179.34 6.52 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.585 -0.895 . . . . 60.509999999999998 108.585 175.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 50.6 t -104.21 136.9 42.95 Favored 'General case' 0 C--O 1.248 0.994 0 C-N-CA 118.48 -1.288 . . . . 45.170000000000002 113.003 -177.315 179.576 -97.37 -79.508 100.122 2.028 114.893 -72.506 -82.769 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.776 ' HB3' HD21 ' A' ' 51' ' ' LEU . . . -137.89 175.84 9.24 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.407 -0.815 . . . . 39.539999999999999 108.824 178.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.2 t -110.84 123.85 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 O-C-N 123.282 0.364 . . . . 39.170000000000002 111.193 -174.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.8 p -71.48 175.6 5.38 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 119.398 -0.334 . . . . 46.310000000000002 110.225 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -64.33 -18.84 65.02 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 121.128 0.49 . . . . 57.369999999999997 112.078 177.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.652 ' NZ ' ' O ' ' A' ' 104' ' ' HOH . 50.3 mttt -88.62 5.02 44.93 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.019 0.748 . . . . 63.450000000000003 113.019 178.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 76.15 19.12 78.86 Favored Glycine 0 C--N 1.337 0.594 0 N-CA-C 115.801 1.08 . . . . 57.049999999999997 115.801 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -118.55 152.49 51.2 Favored Pre-proline 0 N--CA 1.465 0.312 0 CA-C-N 117.091 0.446 . . . . 71.079999999999998 110.585 -177.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -73.26 140.4 30.63 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.752 2.301 . . . . 41.57 115.593 -175.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.308 0.0 OUTLIER -135.78 167.01 21.95 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 108.115 -1.069 . . . . 41.950000000000003 108.115 169.094 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 63.1 m -101.77 133.44 46.5 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.382 -1.281 . . . . 43.049999999999997 109.253 166.901 -56.955 -70.414 -80.37 106.357 2.043 99.497 -66.727 -55.152 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.776 HD21 ' HB3' ' A' ' 41' ' ' ALA . 0.2 OUTLIER -135.18 166.25 23.53 Favored 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 106.773 -1.566 . . . . 48.630000000000003 106.773 171.95 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 64.0 m -51.77 140.56 18.98 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 115.727 -0.67 . . . . 41.130000000000003 110.501 176.136 -57.279 -40.044 -85.249 112.846 2.029 105.14 -85.652 -174.314 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 5.2 mt -67.88 134.56 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 107.975 -1.121 . . . . 41.149999999999999 107.975 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.8 tp10 -63.54 -60.19 3.66 Favored 'General case' 0 C--O 1.241 0.636 0 O-C-N 123.355 0.409 . . . . 45.060000000000002 111.174 -177.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 108' ' ' HOH . 8.6 tp-100 -133.1 128.99 37.36 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 108.885 -0.784 . . . . 56.600000000000001 108.885 176.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 91.1 m -79.2 144.06 34.77 Favored 'General case' 0 C--O 1.242 0.696 0 N-CA-C 107.862 -1.162 . . . . 37.710000000000001 107.862 175.719 -70.181 -75.162 -78.574 99.59 2.039 109.975 -77.515 172.407 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -61.83 125.61 85.31 Favored Pre-proline 0 C--O 1.242 0.659 0 N-CA-C 107.433 -1.321 . . . . 49.32 107.433 171.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -81.11 53.21 4.66 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.977 2.451 . . . . 41.909999999999997 110.981 -172.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.74 ' ND1' ' O ' ' A' ' 102' ' ' HOH . 31.5 m80 -72.15 141.1 49.12 Favored 'General case' 0 C--O 1.241 0.644 0 N-CA-C 107.319 -1.363 . . . . 38.740000000000002 107.319 167.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -88.98 101.42 14.07 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.458 -0.941 . . . . 66.069999999999993 108.458 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.4 mpp_? -145.39 64.5 10.76 Favored Pre-proline 0 CA--C 1.505 -0.753 0 N-CA-C 108.53 -0.915 . . . . 39.600000000000001 108.53 -177.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -52.53 157.58 6.95 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.767 1.645 . . . . 33.920000000000002 112.225 -166.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -155.39 145.5 12.86 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 109.027 -0.731 . . . . 49.649999999999999 109.027 -173.856 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.4 t -107.16 127.46 53.52 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.221 0.823 . . . . 53.890000000000001 113.221 -179.313 175.777 80.148 92.679 100.13 2.045 114.799 -48.372 -72.997 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -91.59 158.15 25.08 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.087 -0.577 . . . . 50.43 113.217 -173.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.5 p -55.82 -34.36 65.29 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.45 -0.574 . . . . 57.329999999999998 109.45 173.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 46.1 p-10 -67.36 3.16 1.35 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.538 0.94 . . . . 59.299999999999997 113.538 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.65 4.26 89.26 Favored Glycine 0 C--O 1.242 0.634 0 C-N-CA 120.967 -0.635 . . . . 51.18 114.552 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -97.31 154.1 17.64 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.069 -0.652 . . . . 65.579999999999998 112.102 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.2 m -100.22 130.95 46.4 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.6 -0.518 . . . . 52.509999999999998 109.6 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -115.38 152.79 32.19 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 117.925 0.33 . . . . 48.0 111.71 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 40.6 tp -59.99 -32.56 70.96 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 116.321 -0.4 . . . . 38.170000000000002 111.698 -177.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -165.18 178.91 6.64 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.332 -0.547 . . . . 38.909999999999997 111.81 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -62.24 -50.31 72.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.952 -0.567 . . . . 41.539999999999999 110.168 -175.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 27.6 t -51.61 -45.11 63.1 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.7 1.0 . . . . 39.909999999999997 113.7 177.826 172.407 -77.515 -78.574 109.975 2.039 99.59 -75.162 -70.181 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -62.71 -33.26 74.74 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.65 0.982 . . . . 45.280000000000001 113.65 -177.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.5 tt -67.73 -41.35 83.6 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.166 0.508 . . . . 37.240000000000002 110.046 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -84.43 -27.77 27.32 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 120.418 -0.513 . . . . 41.289999999999999 111.03 -174.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 69.7 ttt-85 -64.01 -43.12 96.59 Favored 'General case' 0 C--O 1.241 0.605 0 N-CA-C 108.205 -1.035 . . . . 42.75 108.205 175.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -61.39 -41.55 97.3 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 109.199 -0.667 . . . . 51.659999999999997 109.199 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.16 -41.38 92.68 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.463 0.649 . . . . 44.859999999999999 109.586 -178.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 48.7 t -68.89 -31.38 70.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.446 -1.252 . . . . 46.18 113.31 -179.362 -174.314 -85.652 -85.249 105.14 2.029 112.846 -40.044 -57.279 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 60.6 mt -80.07 -23.46 41.33 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 120.865 -0.334 . . . . 40.579999999999998 111.465 -177.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 71.4 p -110.04 -5.27 15.46 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.958 -0.565 . . . . 49.939999999999998 110.974 -172.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 61.7 17.1 53.33 Favored Glycine 0 CA--C 1.523 0.563 0 O-C-N 123.356 0.41 . . . . 52.43 113.091 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.6 p -91.49 177.33 6.26 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 112.709 0.633 . . . . 66.840000000000003 112.709 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -107.2 72.39 0.87 Allowed 'General case' 0 C--O 1.238 0.499 0 CA-C-N 114.671 -1.149 . . . . 87.930000000000007 111.746 -174.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -98.02 140.62 17.63 Favored 'Isoleucine or valine' 0 C--O 1.245 0.838 0 CA-C-O 121.247 0.546 . . . . 57.850000000000001 109.995 176.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -141.32 161.46 37.83 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 106.978 -1.49 . . . . 63.43 106.978 168.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.5 t -73.62 125.29 32.47 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 N-CA-C 108.302 -0.999 . . . . 52.82 108.302 173.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.666 ' HB3' ' O ' ' A' ' 110' ' ' HOH . 8.2 p30 -96.5 -31.3 12.86 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 118.071 -1.451 . . . . 85.099999999999994 113.489 168.721 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -156.36 155.46 32.24 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.595 0.591 . . . . 57.479999999999997 112.595 170.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.1 p30 -86.8 170.99 11.22 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.763 1.764 . . . . 47.740000000000002 115.763 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 79.03 -177.91 53.93 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 109.585 -1.406 . . . . 46.280000000000001 109.585 -170.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -68.82 154.38 42.09 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.274 1.037 . . . . 51.119999999999997 111.46 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 64.9 m -59.67 165.02 3.22 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.039 0.212 . . . . 59.140000000000001 111.034 172.357 -72.997 -48.372 92.679 114.799 2.045 100.13 80.148 175.777 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 162.92 9.3 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.765 1.394 . . . . 96.409999999999997 114.765 -177.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 113.628 0.973 . . . . 96.200000000000003 113.628 174.895 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . 0.802 ' O ' ' O ' ' A' ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . 0.74 ' O ' ' ND1' ' A' ' 59' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . 0.652 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.445 ' O ' ' NE2' ' A' ' 55' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . 0.666 ' O ' ' HB3' ' A' ' 91' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 0 . 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 stop_ save_