data_6jck_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 6jck _Structure_validation_residue.Date_analyzed 2020-01-10 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 ' 745' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.917 0.389 . . . . 128.55 110.734 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 746' ' ' SER . . . . . . . . . . . . . 78.0 p -147.81 138.21 23.02 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.179 -1.045 . . . . 88.07 108.179 176.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 747' ' ' ILE . . . . . . . . . . . . . 16.2 pt -120.83 165.21 16.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 122.127 0.965 . . . . 75.91 109.818 -174.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 748' ' ' VAL . . . . . . . . . . . . . 4.1 t -89.5 144.36 9.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.883 -1.053 . . . . 59.47 109.158 -176.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 749' ' ' VAL . . . . . . . . . . . . . 8.0 p -129.38 137.27 57.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 108.747 -0.834 . . . . 73.33 108.747 176.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 750' ' ' ALA . . . . . . . . . . . . . . . -144.21 124.57 13.85 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.772 -1.195 . . . . 72.03 107.772 174.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 751' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -131.55 170.76 14.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.64 0.733 . . . . 55.5 109.883 -175.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 752' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -115.06 115.76 27.33 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.255 -1.387 . . . . 84.34 107.255 174.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 753' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -93.23 76.95 4.58 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.119 -1.067 . . . . 63.26 108.119 175.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 754' ' ' CYS . . . . . . . . . . . . . 30.2 p 47.73 104.44 0.0 OUTLIER 'General case' 0 C--O 1.235 0.332 0 C-N-CA 126.541 1.937 . . . . 87.22 113.2 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 CA-C-N 116.324 -0.398 . . . . 79.23 112.59 178.962 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 757' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo . . . . . 0 C--O 1.236 0.378 0 N-CA-C 112.82 0.277 . . . . 71.31 112.82 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 758' ' ' ILE . . . . . . . . . . . . . 7.0 pt 30.92 64.84 0.96 Allowed Pre-proline 0 C--O 1.24 0.583 0 C-N-CA 125.459 1.504 . . . . 90.55 110.946 -166.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 759' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -58.74 150.14 72.64 Favored 'Trans proline' 0 C--O 1.234 0.296 0 CA-C-N 119.251 0.768 . . . . 80.76 110.573 174.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 760' ' ' ASP . . . . . 0.436 ' N ' ' OD1' ' A' ' 760' ' ' ASP . 0.4 OUTLIER -53.51 139.74 30.33 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.023 -0.989 . . . . 83.78 111.755 -167.284 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 18.6 mtm105 -57.48 119.67 6.92 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.593 -0.731 . . . . 95.97 109.922 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 762' ' ' THR . . . . . . . . . . . . . 2.9 m -103.57 150.68 23.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.348 0.594 . . . . 68.95 110.119 -178.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.72 141.08 33.91 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.337 -0.616 . . . . 58.47 109.337 168.319 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 764' ' ' VAL . . . . . . . . . . . . . 52.9 t -136.37 128.96 45.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.106 -1.072 . . . . 37.81 108.106 177.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 765' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.79 147.78 22.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.62 0.724 . . . . 96.7 110.874 -178.347 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . -111.35 92.5 0.66 Allowed Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 115.45 0.94 . . . . 65.85 115.45 -171.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -122.99 47.89 1.89 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.756 1.222 . . . . 89.27 108.45 163.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 768' ' ' ALA . . . . . . . . . . . . . . . 58.18 99.51 0.02 OUTLIER 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.265 1.026 . . . . 94.16 109.009 -160.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 769' ' ' VAL . . . . . . . . . . . . . 90.2 t -60.61 128.05 21.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.251 0.548 . . . . 33.57 109.774 -176.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.07 160.06 14.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.567 0.699 . . . . 62.87 110.513 -174.725 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 30.6 tp -62.95 -42.99 99.99 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.535 -0.757 . . . . 38.68 110.841 177.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 772' ' ' GLY . . . . . . . . . . . . . . . -65.06 -34.58 90.19 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 119.992 -1.099 . . . . 46.54 112.052 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 773' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -63.67 -29.35 70.59 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 122.4 -0.47 . . . . 77.5 111.214 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 774' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -77.99 -47.31 18.8 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.736 -0.385 . . . . 73.28 111.238 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 775' ' ' LYS . . . . . 0.669 ' O ' ' NZ ' ' A' ' 781' ' ' LYS . 4.4 ptmm? -79.75 -7.32 58.57 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 113.347 0.869 . . . . 54.21 113.347 -174.481 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 776' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -72.74 -8.14 53.98 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.945 -1.102 . . . . 55.32 112.072 167.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 777' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.2 -5.39 54.15 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.099 0.56 . . . . 80.45 112.35 168.974 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 778' ' ' LEU . . . . . . . . . . . . . 9.0 mp -116.55 153.93 31.33 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.175 0.59 . . . . 72.52 110.371 -171.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.42 162.37 24.04 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.38 -0.827 . . . . 46.55 109.06 176.979 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 780' ' ' LYS . . . . . . . . . . . . . 13.6 mptt 57.82 36.89 26.83 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.615 -0.721 . . . . 64.42 111.48 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 781' ' ' LYS . . . . . 0.669 ' NZ ' ' O ' ' A' ' 775' ' ' LYS . 12.4 pttt -82.31 -142.44 0.05 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.488 -0.324 . . . . 46.67 111.059 179.09 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 782' ' ' GLY . . . . . . . . . . . . . . . 93.85 -36.42 3.75 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 122.7 0.191 . . . . 47.59 113.218 -174.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 45.6 m -121.79 14.67 10.88 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 117.193 0.497 . . . . 59.14 112.243 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -71.89 163.38 27.94 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.735 0.779 . . . . 51.41 109.982 171.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 785' ' ' ARG . . . . . 0.441 ' NH2' ' O ' ' B' ' 46' ' ' VAL . 16.8 ttt180 -142.23 129.87 21.5 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.193 -1.039 . . . . 99.47 108.193 177.015 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 786' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -113.9 137.63 51.41 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.609 0.568 . . . . 53.02 110.717 -166.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 787' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -133.72 156.27 48.25 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.298 -1.371 . . . . 82.0 107.298 170.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 788' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -144.56 123.76 12.95 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.657 -0.497 . . . . 55.08 109.657 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 789' ' ' LYS . . . . . . . . . . . . . 34.0 tttt -59.37 118.57 6.13 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.658 0.599 . . . . 55.61 110.346 -179.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 790' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.25 143.16 50.36 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 115.727 -0.67 . . . . 60.91 109.78 -174.721 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 791' ' ' VAL . . . . . . . . . . . . . 10.0 t -78.32 98.09 2.39 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.291 -1.374 . . . . 89.31 107.291 -178.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 792' ' ' SER . . . . . . . . . . . . . 1.3 t -165.96 113.84 0.93 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.868 -0.79 . . . . 101.74 108.868 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 793' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 793' ' ' ASP . 9.6 p-10 -108.92 47.54 0.91 Allowed 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.744 -0.836 . . . . 120.19 108.744 165.567 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 794' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -57.13 125.69 23.86 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 110.175 -0.305 . . . . 98.27 110.175 -176.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 795' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.888 -0.596 . . . . 94.61 112.222 -163.505 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 798' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 113.742 0.257 . . . . 75.28 113.742 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 799' ' ' VAL . . . . . . . . . . . . . 10.2 m -115.91 165.54 11.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 107.403 -1.332 . . . . 51.83 107.403 170.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 800' ' ' VAL . . . . . . . . . . . . . 5.2 m -138.07 174.31 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.107 0 CA-C-O 121.583 0.706 . . . . 40.6 109.47 -172.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 801' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -118.11 88.24 2.88 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 105.841 -1.911 . . . . 72.66 105.841 167.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -77.63 129.69 35.9 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.358 -0.383 . . . . 64.86 110.431 -176.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 803' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -71.96 132.28 44.11 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 120.697 -0.401 . . . . 52.66 110.499 -179.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 804' ' ' VAL . . . . . . . . . . . . . 44.0 t -117.81 124.49 73.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 N-CA-C 108.027 -1.101 . . . . 48.82 108.027 176.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 46.3 mtp85 -120.41 -11.58 9.11 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 114.27 1.211 . . . . 71.34 114.27 -174.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -101.31 130.52 47.49 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.02 0.827 . . . . 79.48 110.109 -175.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -61.93 -3.59 1.25 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.025 0.53 . . . . 67.76 112.273 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 808' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -117.09 -1.26 11.93 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 113.925 1.083 . . . . 55.31 113.925 -176.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -74.84 142.64 44.14 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 119.127 0.876 . . . . 44.14 111.122 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 810' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.03 138.27 23.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-N 115.705 -0.68 . . . . 77.39 109.541 170.492 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 811' ' ' LEU . . . . . . . . . . . . . 59.0 mt -87.27 133.64 38.21 Favored Pre-proline 0 C--N 1.305 -1.368 0 C-N-CA 118.3 -1.36 . . . . 55.01 109.972 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -61.72 160.33 29.15 Favored 'Trans proline' 0 C--N 1.331 -0.394 0 C-N-CA 120.56 0.84 . . . . 64.9 111.414 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 813' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.23 117.04 51.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.165 -0.925 . . . . 68.5 108.558 -177.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 814' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -105.31 139.15 40.39 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.658 -0.867 . . . . 80.83 108.658 173.425 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 815' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 55.64 -102.53 0.15 Allowed 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.274 -0.639 . . . . 110.23 109.274 -175.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -139.44 30.86 2.12 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 122.864 0.466 . . . . 96.61 110.148 172.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -140.15 -170.64 3.01 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.266 -1.013 . . . . 102.55 108.266 -178.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 818' ' ' ILE . . . . . . . . . . . . . 16.5 mt -120.67 80.07 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 108.356 -0.979 . . . . 53.57 108.356 170.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 819' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.5 120.34 14.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 108.379 -0.971 . . . . 50.76 108.379 176.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 820' ' ' GLY . . . . . . . . . . . . . . . -129.71 -174.7 13.78 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.919 -0.658 . . . . 55.38 113.745 -176.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 821' ' ' LYS . . . . . 0.675 ' NZ ' ' OE2' ' B' ' 23' ' ' GLU . 33.6 ttmt -160.99 109.65 1.59 Allowed 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.699 -1.223 . . . . 58.01 107.699 -177.692 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 1.2 p -111.08 129.26 66.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 108.229 -1.026 . . . . 44.02 108.229 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 823' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -136.93 158.14 45.14 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.652 0.739 . . . . 61.67 109.825 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 824' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -96.93 152.53 18.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.177 -0.919 . . . . 133.69 110.796 -173.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 825' ' ' VAL . . . . . . . . . . . . . 27.9 m -92.67 -167.56 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.336 -0.987 . . . . 91.45 108.336 172.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 826' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 120.804 0.335 . . . . 142.89 110.686 175.276 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 . . . . . 0 C--O 1.232 0.141 0 N-CA-C 110.156 -0.313 . . . . 101.52 110.156 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 9.9 m -112.47 134.05 54.21 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.898 0.479 . . . . 92.02 109.903 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -84.49 128.39 34.56 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.871 -0.418 . . . . 85.55 109.871 174.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 93.6 t -125.68 116.73 47.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 108.206 -1.035 . . . . 97.86 108.206 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 32.8 mt -104.43 118.55 51.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 N-CA-C 107.675 -1.232 . . . . 84.94 107.675 175.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 53.4 p90 -125.51 141.18 52.18 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.006 0.432 . . . . 77.2 110.462 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -93.37 112.04 23.85 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.056 -1.09 . . . . 101.44 108.056 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 23.9 tp -80.65 120.5 24.66 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 109.627 -0.509 . . . . 76.87 109.627 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 51.51 -102.08 0.12 Allowed 'General case' 0 C--O 1.236 0.368 0 O-C-N 123.337 0.398 . . . . 101.5 110.277 -176.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -150.35 60.89 0.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 122.486 1.136 . . . . 128.1 108.454 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLU . . . . . 0.675 ' OE2' ' NZ ' ' A' ' 821' ' ' LYS . 20.0 tt0 -82.9 151.48 25.94 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.554 -0.716 . . . . 121.48 109.646 170.132 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -58.03 -61.58 2.44 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.593 -0.73 . . . . 86.22 111.198 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 64.3 m -91.74 131.46 35.66 Favored Pre-proline 0 C--N 1.322 -0.63 0 C-N-CA 123.558 0.743 . . . . 78.32 110.029 -176.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -79.15 179.66 6.25 Favored 'Trans proline' 0 C--N 1.327 -0.557 0 C-N-CA 121.01 1.14 . . . . 63.84 110.653 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 18.7 m-30 -111.92 148.78 32.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.063 -0.971 . . . . 62.11 110.223 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 44.0 tp -121.23 121.52 37.93 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.456 -0.942 . . . . 66.25 108.456 174.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -132.21 130.84 60.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.448 -0.945 . . . . 69.07 108.448 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -90.75 129.28 36.85 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.307 -0.627 . . . . 82.65 109.307 175.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ILE . . . . . . . . . . . . . 59.2 mt -107.11 122.17 42.35 Favored Pre-proline 0 C--O 1.237 0.409 0 N-CA-C 107.729 -1.211 . . . . 84.47 107.729 -178.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -71.63 36.71 0.31 Allowed 'Trans proline' 0 C--O 1.236 0.386 0 N-CA-C 114.217 0.814 . . . . 135.8 114.217 -172.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 34.3 t -118.53 121.35 31.01 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 107.701 -1.222 . . . . 106.38 107.701 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -55.29 149.69 44.52 Favored 'Trans proline' 0 C--O 1.234 0.307 0 CA-C-N 119.158 0.735 . . . . 128.74 111.73 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.67 -8.42 2.91 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.667 0.988 . . . . 129.23 113.667 -170.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -75.68 -18.52 59.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 119.02 0.827 . . . . 174.62 111.958 176.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -128.95 22.35 5.77 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.806 0.442 . . . . 147.65 112.101 -172.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 4.1 tp -75.9 107.87 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 108.815 -0.809 . . . . 119.82 108.815 -172.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 71.1 p -112.49 156.6 22.32 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.491 0.662 . . . . 136.52 111.29 -174.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 52.6 tp -57.79 -31.16 66.29 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.111 -0.949 . . . . 109.8 111.08 171.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.69 -40.28 96.31 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 120.078 -1.058 . . . . 122.86 112.464 171.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -67.7 -41.21 83.93 Favored 'General case' 0 C--O 1.238 0.472 0 O-C-N 122.201 -0.588 . . . . 160.55 111.283 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -59.27 -40.88 87.45 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.189 -0.604 . . . . 82.07 110.903 177.236 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -70.53 -41.44 72.56 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.658 -0.417 . . . . 142.68 111.407 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 51.1 m -61.94 -25.66 67.73 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.721 -0.392 . . . . 114.69 111.887 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' VAL . . . . . 0.441 ' O ' ' NH2' ' A' ' 785' ' ' ARG . 38.2 t -81.24 -54.78 9.4 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 120.975 0.417 . . . . 85.6 110.731 175.354 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' LEU . . . . . . . . . . . . . 36.7 mt -65.83 -54.92 20.45 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.963 -0.461 . . . . 112.01 111.714 -173.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 56.63 56.81 5.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 122.294 1.045 . . . . 150.68 110.497 -174.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -86.98 132.85 40.62 Favored Pre-proline 0 C--O 1.235 0.337 1 C-N-CA 134.478 5.111 . . . . 136.73 110.564 -179.365 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -58.55 149.63 74.33 Favored 'Trans proline' 0 C--N 1.332 -0.336 0 O-C-N 122.455 0.713 . . . . 184.65 111.896 174.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.95 148.53 31.16 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.93 -1.032 . . . . 233.05 111.091 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -129.83 100.29 0.48 Allowed Glycine 0 C--N 1.334 0.433 0 C-N-CA 123.496 0.569 . . . . 227.9 113.615 0.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.52 153.32 35.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.541 0.686 . . . . 187.72 110.944 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -108.46 156.62 19.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.464 -0.789 . . . . 180.66 109.888 174.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -131.03 137.58 49.24 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.455 -0.793 . . . . 156.96 110.418 -173.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -128.76 164.57 22.72 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.071 -1.085 . . . . 142.96 108.071 173.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -140.89 168.61 19.37 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.756 0.789 . . . . 137.31 110.422 -174.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -99.71 87.75 3.63 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 114.878 -1.056 . . . . 107.37 109.105 -169.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 115.764 -0.653 . . . . 116.94 110.285 173.947 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' B' ' 74' ' ' ASP . 19.6 t0 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.754 0.311 . . . . 172.54 110.364 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ASP . . . . . 0.471 ' N ' ' OD1' ' B' ' 73' ' ' ASP . 55.5 m-20 -70.08 -37.98 75.59 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.335 -0.546 . . . . 140.91 111.427 -178.924 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ASN . . . . . . . . . . . . . 31.4 m-80 -66.91 -29.64 69.58 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.177 -0.609 . . . . 151.5 111.638 178.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.43 145.76 52.55 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.698 0.761 . . . . 144.93 110.861 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 4.2 ttp-105 -84.25 173.4 11.03 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.913 0.863 . . . . 126.74 110.461 -178.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 14.7 mt -110.51 131.89 21.83 Favored Pre-proline 0 C--O 1.239 0.543 0 CA-C-N 115.544 -0.753 . . . . 124.48 110.108 179.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.56 124.73 10.04 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 120.537 0.825 . . . . 104.11 110.91 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 9.4 p -139.95 130.45 25.55 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.03 -0.532 . . . . 129.55 109.646 -177.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -106.78 131.82 53.45 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.48 -0.933 . . . . 117.71 108.48 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 54.16 35.8 23.33 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.596 0.712 . . . . 143.4 111.154 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 70.01 28.0 72.3 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 115.243 0.857 . . . . 126.65 115.243 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.28 122.58 38.12 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.046 0.923 . . . . 130.87 109.031 178.535 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 14.2 t -101.04 138.83 23.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.007 -1.109 . . . . 86.88 108.007 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.32 125.98 68.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 107.816 -1.179 . . . . 94.74 107.816 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.66 166.65 24.16 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.871 0.843 . . . . 125.57 110.809 -172.157 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -131.85 143.08 49.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 114.952 -1.022 . . . . 124.76 109.058 176.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 10.4 mp -123.18 140.79 52.66 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.893 -0.41 . . . . 98.85 109.893 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 52.9 t -129.81 124.82 59.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 108.053 -1.091 . . . . 115.76 108.053 176.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.89 0.376 . . . . 124.37 111.577 -179.337 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.917 0.389 . . . . 128.55 110.734 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 746' ' ' SER . . . . . . . . . . . . . 78.0 p -147.81 138.21 23.02 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.179 -1.045 . . . . 88.07 108.179 176.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 747' ' ' ILE . . . . . . . . . . . . . 16.2 pt -120.83 165.21 16.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 122.127 0.965 . . . . 75.91 109.818 -174.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 748' ' ' VAL . . . . . 0.481 ' HB ' ' HG2' ' A' ' 817' ' ' LYS . 4.1 t -89.5 144.36 9.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.883 -1.053 . . . . 59.47 109.158 -176.596 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 749' ' ' VAL . . . . . . . . . . . . . 8.0 p -129.38 137.27 57.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 108.747 -0.834 . . . . 73.33 108.747 176.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 750' ' ' ALA . . . . . . . . . . . . . . . -144.21 124.57 13.85 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.772 -1.195 . . . . 72.03 107.772 174.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 751' ' ' TYR . . . . . 0.414 ' O ' ' HD2' ' A' ' 759' ' ' PRO . 17.8 p90 -131.55 170.76 14.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.64 0.733 . . . . 55.5 109.883 -175.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 752' ' ' TYR . . . . . 0.422 ' HB2' ' HG3' ' A' ' 821' ' ' LYS . 3.9 m-30 -115.06 115.76 27.33 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.255 -1.387 . . . . 84.34 107.255 174.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 753' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -93.23 76.95 4.58 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.119 -1.067 . . . . 63.26 108.119 175.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 754' ' ' CYS . . . . . . . . . . . . . 30.2 p 47.73 104.44 0.0 OUTLIER 'General case' 0 C--O 1.235 0.332 0 C-N-CA 126.541 1.937 . . . . 87.22 113.2 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 CA-C-N 116.324 -0.398 . . . . 79.23 112.59 178.962 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 757' ' ' PRO . . . . . 0.624 ' HB2' ' HD3' ' A' ' 759' ' ' PRO . 32.8 Cg_exo . . . . . 0 C--O 1.236 0.378 0 N-CA-C 112.82 0.277 . . . . 71.31 112.82 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 758' ' ' ILE . . . . . . . . . . . . . 7.0 pt 30.92 64.84 0.96 Allowed Pre-proline 0 C--O 1.24 0.583 0 C-N-CA 125.459 1.504 . . . . 90.55 110.946 -166.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 759' ' ' PRO . . . . . 0.624 ' HD3' ' HB2' ' A' ' 757' ' ' PRO . 44.6 Cg_exo -58.74 150.14 72.64 Favored 'Trans proline' 0 C--O 1.234 0.296 0 CA-C-N 119.251 0.768 . . . . 80.76 110.573 174.29 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 760' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 760' ' ' ASP . 0.4 OUTLIER -53.51 139.74 30.33 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.023 -0.989 . . . . 83.78 111.755 -167.284 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 761' ' ' ARG . . . . . 0.416 HH21 HG11 ' A' ' 748' ' ' VAL . 18.6 mtm105 -57.48 119.67 6.92 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.593 -0.731 . . . . 95.97 109.922 177.062 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 762' ' ' THR . . . . . . . . . . . . . 2.9 m -103.57 150.68 23.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.348 0.594 . . . . 68.95 110.119 -178.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.72 141.08 33.91 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.337 -0.616 . . . . 58.47 109.337 168.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 764' ' ' VAL . . . . . . . . . . . . . 52.9 t -136.37 128.96 45.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.106 -1.072 . . . . 37.81 108.106 177.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 765' ' ' ARG . . . . . 0.423 ' HD2' ' H ' ' A' ' 765' ' ' ARG . 0.0 OUTLIER -56.79 147.78 22.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.62 0.724 . . . . 96.7 110.874 -178.347 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . -111.35 92.5 0.66 Allowed Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 115.45 0.94 . . . . 65.85 115.45 -171.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -122.99 47.89 1.89 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.756 1.222 . . . . 89.27 108.45 163.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 768' ' ' ALA . . . . . . . . . . . . . . . 58.18 99.51 0.02 OUTLIER 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.265 1.026 . . . . 94.16 109.009 -160.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 769' ' ' VAL . . . . . . . . . . . . . 90.2 t -60.61 128.05 21.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.251 0.548 . . . . 33.57 109.774 -176.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.07 160.06 14.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.567 0.699 . . . . 62.87 110.513 -174.725 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 771' ' ' LEU . . . . . 0.643 HD22 HG12 ' A' ' 804' ' ' VAL . 30.6 tp -62.95 -42.99 99.99 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.535 -0.757 . . . . 38.68 110.841 177.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 772' ' ' GLY . . . . . 0.438 ' HA2' ' HG2' ' A' ' 775' ' ' LYS . . . -65.06 -34.58 90.19 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 119.992 -1.099 . . . . 46.54 112.052 174.885 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 773' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -63.67 -29.35 70.59 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 122.4 -0.47 . . . . 77.5 111.214 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 774' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -77.99 -47.31 18.8 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.736 -0.385 . . . . 73.28 111.238 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 775' ' ' LYS . . . . . 0.65 ' O ' ' NZ ' ' A' ' 781' ' ' LYS . 4.4 ptmm? -79.75 -7.32 58.57 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 113.347 0.869 . . . . 54.21 113.347 -174.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 776' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -72.74 -8.14 53.98 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.945 -1.102 . . . . 55.32 112.072 167.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 777' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.2 -5.39 54.15 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.099 0.56 . . . . 80.45 112.35 168.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 778' ' ' LEU . . . . . . . . . . . . . 9.0 mp -116.55 153.93 31.33 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.175 0.59 . . . . 72.52 110.371 -171.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.42 162.37 24.04 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.38 -0.827 . . . . 46.55 109.06 176.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 780' ' ' LYS . . . . . . . . . . . . . 13.6 mptt 57.82 36.89 26.83 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.615 -0.721 . . . . 64.42 111.48 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 781' ' ' LYS . . . . . 0.65 ' NZ ' ' O ' ' A' ' 775' ' ' LYS . 12.4 pttt -82.31 -142.44 0.05 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.488 -0.324 . . . . 46.67 111.059 179.09 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 782' ' ' GLY . . . . . . . . . . . . . . . 93.85 -36.42 3.75 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 122.7 0.191 . . . . 47.59 113.218 -174.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 45.6 m -121.79 14.67 10.88 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 117.193 0.497 . . . . 59.14 112.243 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 784' ' ' TYR . . . . . 0.404 ' CD1' ' HD3' ' A' ' 824' ' ' LYS . 10.9 m-30 -71.89 163.38 27.94 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.735 0.779 . . . . 51.41 109.982 171.289 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 785' ' ' ARG . . . . . 0.415 ' NH2' ' O ' ' B' ' 46' ' ' VAL . 16.8 ttt180 -142.23 129.87 21.5 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.193 -1.039 . . . . 99.47 108.193 177.015 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 786' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -113.9 137.63 51.41 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.609 0.568 . . . . 53.02 110.717 -166.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 787' ' ' TYR . . . . . 0.466 ' HB3' ' HB3' ' A' ' 801' ' ' PHE . 29.3 m-85 -133.72 156.27 48.25 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.298 -1.371 . . . . 82.0 107.298 170.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 788' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -144.56 123.76 12.95 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.657 -0.497 . . . . 55.08 109.657 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 789' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 800' ' ' VAL . 34.0 tttt -59.37 118.57 6.13 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.658 0.599 . . . . 55.61 110.346 -179.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 790' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.25 143.16 50.36 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 115.727 -0.67 . . . . 60.91 109.78 -174.721 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 791' ' ' VAL . . . . . . . . . . . . . 10.0 t -78.32 98.09 2.39 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.291 -1.374 . . . . 89.31 107.291 -178.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 792' ' ' SER . . . . . 0.451 ' OG ' ' HG2' ' A' ' 794' ' ' GLU . 1.3 t -165.96 113.84 0.93 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.868 -0.79 . . . . 101.74 108.868 -176.363 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 793' ' ' ASP . . . . . 0.624 ' HB3' ' HA2' ' A' ' 798' ' ' GLY . 9.6 p-10 -108.92 47.54 0.91 Allowed 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.744 -0.836 . . . . 120.19 108.744 165.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 794' ' ' GLU . . . . . 0.451 ' HG2' ' OG ' ' A' ' 792' ' ' SER . 72.0 mm-40 -57.13 125.69 23.86 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 110.175 -0.305 . . . . 98.27 110.175 -176.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 795' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.888 -0.596 . . . . 94.61 112.222 -163.505 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 798' ' ' GLY . . . . . 0.624 ' HA2' ' HB3' ' A' ' 793' ' ' ASP . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 113.742 0.257 . . . . 75.28 113.742 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 799' ' ' VAL . . . . . . . . . . . . . 10.2 m -115.91 165.54 11.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 107.403 -1.332 . . . . 51.83 107.403 170.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 800' ' ' VAL . . . . . 0.475 ' O ' ' HA ' ' A' ' 789' ' ' LYS . 5.2 m -138.07 174.31 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.107 0 CA-C-O 121.583 0.706 . . . . 40.6 109.47 -172.823 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 801' ' ' PHE . . . . . 0.466 ' HB3' ' HB3' ' A' ' 787' ' ' TYR . 15.3 m-85 -118.11 88.24 2.88 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 105.841 -1.911 . . . . 72.66 105.841 167.716 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -77.63 129.69 35.9 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.358 -0.383 . . . . 64.86 110.431 -176.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 803' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -71.96 132.28 44.11 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 120.697 -0.401 . . . . 52.66 110.499 -179.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 804' ' ' VAL . . . . . 0.643 HG12 HD22 ' A' ' 771' ' ' LEU . 44.0 t -117.81 124.49 73.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 N-CA-C 108.027 -1.101 . . . . 48.82 108.027 176.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 46.3 mtp85 -120.41 -11.58 9.11 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 114.27 1.211 . . . . 71.34 114.27 -174.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -101.31 130.52 47.49 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.02 0.827 . . . . 79.48 110.109 -175.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -61.93 -3.59 1.25 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.025 0.53 . . . . 67.76 112.273 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 808' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -117.09 -1.26 11.93 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 113.925 1.083 . . . . 55.31 113.925 -176.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -74.84 142.64 44.14 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 119.127 0.876 . . . . 44.14 111.122 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 810' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.03 138.27 23.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-N 115.705 -0.68 . . . . 77.39 109.541 170.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 811' ' ' LEU . . . . . . . . . . . . . 59.0 mt -87.27 133.64 38.21 Favored Pre-proline 0 C--N 1.305 -1.368 0 C-N-CA 118.3 -1.36 . . . . 55.01 109.972 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -61.72 160.33 29.15 Favored 'Trans proline' 0 C--N 1.331 -0.394 0 C-N-CA 120.56 0.84 . . . . 64.9 111.414 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 813' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.23 117.04 51.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.165 -0.925 . . . . 68.5 108.558 -177.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 814' ' ' PHE . . . . . 0.402 ' HD1' ' N ' ' A' ' 815' ' ' GLU . 0.6 OUTLIER -105.31 139.15 40.39 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.658 -0.867 . . . . 80.83 108.658 173.425 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 815' ' ' GLU . . . . . 0.402 ' N ' ' HD1' ' A' ' 814' ' ' PHE . 19.7 tt0 55.64 -102.53 0.15 Allowed 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.274 -0.639 . . . . 110.23 109.274 -175.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -139.44 30.86 2.12 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 122.864 0.466 . . . . 96.61 110.148 172.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 817' ' ' LYS . . . . . 0.481 ' HG2' ' HB ' ' A' ' 748' ' ' VAL . 26.6 mttm -140.15 -170.64 3.01 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.266 -1.013 . . . . 102.55 108.266 -178.437 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 818' ' ' ILE . . . . . . . . . . . . . 16.5 mt -120.67 80.07 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 108.356 -0.979 . . . . 53.57 108.356 170.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 819' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.5 120.34 14.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 108.379 -0.971 . . . . 50.76 108.379 176.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 820' ' ' GLY . . . . . . . . . . . . . . . -129.71 -174.7 13.78 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.919 -0.658 . . . . 55.38 113.745 -176.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 821' ' ' LYS . . . . . 0.675 ' NZ ' ' OE2' ' B' ' 23' ' ' GLU . 33.6 ttmt -160.99 109.65 1.59 Allowed 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.699 -1.223 . . . . 58.01 107.699 -177.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 1.2 p -111.08 129.26 66.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 108.229 -1.026 . . . . 44.02 108.229 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 823' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -136.93 158.14 45.14 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.652 0.739 . . . . 61.67 109.825 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 824' ' ' LYS . . . . . 0.404 ' HD3' ' CD1' ' A' ' 784' ' ' TYR . 38.0 tptt -96.93 152.53 18.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.177 -0.919 . . . . 133.69 110.796 -173.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 825' ' ' VAL . . . . . . . . . . . . . 27.9 m -92.67 -167.56 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.336 -0.987 . . . . 91.45 108.336 172.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 826' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 120.804 0.335 . . . . 142.89 110.686 175.276 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 . . . . . 0 C--O 1.232 0.141 0 N-CA-C 110.156 -0.313 . . . . 101.52 110.156 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 9.9 m -112.47 134.05 54.21 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.898 0.479 . . . . 92.02 109.903 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . 0.605 ' HD2' HH21 ' B' ' 84' ' ' ARG . 92.7 mttt -84.49 128.39 34.56 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.871 -0.418 . . . . 85.55 109.871 174.097 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' VAL . . . . . 0.42 HG22 ' HB ' ' B' ' 85' ' ' VAL . 93.6 t -125.68 116.73 47.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 108.206 -1.035 . . . . 97.86 108.206 -177.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 32.8 mt -104.43 118.55 51.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 N-CA-C 107.675 -1.232 . . . . 84.94 107.675 175.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 53.4 p90 -125.51 141.18 52.18 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.006 0.432 . . . . 77.2 110.462 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' HIS . . . . . 0.427 ' NE2' ' HG3' ' B' ' 26' ' ' PRO . 78.5 m80 -93.37 112.04 23.85 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.056 -1.09 . . . . 101.44 108.056 173.134 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 23.9 tp -80.65 120.5 24.66 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 109.627 -0.509 . . . . 76.87 109.627 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 51.51 -102.08 0.12 Allowed 'General case' 0 C--O 1.236 0.368 0 O-C-N 123.337 0.398 . . . . 101.5 110.277 -176.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -150.35 60.89 0.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 122.486 1.136 . . . . 128.1 108.454 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLU . . . . . 0.675 ' OE2' ' NZ ' ' A' ' 821' ' ' LYS . 20.0 tt0 -82.9 151.48 25.94 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.554 -0.716 . . . . 121.48 109.646 170.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -58.03 -61.58 2.44 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.593 -0.73 . . . . 86.22 111.198 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 64.3 m -91.74 131.46 35.66 Favored Pre-proline 0 C--N 1.322 -0.63 0 C-N-CA 123.558 0.743 . . . . 78.32 110.029 -176.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' PRO . . . . . 0.427 ' HG3' ' NE2' ' B' ' 19' ' ' HIS . 2.7 Cg_endo -79.15 179.66 6.25 Favored 'Trans proline' 0 C--N 1.327 -0.557 0 C-N-CA 121.01 1.14 . . . . 63.84 110.653 178.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 18.7 m-30 -111.92 148.78 32.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.063 -0.971 . . . . 62.11 110.223 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 44.0 tp -121.23 121.52 37.93 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.456 -0.942 . . . . 66.25 108.456 174.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -132.21 130.84 60.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.448 -0.945 . . . . 69.07 108.448 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -90.75 129.28 36.85 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.307 -0.627 . . . . 82.65 109.307 175.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ILE . . . . . 0.523 HG12 HG21 ' B' ' 46' ' ' VAL . 59.2 mt -107.11 122.17 42.35 Favored Pre-proline 0 C--O 1.237 0.409 0 N-CA-C 107.729 -1.211 . . . . 84.47 107.729 -178.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -71.63 36.71 0.31 Allowed 'Trans proline' 0 C--O 1.236 0.386 0 N-CA-C 114.217 0.814 . . . . 135.8 114.217 -172.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 34.3 t -118.53 121.35 31.01 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 107.701 -1.222 . . . . 106.38 107.701 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' PRO . . . . . 0.672 ' HD2' HH21 ' B' ' 37' ' ' ARG . 77.6 Cg_exo -55.29 149.69 44.52 Favored 'Trans proline' 0 C--O 1.234 0.307 0 CA-C-N 119.158 0.735 . . . . 128.74 111.73 176.281 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.67 -8.42 2.91 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.667 0.988 . . . . 129.23 113.667 -170.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -75.68 -18.52 59.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 119.02 0.827 . . . . 174.62 111.958 176.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ARG . . . . . 0.672 HH21 ' HD2' ' B' ' 34' ' ' PRO . 56.1 mtm180 -128.95 22.35 5.77 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.806 0.442 . . . . 147.65 112.101 -172.845 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 4.1 tp -75.9 107.87 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 108.815 -0.809 . . . . 119.82 108.815 -172.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 71.1 p -112.49 156.6 22.32 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.491 0.662 . . . . 136.52 111.29 -174.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 52.6 tp -57.79 -31.16 66.29 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.111 -0.949 . . . . 109.8 111.08 171.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.69 -40.28 96.31 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 120.078 -1.058 . . . . 122.86 112.464 171.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -67.7 -41.21 83.93 Favored 'General case' 0 C--O 1.238 0.472 0 O-C-N 122.201 -0.588 . . . . 160.55 111.283 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -59.27 -40.88 87.45 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.189 -0.604 . . . . 82.07 110.903 177.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -70.53 -41.44 72.56 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.658 -0.417 . . . . 142.68 111.407 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 51.1 m -61.94 -25.66 67.73 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.721 -0.392 . . . . 114.69 111.887 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' VAL . . . . . 0.523 HG21 HG12 ' B' ' 31' ' ' ILE . 38.2 t -81.24 -54.78 9.4 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 120.975 0.417 . . . . 85.6 110.731 175.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' LEU . . . . . . . . . . . . . 36.7 mt -65.83 -54.92 20.45 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.963 -0.461 . . . . 112.01 111.714 -173.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 56.63 56.81 5.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 122.294 1.045 . . . . 150.68 110.497 -174.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ARG . . . . . 0.672 ' HD3' ' HD2' ' B' ' 50' ' ' PRO . 23.5 tpp180 -86.98 132.85 40.62 Favored Pre-proline 0 C--O 1.235 0.337 1 C-N-CA 134.478 5.111 . . . . 136.73 110.564 -179.365 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 50' ' ' PRO . . . . . 0.672 ' HD2' ' HD3' ' B' ' 49' ' ' ARG . 11.9 Cg_endo -58.55 149.63 74.33 Favored 'Trans proline' 0 C--N 1.332 -0.336 0 O-C-N 122.455 0.713 . . . . 184.65 111.896 174.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ALA . . . . . 0.448 ' HA ' ' HA2' ' B' ' 52' ' ' GLY . . . -79.95 148.53 31.16 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.93 -1.032 . . . . 233.05 111.091 -175.559 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' B' ' 51' ' ' ALA . . . -129.83 100.29 0.48 Allowed Glycine 0 C--N 1.334 0.433 0 C-N-CA 123.496 0.569 . . . . 227.9 113.615 0.458 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.52 153.32 35.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.541 0.686 . . . . 187.72 110.944 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -108.46 156.62 19.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.464 -0.789 . . . . 180.66 109.888 174.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -131.03 137.58 49.24 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.455 -0.793 . . . . 156.96 110.418 -173.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -128.76 164.57 22.72 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.071 -1.085 . . . . 142.96 108.071 173.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' PHE . . . . . 0.435 ' CZ ' HD22 ' B' ' 78' ' ' LEU . 82.6 m-85 -140.89 168.61 19.37 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.756 0.789 . . . . 137.31 110.422 -174.197 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -99.71 87.75 3.63 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 114.878 -1.056 . . . . 107.37 109.105 -169.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 115.764 -0.653 . . . . 116.94 110.285 173.947 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' B' ' 74' ' ' ASP . 19.6 t0 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.754 0.311 . . . . 172.54 110.364 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ASP . . . . . 0.471 ' N ' ' OD1' ' B' ' 73' ' ' ASP . 55.5 m-20 -70.08 -37.98 75.59 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.335 -0.546 . . . . 140.91 111.427 -178.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ASN . . . . . . . . . . . . . 31.4 m-80 -66.91 -29.64 69.58 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.177 -0.609 . . . . 151.5 111.638 178.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.43 145.76 52.55 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.698 0.761 . . . . 144.93 110.861 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 4.2 ttp-105 -84.25 173.4 11.03 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.913 0.863 . . . . 126.74 110.461 -178.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LEU . . . . . 0.435 HD22 ' CZ ' ' B' ' 57' ' ' PHE . 14.7 mt -110.51 131.89 21.83 Favored Pre-proline 0 C--O 1.239 0.543 0 CA-C-N 115.544 -0.753 . . . . 124.48 110.108 179.92 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.56 124.73 10.04 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 120.537 0.825 . . . . 104.11 110.91 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' CYS . . . . . 0.645 ' HB3' HG22 ' B' ' 85' ' ' VAL . 9.4 p -139.95 130.45 25.55 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.03 -0.532 . . . . 129.55 109.646 -177.938 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -106.78 131.82 53.45 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.48 -0.933 . . . . 117.71 108.48 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 54.16 35.8 23.33 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.596 0.712 . . . . 143.4 111.154 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 70.01 28.0 72.3 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 115.243 0.857 . . . . 126.65 115.243 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ARG . . . . . 0.605 HH21 ' HD2' ' B' ' 15' ' ' LYS . 0.1 OUTLIER -124.28 122.58 38.12 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.046 0.923 . . . . 130.87 109.031 178.535 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 85' ' ' VAL . . . . . 0.645 HG22 ' HB3' ' B' ' 80' ' ' CYS . 14.2 t -101.04 138.83 23.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.007 -1.109 . . . . 86.88 108.007 172.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.32 125.98 68.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 107.816 -1.179 . . . . 94.74 107.816 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.66 166.65 24.16 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.871 0.843 . . . . 125.57 110.809 -172.157 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -131.85 143.08 49.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 114.952 -1.022 . . . . 124.76 109.058 176.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 10.4 mp -123.18 140.79 52.66 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.893 -0.41 . . . . 98.85 109.893 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 52.9 t -129.81 124.82 59.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 108.053 -1.091 . . . . 115.76 108.053 176.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.89 0.376 . . . . 124.37 111.577 -179.337 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.917 0.389 . . . . 128.55 110.734 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 746' ' ' SER . . . . . . . . . . . . . 78.0 p -147.81 138.21 23.02 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.179 -1.045 . . . . 88.07 108.179 176.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 747' ' ' ILE . . . . . . . . . . . . . 16.2 pt -120.83 165.21 16.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 122.127 0.965 . . . . 75.91 109.818 -174.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 748' ' ' VAL . . . . . 0.481 ' HB ' ' HG2' ' A' ' 817' ' ' LYS . 4.1 t -89.5 144.36 9.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.883 -1.053 . . . . 59.47 109.158 -176.596 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 749' ' ' VAL . . . . . . . . . . . . . 8.0 p -129.38 137.27 57.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 108.747 -0.834 . . . . 73.33 108.747 176.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 750' ' ' ALA . . . . . . . . . . . . . . . -144.21 124.57 13.85 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.772 -1.195 . . . . 72.03 107.772 174.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 751' ' ' TYR . . . . . 0.414 ' O ' ' HD2' ' A' ' 759' ' ' PRO . 17.8 p90 -131.55 170.76 14.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.64 0.733 . . . . 55.5 109.883 -175.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 752' ' ' TYR . . . . . 0.422 ' HB2' ' HG3' ' A' ' 821' ' ' LYS . 3.9 m-30 -115.06 115.76 27.33 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.255 -1.387 . . . . 84.34 107.255 174.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 753' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -93.23 76.95 4.58 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.119 -1.067 . . . . 63.26 108.119 175.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 754' ' ' CYS . . . . . . . . . . . . . 30.2 p 47.73 104.44 0.0 OUTLIER 'General case' 0 C--O 1.235 0.332 0 C-N-CA 126.541 1.937 . . . . 87.22 113.2 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 CA-C-N 116.324 -0.398 . . . . 79.23 112.59 178.962 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 757' ' ' PRO . . . . . 0.624 ' HB2' ' HD3' ' A' ' 759' ' ' PRO . 32.8 Cg_exo . . . . . 0 C--O 1.236 0.378 0 N-CA-C 112.82 0.277 . . . . 71.31 112.82 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 758' ' ' ILE . . . . . . . . . . . . . 7.0 pt 30.92 64.84 0.96 Allowed Pre-proline 0 C--O 1.24 0.583 0 C-N-CA 125.459 1.504 . . . . 90.55 110.946 -166.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 759' ' ' PRO . . . . . 0.624 ' HD3' ' HB2' ' A' ' 757' ' ' PRO . 44.6 Cg_exo -58.74 150.14 72.64 Favored 'Trans proline' 0 C--O 1.234 0.296 0 CA-C-N 119.251 0.768 . . . . 80.76 110.573 174.29 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 760' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 760' ' ' ASP . 0.4 OUTLIER -53.51 139.74 30.33 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.023 -0.989 . . . . 83.78 111.755 -167.284 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 761' ' ' ARG . . . . . 0.416 HH21 HG11 ' A' ' 748' ' ' VAL . 18.6 mtm105 -57.48 119.67 6.92 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.593 -0.731 . . . . 95.97 109.922 177.062 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 762' ' ' THR . . . . . . . . . . . . . 2.9 m -103.57 150.68 23.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.348 0.594 . . . . 68.95 110.119 -178.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.72 141.08 33.91 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.337 -0.616 . . . . 58.47 109.337 168.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 764' ' ' VAL . . . . . . . . . . . . . 52.9 t -136.37 128.96 45.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.106 -1.072 . . . . 37.81 108.106 177.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 765' ' ' ARG . . . . . 0.423 ' HD2' ' H ' ' A' ' 765' ' ' ARG . 0.0 OUTLIER -56.79 147.78 22.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.62 0.724 . . . . 96.7 110.874 -178.347 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . -111.35 92.5 0.66 Allowed Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 115.45 0.94 . . . . 65.85 115.45 -171.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -122.99 47.89 1.89 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.756 1.222 . . . . 89.27 108.45 163.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 768' ' ' ALA . . . . . . . . . . . . . . . 58.18 99.51 0.02 OUTLIER 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.265 1.026 . . . . 94.16 109.009 -160.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 769' ' ' VAL . . . . . . . . . . . . . 90.2 t -60.61 128.05 21.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.251 0.548 . . . . 33.57 109.774 -176.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.07 160.06 14.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.567 0.699 . . . . 62.87 110.513 -174.725 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.643 HD22 HG12 ' A' ' 804' ' ' VAL . 30.6 tp -62.95 -42.99 99.99 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.535 -0.757 . . . . 38.68 110.841 177.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 772' ' ' GLY . . . . . 0.438 ' HA2' ' HG2' ' A' ' 775' ' ' LYS . . . -65.06 -34.58 90.19 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 119.992 -1.099 . . . . 46.54 112.052 174.885 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 773' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -63.67 -29.35 70.59 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 122.4 -0.47 . . . . 77.5 111.214 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 774' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -77.99 -47.31 18.8 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.736 -0.385 . . . . 73.28 111.238 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 775' ' ' LYS . . . . . 0.65 ' O ' ' NZ ' ' A' ' 781' ' ' LYS . 4.4 ptmm? -79.75 -7.32 58.57 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 113.347 0.869 . . . . 54.21 113.347 -174.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 776' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -72.74 -8.14 53.98 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.945 -1.102 . . . . 55.32 112.072 167.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 777' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.2 -5.39 54.15 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.099 0.56 . . . . 80.45 112.35 168.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 778' ' ' LEU . . . . . . . . . . . . . 9.0 mp -116.55 153.93 31.33 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.175 0.59 . . . . 72.52 110.371 -171.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.42 162.37 24.04 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.38 -0.827 . . . . 46.55 109.06 176.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 780' ' ' LYS . . . . . . . . . . . . . 13.6 mptt 57.82 36.89 26.83 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.615 -0.721 . . . . 64.42 111.48 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 781' ' ' LYS . . . . . 0.65 ' NZ ' ' O ' ' A' ' 775' ' ' LYS . 12.4 pttt -82.31 -142.44 0.05 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.488 -0.324 . . . . 46.67 111.059 179.09 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 782' ' ' GLY . . . . . . . . . . . . . . . 93.85 -36.42 3.75 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 122.7 0.191 . . . . 47.59 113.218 -174.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 45.6 m -121.79 14.67 10.88 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 117.193 0.497 . . . . 59.14 112.243 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 784' ' ' TYR . . . . . 0.404 ' CD1' ' HD3' ' A' ' 824' ' ' LYS . 10.9 m-30 -71.89 163.38 27.94 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.735 0.779 . . . . 51.41 109.982 171.289 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 785' ' ' ARG . . . . . 0.415 ' NH2' ' O ' ' B' ' 46' ' ' VAL . 16.8 ttt180 -142.23 129.87 21.5 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.193 -1.039 . . . . 99.47 108.193 177.015 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 786' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -113.9 137.63 51.41 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.609 0.568 . . . . 53.02 110.717 -166.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 787' ' ' TYR . . . . . 0.466 ' HB3' ' HB3' ' A' ' 801' ' ' PHE . 29.3 m-85 -133.72 156.27 48.25 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.298 -1.371 . . . . 82.0 107.298 170.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 788' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -144.56 123.76 12.95 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.657 -0.497 . . . . 55.08 109.657 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 789' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 800' ' ' VAL . 34.0 tttt -59.37 118.57 6.13 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.658 0.599 . . . . 55.61 110.346 -179.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 790' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.25 143.16 50.36 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 115.727 -0.67 . . . . 60.91 109.78 -174.721 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 791' ' ' VAL . . . . . . . . . . . . . 10.0 t -78.32 98.09 2.39 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.291 -1.374 . . . . 89.31 107.291 -178.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 792' ' ' SER . . . . . 0.451 ' OG ' ' HG2' ' A' ' 794' ' ' GLU . 1.3 t -165.96 113.84 0.93 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.868 -0.79 . . . . 101.74 108.868 -176.363 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 793' ' ' ASP . . . . . 0.624 ' HB3' ' HA2' ' A' ' 798' ' ' GLY . 9.6 p-10 -108.92 47.54 0.91 Allowed 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.744 -0.836 . . . . 120.19 108.744 165.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 794' ' ' GLU . . . . . 0.451 ' HG2' ' OG ' ' A' ' 792' ' ' SER . 72.0 mm-40 -57.13 125.69 23.86 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 110.175 -0.305 . . . . 98.27 110.175 -176.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 795' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.888 -0.596 . . . . 94.61 112.222 -163.505 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 798' ' ' GLY . . . . . 0.624 ' HA2' ' HB3' ' A' ' 793' ' ' ASP . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 113.742 0.257 . . . . 75.28 113.742 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 799' ' ' VAL . . . . . . . . . . . . . 10.2 m -115.91 165.54 11.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 107.403 -1.332 . . . . 51.83 107.403 170.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 800' ' ' VAL . . . . . 0.475 ' O ' ' HA ' ' A' ' 789' ' ' LYS . 5.2 m -138.07 174.31 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.107 0 CA-C-O 121.583 0.706 . . . . 40.6 109.47 -172.823 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 801' ' ' PHE . . . . . 0.466 ' HB3' ' HB3' ' A' ' 787' ' ' TYR . 15.3 m-85 -118.11 88.24 2.88 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 105.841 -1.911 . . . . 72.66 105.841 167.716 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -77.63 129.69 35.9 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.358 -0.383 . . . . 64.86 110.431 -176.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 803' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -71.96 132.28 44.11 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 120.697 -0.401 . . . . 52.66 110.499 -179.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 804' ' ' VAL . . . . . 0.643 HG12 HD22 ' A' ' 771' ' ' LEU . 44.0 t -117.81 124.49 73.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 N-CA-C 108.027 -1.101 . . . . 48.82 108.027 176.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 46.3 mtp85 -120.41 -11.58 9.11 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 114.27 1.211 . . . . 71.34 114.27 -174.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -101.31 130.52 47.49 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.02 0.827 . . . . 79.48 110.109 -175.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -61.93 -3.59 1.25 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.025 0.53 . . . . 67.76 112.273 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 808' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -117.09 -1.26 11.93 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 113.925 1.083 . . . . 55.31 113.925 -176.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -74.84 142.64 44.14 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 119.127 0.876 . . . . 44.14 111.122 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 810' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.03 138.27 23.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-N 115.705 -0.68 . . . . 77.39 109.541 170.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 811' ' ' LEU . . . . . . . . . . . . . 59.0 mt -87.27 133.64 38.21 Favored Pre-proline 0 C--N 1.305 -1.368 0 C-N-CA 118.3 -1.36 . . . . 55.01 109.972 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -61.72 160.33 29.15 Favored 'Trans proline' 0 C--N 1.331 -0.394 0 C-N-CA 120.56 0.84 . . . . 64.9 111.414 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 813' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.23 117.04 51.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.165 -0.925 . . . . 68.5 108.558 -177.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 814' ' ' PHE . . . . . 0.402 ' HD1' ' N ' ' A' ' 815' ' ' GLU . 0.6 OUTLIER -105.31 139.15 40.39 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.658 -0.867 . . . . 80.83 108.658 173.425 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 815' ' ' GLU . . . . . 0.402 ' N ' ' HD1' ' A' ' 814' ' ' PHE . 19.7 tt0 55.64 -102.53 0.15 Allowed 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.274 -0.639 . . . . 110.23 109.274 -175.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -139.44 30.86 2.12 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 122.864 0.466 . . . . 96.61 110.148 172.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.481 ' HG2' ' HB ' ' A' ' 748' ' ' VAL . 26.6 mttm -140.15 -170.64 3.01 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.266 -1.013 . . . . 102.55 108.266 -178.437 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 818' ' ' ILE . . . . . . . . . . . . . 16.5 mt -120.67 80.07 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 108.356 -0.979 . . . . 53.57 108.356 170.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 819' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.5 120.34 14.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 108.379 -0.971 . . . . 50.76 108.379 176.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 820' ' ' GLY . . . . . . . . . . . . . . . -129.71 -174.7 13.78 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.919 -0.658 . . . . 55.38 113.745 -176.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 821' ' ' LYS . . . . . 0.675 ' NZ ' ' OE2' ' B' ' 23' ' ' GLU . 33.6 ttmt -160.99 109.65 1.59 Allowed 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.699 -1.223 . . . . 58.01 107.699 -177.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 1.2 p -111.08 129.26 66.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 108.229 -1.026 . . . . 44.02 108.229 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 823' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -136.93 158.14 45.14 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.652 0.739 . . . . 61.67 109.825 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 824' ' ' LYS . . . . . 0.404 ' HD3' ' CD1' ' A' ' 784' ' ' TYR . 38.0 tptt -96.93 152.53 18.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.177 -0.919 . . . . 133.69 110.796 -173.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 825' ' ' VAL . . . . . . . . . . . . . 27.9 m -92.67 -167.56 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.336 -0.987 . . . . 91.45 108.336 172.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 826' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 120.804 0.335 . . . . 142.89 110.686 175.276 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 . . . . . 0 C--O 1.232 0.141 0 N-CA-C 110.156 -0.313 . . . . 101.52 110.156 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 9.9 m -112.47 134.05 54.21 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.898 0.479 . . . . 92.02 109.903 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . 0.605 ' HD2' HH21 ' B' ' 84' ' ' ARG . 92.7 mttt -84.49 128.39 34.56 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.871 -0.418 . . . . 85.55 109.871 174.097 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.42 HG22 ' HB ' ' B' ' 85' ' ' VAL . 93.6 t -125.68 116.73 47.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 108.206 -1.035 . . . . 97.86 108.206 -177.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 32.8 mt -104.43 118.55 51.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 N-CA-C 107.675 -1.232 . . . . 84.94 107.675 175.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 53.4 p90 -125.51 141.18 52.18 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.006 0.432 . . . . 77.2 110.462 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' HIS . . . . . 0.427 ' NE2' ' HG3' ' B' ' 26' ' ' PRO . 78.5 m80 -93.37 112.04 23.85 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.056 -1.09 . . . . 101.44 108.056 173.134 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 23.9 tp -80.65 120.5 24.66 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 109.627 -0.509 . . . . 76.87 109.627 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 51.51 -102.08 0.12 Allowed 'General case' 0 C--O 1.236 0.368 0 O-C-N 123.337 0.398 . . . . 101.5 110.277 -176.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -150.35 60.89 0.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 122.486 1.136 . . . . 128.1 108.454 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.675 ' OE2' ' NZ ' ' A' ' 821' ' ' LYS . 20.0 tt0 -82.9 151.48 25.94 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.554 -0.716 . . . . 121.48 109.646 170.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -58.03 -61.58 2.44 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.593 -0.73 . . . . 86.22 111.198 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 64.3 m -91.74 131.46 35.66 Favored Pre-proline 0 C--N 1.322 -0.63 0 C-N-CA 123.558 0.743 . . . . 78.32 110.029 -176.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' PRO . . . . . 0.427 ' HG3' ' NE2' ' B' ' 19' ' ' HIS . 2.7 Cg_endo -79.15 179.66 6.25 Favored 'Trans proline' 0 C--N 1.327 -0.557 0 C-N-CA 121.01 1.14 . . . . 63.84 110.653 178.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 18.7 m-30 -111.92 148.78 32.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.063 -0.971 . . . . 62.11 110.223 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 44.0 tp -121.23 121.52 37.93 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.456 -0.942 . . . . 66.25 108.456 174.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -132.21 130.84 60.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.448 -0.945 . . . . 69.07 108.448 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -90.75 129.28 36.85 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.307 -0.627 . . . . 82.65 109.307 175.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.523 HG12 HG21 ' B' ' 46' ' ' VAL . 59.2 mt -107.11 122.17 42.35 Favored Pre-proline 0 C--O 1.237 0.409 0 N-CA-C 107.729 -1.211 . . . . 84.47 107.729 -178.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -71.63 36.71 0.31 Allowed 'Trans proline' 0 C--O 1.236 0.386 0 N-CA-C 114.217 0.814 . . . . 135.8 114.217 -172.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 34.3 t -118.53 121.35 31.01 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 107.701 -1.222 . . . . 106.38 107.701 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' PRO . . . . . 0.672 ' HD2' HH21 ' B' ' 37' ' ' ARG . 77.6 Cg_exo -55.29 149.69 44.52 Favored 'Trans proline' 0 C--O 1.234 0.307 0 CA-C-N 119.158 0.735 . . . . 128.74 111.73 176.281 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.67 -8.42 2.91 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.667 0.988 . . . . 129.23 113.667 -170.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -75.68 -18.52 59.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 119.02 0.827 . . . . 174.62 111.958 176.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.672 HH21 ' HD2' ' B' ' 34' ' ' PRO . 56.1 mtm180 -128.95 22.35 5.77 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.806 0.442 . . . . 147.65 112.101 -172.845 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 4.1 tp -75.9 107.87 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 108.815 -0.809 . . . . 119.82 108.815 -172.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 71.1 p -112.49 156.6 22.32 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.491 0.662 . . . . 136.52 111.29 -174.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 52.6 tp -57.79 -31.16 66.29 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.111 -0.949 . . . . 109.8 111.08 171.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.69 -40.28 96.31 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 120.078 -1.058 . . . . 122.86 112.464 171.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -67.7 -41.21 83.93 Favored 'General case' 0 C--O 1.238 0.472 0 O-C-N 122.201 -0.588 . . . . 160.55 111.283 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -59.27 -40.88 87.45 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.189 -0.604 . . . . 82.07 110.903 177.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -70.53 -41.44 72.56 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.658 -0.417 . . . . 142.68 111.407 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 51.1 m -61.94 -25.66 67.73 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.721 -0.392 . . . . 114.69 111.887 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' VAL . . . . . 0.523 HG21 HG12 ' B' ' 31' ' ' ILE . 38.2 t -81.24 -54.78 9.4 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 120.975 0.417 . . . . 85.6 110.731 175.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' LEU . . . . . . . . . . . . . 36.7 mt -65.83 -54.92 20.45 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.963 -0.461 . . . . 112.01 111.714 -173.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 56.63 56.81 5.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 122.294 1.045 . . . . 150.68 110.497 -174.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.672 ' HD3' ' HD2' ' B' ' 50' ' ' PRO . 23.5 tpp180 -86.98 132.85 40.62 Favored Pre-proline 0 C--O 1.235 0.337 1 C-N-CA 134.478 5.111 . . . . 136.73 110.564 -179.365 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' PRO . . . . . 0.672 ' HD2' ' HD3' ' B' ' 49' ' ' ARG . 11.9 Cg_endo -58.55 149.63 74.33 Favored 'Trans proline' 0 C--N 1.332 -0.336 0 O-C-N 122.455 0.713 . . . . 184.65 111.896 174.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ALA . . . . . 0.448 ' HA ' ' HA2' ' B' ' 52' ' ' GLY . . . -79.95 148.53 31.16 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.93 -1.032 . . . . 233.05 111.091 -175.559 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' B' ' 51' ' ' ALA . . . -129.83 100.29 0.48 Allowed Glycine 0 C--N 1.334 0.433 0 C-N-CA 123.496 0.569 . . . . 227.9 113.615 0.458 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.52 153.32 35.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.541 0.686 . . . . 187.72 110.944 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -108.46 156.62 19.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.464 -0.789 . . . . 180.66 109.888 174.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -131.03 137.58 49.24 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.455 -0.793 . . . . 156.96 110.418 -173.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -128.76 164.57 22.72 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.071 -1.085 . . . . 142.96 108.071 173.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' PHE . . . . . 0.435 ' CZ ' HD22 ' B' ' 78' ' ' LEU . 82.6 m-85 -140.89 168.61 19.37 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.756 0.789 . . . . 137.31 110.422 -174.197 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -99.71 87.75 3.63 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 114.878 -1.056 . . . . 107.37 109.105 -169.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 115.764 -0.653 . . . . 116.94 110.285 173.947 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' B' ' 74' ' ' ASP . 19.6 t0 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.754 0.311 . . . . 172.54 110.364 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ASP . . . . . 0.471 ' N ' ' OD1' ' B' ' 73' ' ' ASP . 55.5 m-20 -70.08 -37.98 75.59 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.335 -0.546 . . . . 140.91 111.427 -178.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ASN . . . . . . . . . . . . . 31.4 m-80 -66.91 -29.64 69.58 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.177 -0.609 . . . . 151.5 111.638 178.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.43 145.76 52.55 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.698 0.761 . . . . 144.93 110.861 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 4.2 ttp-105 -84.25 173.4 11.03 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.913 0.863 . . . . 126.74 110.461 -178.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LEU . . . . . 0.435 HD22 ' CZ ' ' B' ' 57' ' ' PHE . 14.7 mt -110.51 131.89 21.83 Favored Pre-proline 0 C--O 1.239 0.543 0 CA-C-N 115.544 -0.753 . . . . 124.48 110.108 179.92 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.56 124.73 10.04 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 120.537 0.825 . . . . 104.11 110.91 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.645 ' HB3' HG22 ' B' ' 85' ' ' VAL . 9.4 p -139.95 130.45 25.55 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.03 -0.532 . . . . 129.55 109.646 -177.938 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -106.78 131.82 53.45 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.48 -0.933 . . . . 117.71 108.48 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 54.16 35.8 23.33 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.596 0.712 . . . . 143.4 111.154 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 70.01 28.0 72.3 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 115.243 0.857 . . . . 126.65 115.243 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ARG . . . . . 0.605 HH21 ' HD2' ' B' ' 15' ' ' LYS . 0.1 OUTLIER -124.28 122.58 38.12 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.046 0.923 . . . . 130.87 109.031 178.535 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.645 HG22 ' HB3' ' B' ' 80' ' ' CYS . 14.2 t -101.04 138.83 23.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.007 -1.109 . . . . 86.88 108.007 172.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.32 125.98 68.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 107.816 -1.179 . . . . 94.74 107.816 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.66 166.65 24.16 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.871 0.843 . . . . 125.57 110.809 -172.157 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -131.85 143.08 49.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 114.952 -1.022 . . . . 124.76 109.058 176.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 10.4 mp -123.18 140.79 52.66 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.893 -0.41 . . . . 98.85 109.893 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 52.9 t -129.81 124.82 59.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 108.053 -1.091 . . . . 115.76 108.053 176.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.89 0.376 . . . . 124.37 111.577 -179.337 . . . . . . . . 0 0 . 1 stop_ save_