data_4ulx_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 4ulx _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' 2001 ' ' HOH . 8.8 t . . . . . 0 C--O 1.23 0.076 0 CA-C-O 121.018 0.437 . . . . 52.8 110.634 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.7 t -97.25 122.35 48.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 109.294 -0.632 . . . . 34.26 109.294 173.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.9 mm -89.0 119.4 36.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.147 -0.479 . . . . 28.4 112.1 -175.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -78.58 123.67 27.35 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.689 -0.486 . . . . 36.02 109.689 175.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 83.3 t -119.88 139.7 46.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 112.376 0.509 . . . . 30.94 112.376 -170.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.3 p -116.72 178.24 4.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 38.09 111.373 179.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASP . . . . . 0.469 ' OD1' ' OG1' ' A' ' 65' ' ' THR . 75.9 m-20 -57.35 -33.16 67.47 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.49 0.662 . . . . 34.04 110.154 174.495 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -63.46 -32.21 73.59 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.853 -1.067 . . . . 57.3 113.0 -174.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -132.99 19.28 4.1 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 114.44 1.274 . . . . 34.44 114.44 -174.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -64.07 -39.61 94.44 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.176 0.436 . . . . 30.93 112.176 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.83 -45.44 89.57 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.531 0.567 . . . . 53.24 112.531 -175.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -73.27 -40.89 64.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.912 0.387 . . . . 56.23 111.537 -178.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . 0.441 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 79.9 mm-40 -77.79 -32.75 52.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.247 0.832 . . . . 33.7 113.247 -174.093 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 91.1 t -111.07 -59.32 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 113.198 0.814 . . . . 31.82 113.198 -175.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.7 mt -64.92 -31.19 72.31 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.526 0.565 . . . . 40.95 112.526 -176.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -102.33 10.47 39.12 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.408 -0.517 . . . . 41.67 111.837 -176.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.5 t -76.58 135.49 39.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.917 -0.583 . . . . 35.17 110.319 173.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -75.82 -19.95 58.54 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.043 -0.526 . . . . 51.47 111.386 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -100.91 156.96 34.53 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.515 -0.766 . . . . 45.94 110.429 176.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -58.76 145.47 96.05 Favored 'Trans proline' 0 C--N 1.342 0.197 0 O-C-N 122.613 0.796 . . . . 33.45 110.974 170.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.3 t -121.77 127.91 75.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 113.389 0.885 . . . . 29.03 113.389 -176.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.3 tp -95.75 122.31 38.39 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.336 -0.616 . . . . 25.22 109.336 170.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.4 t -112.72 114.53 47.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.726 0.298 . . . . 23.76 111.436 -176.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -94.42 106.41 18.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.27 -0.423 . . . . 29.41 110.657 177.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -83.42 129.83 35.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 26.7 110.165 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 26.0 p-90 -150.81 177.24 10.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 28.64 111.814 -172.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.57 149.57 16.29 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.288 -0.634 . . . . 31.68 109.288 175.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -41.31 -48.12 5.29 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 125.174 3.916 . . . . 56.52 116.773 -172.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -98.13 47.6 1.0 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.401 -0.52 . . . . 69.65 112.156 -174.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.3 t -116.68 98.34 6.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.96 -0.564 . . . . 40.49 111.134 179.963 -179.967 -149.751 73.738 88.742 2.033 100.975 73.765 -60.111 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -52.33 -53.34 31.96 Favored Glycine 0 CA--C 1.519 0.295 0 CA-C-N 116.042 -0.527 . . . . 35.05 114.089 176.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -57.69 -34.47 98.2 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.049 1.166 . . . . 35.15 113.32 173.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 82.3 m -62.76 -40.73 98.18 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.444 -0.576 . . . . 28.43 109.444 175.667 -60.111 73.765 73.738 100.975 2.033 88.742 -149.751 -179.967 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.8 mtm105 -64.71 -31.64 72.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.433 -0.803 . . . . 61.89 111.552 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 37.9 mtp -69.23 -33.64 73.59 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 113.649 0.981 . . . . 51.78 113.649 -175.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.2 pt -104.93 -4.59 9.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 113.718 1.007 . . . . 37.16 113.718 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.6 99.72 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.104 0.409 . . . . 31.55 112.104 177.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -68.81 -27.62 31.06 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 116.297 -2.002 . . . . 33.55 112.652 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.8 mt -67.65 -43.0 87.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 109.596 -0.52 . . . . 34.66 109.596 175.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 34.6 mm -61.83 -37.26 77.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.935 -0.575 . . . . 35.14 110.425 174.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -63.53 -43.65 96.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.232 -0.44 . . . . 47.96 112.039 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -68.3 -30.67 69.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.533 -0.303 . . . . 57.26 111.662 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.67 -42.5 99.66 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.925 0.343 . . . . 35.48 111.925 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.52 -36.83 83.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.068 -0.515 . . . . 40.99 110.56 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 12.4 tttm -67.81 -41.08 83.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.802 -0.636 . . . . 64.49 110.772 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -83.51 -19.9 34.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.856 0.687 . . . . 49.79 112.856 -174.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -108.13 11.12 27.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.487 -0.324 . . . . 46.21 111.709 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -56.67 125.21 21.24 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.839 0.681 . . . . 57.91 112.839 -175.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.67 -19.29 52.05 Favored Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.803 -0.635 . . . . 39.86 111.963 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -110.05 -45.54 3.59 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.853 0.316 . . . . 54.44 111.853 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 39.3 t -128.39 127.41 67.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.956 0.407 . . . . 31.31 111.648 177.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . 0.441 ' NZ ' ' OE1' ' A' ' 14' ' ' GLU . 85.1 tttt -81.65 136.9 35.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 28.59 109.76 174.272 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 97.6 t -121.55 123.25 69.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.453 -0.34 . . . . 22.72 111.001 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.0 m -129.34 163.75 33.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.622 0.601 . . . . 26.04 112.622 -178.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -129.19 145.92 51.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.691 -0.686 . . . . 30.33 110.503 177.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 87.1 t -132.84 118.5 33.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.374 -0.375 . . . . 27.8 111.957 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.0 t-20 -74.53 109.04 7.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.599 -0.519 . . . . 29.32 109.599 174.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.5 m -71.15 -24.97 24.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 112.09 0.404 . . . . 30.42 112.09 -175.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -65.62 -41.52 92.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.921 0.391 . . . . 40.83 111.005 178.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 81.0 mt-10 -95.65 -12.13 26.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.444 0.535 . . . . 48.74 112.444 -177.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 60.4 m-80 -127.2 68.73 73.07 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 112.068 0.396 . . . . 40.7 112.068 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -70.76 -21.53 28.71 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.713 2.276 . . . . 42.39 112.763 -174.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -69.97 -45.64 66.93 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.364 0.415 . . . . 59.91 112.111 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . 0.469 ' OG1' ' OD1' ' A' ' 8' ' ' ASP . 33.0 m -68.56 -37.72 80.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.301 -0.408 . . . . 36.51 110.563 178.043 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.07 -43.69 91.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.963 -0.562 . . . . 34.5 110.851 178.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.57 -41.49 84.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.878 -0.601 . . . . 35.51 112.12 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.4 -24.9 67.79 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.083 0.771 . . . . 66.78 113.083 -177.215 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -119.01 18.19 13.21 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.83 0.678 . . . . 37.42 112.83 -176.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 55.11 42.02 80.1 Favored Glycine 0 N--CA 1.452 -0.244 0 N-CA-C 115.38 0.912 . . . . 32.53 115.38 173.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.8 mm -71.67 100.47 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.097 -0.705 . . . . 30.94 109.097 175.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.59 -19.39 23.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.371 -0.377 . . . . 39.6 111.986 -175.452 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . 0.512 ' O ' ' OG1' ' A' ' 76' ' ' THR . 59.7 p -155.53 165.69 35.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.914 0.387 . . . . 27.68 111.717 177.344 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.1 pt -133.31 145.89 58.53 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.068 -0.515 . . . . 22.73 111.195 -178.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -76.77 138.76 55.99 Favored 'Cis proline' 0 C--N 1.343 0.282 0 O-C-N 122.361 0.664 . . . . 24.71 113.249 -0.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . 0.512 ' OG1' ' O ' ' A' ' 73' ' ' SER . 22.9 m -121.5 125.32 46.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.799 -0.637 . . . . 31.58 109.643 175.927 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.6 mt -108.09 122.71 47.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.1 -0.5 . . . . 29.95 111.339 -176.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 50.2 mt -112.7 138.64 49.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.122 -0.49 . . . . 30.39 110.652 175.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.2 tp -106.46 118.35 36.42 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.389 -0.597 . . . . 33.93 109.389 173.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -101.56 131.6 47.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.887 -0.597 . . . . 32.54 111.435 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -125.27 100.92 6.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.911 -0.586 . . . . 43.1 109.612 173.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.0 m120 56.76 55.84 5.96 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.512 0.93 . . . . 58.43 113.512 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 90.23 -2.32 81.06 Favored Glycine 0 N--CA 1.452 -0.267 0 N-CA-C 116.428 1.331 . . . . 45.88 116.428 170.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -138.71 153.06 48.48 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 117.498 0.649 . . . . 64.29 112.695 -177.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.4 t -81.24 122.95 37.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.903 -0.589 . . . . 36.65 112.086 -176.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.37 -9.27 11.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 33.91 111.819 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 101' ' ' ARG . 19.1 t0 -159.27 152.18 21.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.115 0.483 . . . . 47.78 111.128 177.299 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 41.3 ttm-85 -142.4 137.45 30.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.65 -0.704 . . . . 36.22 110.436 -177.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -152.27 125.7 8.79 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.558 -0.457 . . . . 46.61 111.735 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.3 m -108.79 153.67 10.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.193 0.52 . . . . 42.05 111.071 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 94.96 157.02 32.35 Favored Glycine 0 N--CA 1.448 -0.547 0 CA-C-N 115.847 -0.615 . . . . 39.07 113.581 176.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.72 103.28 0.54 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.985 0.421 . . . . 49.06 110.253 176.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -101.54 142.6 24.94 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.885 -0.598 . . . . 68.42 112.035 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -67.92 145.24 67.5 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 120.96 1.107 . . . . 42.89 111.994 175.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -52.03 -49.63 63.02 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 114.906 1.447 . . . . 40.91 114.906 -173.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 25.8 tp10 -69.1 -29.5 67.59 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.95 -0.3 . . . . 62.58 111.754 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.82 -37.99 79.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.677 0.275 . . . . 44.87 110.475 176.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 22.8 mt -66.89 -46.79 73.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.303 -0.408 . . . . 45.97 110.819 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt -57.77 -34.6 69.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.368 -0.378 . . . . 39.04 110.326 177.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -65.46 -44.62 86.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.002 -0.544 . . . . 52.81 109.561 176.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ARG . . . . . 0.446 ' NH2' ' OD1' ' A' ' 87' ' ' ASP . 52.4 mtp85 -68.07 -42.53 80.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.749 -0.66 . . . . 69.83 111.417 -179.603 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 90.1 mt -63.57 -50.32 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.13 -0.487 . . . . 46.04 111.541 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -51.55 -24.05 4.86 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.312 1.227 . . . . 53.49 114.312 -176.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -77.77 -9.75 59.18 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.734 0.642 . . . . 64.76 112.734 -175.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 -124.93 26.32 7.08 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.217 0.451 . . . . 65.02 112.217 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.384 -0.371 . . . . 59.43 110.944 177.944 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1107 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2001 ' ' HOH . . . . . 0.557 ' O ' ' N ' ' A' ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' 2001 ' ' HOH . 8.8 t . . . . . 0 C--O 1.23 0.076 0 CA-C-O 121.018 0.437 . . . . 52.799999999999997 110.634 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.7 t -97.25 122.35 48.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 109.294 -0.632 . . . . 34.259999999999998 109.294 173.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.9 mm -89.0 119.4 36.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.147 -0.479 . . . . 28.399999999999999 112.1 -175.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -78.58 123.67 27.35 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.689 -0.486 . . . . 36.020000000000003 109.689 175.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 83.3 t -119.88 139.7 46.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 112.376 0.509 . . . . 30.940000000000001 112.376 -170.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.3 p -116.72 178.24 4.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 38.090000000000003 111.373 179.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -57.35 -33.16 67.47 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.49 0.662 . . . . 34.039999999999999 110.154 174.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -63.46 -32.21 73.59 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.853 -1.067 . . . . 57.299999999999997 113.0 -174.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -132.99 19.28 4.1 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 114.44 1.274 . . . . 34.439999999999998 114.44 -174.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -64.07 -39.61 94.44 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.176 0.436 . . . . 30.93 112.176 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.83 -45.44 89.57 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.531 0.567 . . . . 53.240000000000002 112.531 -175.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -73.27 -40.89 64.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.912 0.387 . . . . 56.229999999999997 111.537 -178.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -77.79 -32.75 52.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.247 0.832 . . . . 33.700000000000003 113.247 -174.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 91.1 t -111.07 -59.32 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 113.198 0.814 . . . . 31.82 113.198 -175.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.7 mt -64.92 -31.19 72.31 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.526 0.565 . . . . 40.950000000000003 112.526 -176.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -102.33 10.47 39.12 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.408 -0.517 . . . . 41.670000000000002 111.837 -176.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.5 t -76.58 135.49 39.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.917 -0.583 . . . . 35.170000000000002 110.319 173.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -75.82 -19.95 58.54 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.043 -0.526 . . . . 51.469999999999999 111.386 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -100.91 156.96 34.53 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.515 -0.766 . . . . 45.939999999999998 110.429 176.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -58.76 145.47 96.05 Favored 'Trans proline' 0 C--N 1.342 0.197 0 O-C-N 122.613 0.796 . . . . 33.450000000000003 110.974 170.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.3 t -121.77 127.91 75.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 113.389 0.885 . . . . 29.030000000000001 113.389 -176.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.3 tp -95.75 122.31 38.39 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.336 -0.616 . . . . 25.219999999999999 109.336 170.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.4 t -112.72 114.53 47.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.726 0.298 . . . . 23.760000000000002 111.436 -176.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . 0.464 ' HA ' HD23 ' A' ' 77' ' ' LEU . 25.6 t0 -94.42 106.41 18.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.27 -0.423 . . . . 29.41 110.657 177.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -83.42 129.83 35.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 26.699999999999999 110.165 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 26.0 p-90 -150.81 177.24 10.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 28.640000000000001 111.814 -172.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.57 149.57 16.29 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.288 -0.634 . . . . 31.68 109.288 175.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -41.31 -48.12 5.29 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 125.174 3.916 . . . . 56.520000000000003 116.773 -172.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -98.13 47.6 1.0 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.401 -0.52 . . . . 69.650000000000006 112.156 -174.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.3 t -116.68 98.34 6.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.96 -0.564 . . . . 40.490000000000002 111.134 179.963 -179.967 -149.751 73.738 88.742 2.033 100.975 73.765 -60.111 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -52.33 -53.34 31.96 Favored Glycine 0 CA--C 1.519 0.295 0 CA-C-N 116.042 -0.527 . . . . 35.049999999999997 114.089 176.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -57.69 -34.47 98.2 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.049 1.166 . . . . 35.149999999999999 113.32 173.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 82.3 m -62.76 -40.73 98.18 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.444 -0.576 . . . . 28.43 109.444 175.667 -60.111 73.765 73.738 100.975 2.033 88.742 -149.751 -179.967 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.8 mtm105 -64.71 -31.64 72.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.433 -0.803 . . . . 61.890000000000001 111.552 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 37.9 mtp -69.23 -33.64 73.59 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 113.649 0.981 . . . . 51.780000000000001 113.649 -175.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.2 pt -104.93 -4.59 9.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 113.718 1.007 . . . . 37.159999999999997 113.718 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.6 99.72 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.104 0.409 . . . . 31.550000000000001 112.104 177.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -68.81 -27.62 31.06 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 116.297 -2.002 . . . . 33.549999999999997 112.652 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.8 mt -67.65 -43.0 87.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 109.596 -0.52 . . . . 34.659999999999997 109.596 175.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 34.6 mm -61.83 -37.26 77.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.935 -0.575 . . . . 35.140000000000001 110.425 174.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -63.53 -43.65 96.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.232 -0.44 . . . . 47.960000000000001 112.039 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -68.3 -30.67 69.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.533 -0.303 . . . . 57.259999999999998 111.662 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 44' ' ' LEU . 27.9 mt -62.67 -42.5 99.66 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.925 0.343 . . . . 35.479999999999997 111.925 -179.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.52 -36.83 83.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.068 -0.515 . . . . 40.990000000000002 110.56 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 12.4 tttm -67.81 -41.08 83.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.802 -0.636 . . . . 64.489999999999995 110.772 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -83.51 -19.9 34.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.856 0.687 . . . . 49.789999999999999 112.856 -174.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . 0.518 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 3.1 m-85 -108.13 11.12 27.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.487 -0.324 . . . . 46.210000000000001 111.709 179.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -56.67 125.21 21.24 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.839 0.681 . . . . 57.909999999999997 112.839 -175.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.67 -19.29 52.05 Favored Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.803 -0.635 . . . . 39.859999999999999 111.963 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -110.05 -45.54 3.59 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.853 0.316 . . . . 54.439999999999998 111.853 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' VAL . . . . . 0.518 ' HB ' ' HB3' ' A' ' 48' ' ' TYR . 39.3 t -128.39 127.41 67.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.956 0.407 . . . . 31.309999999999999 111.648 177.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -81.65 136.9 35.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 28.59 109.76 174.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 97.6 t -121.55 123.25 69.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.453 -0.34 . . . . 22.719999999999999 111.001 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.0 m -129.34 163.75 33.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.622 0.601 . . . . 26.039999999999999 112.622 -178.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . 0.408 ' HG2' ' HB3' ' A' ' 25' ' ' ASP . 58.1 mtpt -129.19 145.92 51.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.691 -0.686 . . . . 30.329999999999998 110.503 177.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 87.1 t -132.84 118.5 33.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.374 -0.375 . . . . 27.800000000000001 111.957 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.0 t-20 -74.53 109.04 7.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.599 -0.519 . . . . 29.32 109.599 174.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.5 m -71.15 -24.97 24.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 112.09 0.404 . . . . 30.420000000000002 112.09 -175.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -65.62 -41.52 92.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.921 0.391 . . . . 40.829999999999998 111.005 178.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 81.0 mt-10 -95.65 -12.13 26.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.444 0.535 . . . . 48.740000000000002 112.444 -177.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 60.4 m-80 -127.2 68.73 73.07 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 112.068 0.396 . . . . 40.700000000000003 112.068 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -70.76 -21.53 28.71 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.713 2.276 . . . . 42.390000000000001 112.763 -174.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -69.97 -45.64 66.93 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.364 0.415 . . . . 59.909999999999997 112.111 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 33.0 m -68.56 -37.72 80.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.301 -0.408 . . . . 36.509999999999998 110.563 178.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.07 -43.69 91.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.963 -0.562 . . . . 34.5 110.851 178.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.57 -41.49 84.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.878 -0.601 . . . . 35.509999999999998 112.12 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.4 -24.9 67.79 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.083 0.771 . . . . 66.780000000000001 113.083 -177.215 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -119.01 18.19 13.21 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.83 0.678 . . . . 37.420000000000002 112.83 -176.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 55.11 42.02 80.1 Favored Glycine 0 N--CA 1.452 -0.244 0 N-CA-C 115.38 0.912 . . . . 32.530000000000001 115.38 173.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.8 mm -71.67 100.47 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.097 -0.705 . . . . 30.940000000000001 109.097 175.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.59 -19.39 23.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.371 -0.377 . . . . 39.600000000000001 111.986 -175.452 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.7 p -155.53 165.69 35.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.914 0.387 . . . . 27.68 111.717 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.1 pt -133.31 145.89 58.53 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.068 -0.515 . . . . 22.73 111.195 -178.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -76.77 138.76 55.99 Favored 'Cis proline' 0 C--N 1.343 0.282 0 O-C-N 122.361 0.664 . . . . 24.710000000000001 113.249 -0.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.9 m -121.5 125.32 46.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.799 -0.637 . . . . 31.579999999999998 109.643 175.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 25' ' ' ASP . 14.6 mt -108.09 122.71 47.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.1 -0.5 . . . . 29.949999999999999 111.339 -176.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 50.2 mt -112.7 138.64 49.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.122 -0.49 . . . . 30.390000000000001 110.652 175.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.2 tp -106.46 118.35 36.42 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.389 -0.597 . . . . 33.93 109.389 173.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -101.56 131.6 47.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.887 -0.597 . . . . 32.539999999999999 111.435 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -125.27 100.92 6.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.911 -0.586 . . . . 43.100000000000001 109.612 173.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.0 m120 56.76 55.84 5.96 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.512 0.93 . . . . 58.43 113.512 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 90.23 -2.32 81.06 Favored Glycine 0 N--CA 1.452 -0.267 0 N-CA-C 116.428 1.331 . . . . 45.880000000000003 116.428 170.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -138.71 153.06 48.48 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 117.498 0.649 . . . . 64.290000000000006 112.695 -177.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.4 t -81.24 122.95 37.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.903 -0.589 . . . . 36.649999999999999 112.086 -176.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.37 -9.27 11.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 33.909999999999997 111.819 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . 0.44 ' OD1' ' NH2' ' A' ' 101' ' ' ARG . 19.1 t0 -159.27 152.18 21.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.115 0.483 . . . . 47.780000000000001 111.128 177.299 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 41.3 ttm-85 -142.4 137.45 30.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.65 -0.704 . . . . 36.219999999999999 110.436 -177.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -152.27 125.7 8.79 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.558 -0.457 . . . . 46.609999999999999 111.735 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.3 m -108.79 153.67 10.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.193 0.52 . . . . 42.049999999999997 111.071 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 94.96 157.02 32.35 Favored Glycine 0 N--CA 1.448 -0.547 0 CA-C-N 115.847 -0.615 . . . . 39.07 113.581 176.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.72 103.28 0.54 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.985 0.421 . . . . 49.060000000000002 110.253 176.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -101.54 142.6 24.94 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.885 -0.598 . . . . 68.420000000000002 112.035 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -67.92 145.24 67.5 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 120.96 1.107 . . . . 42.890000000000001 111.994 175.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -52.03 -49.63 63.02 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 114.906 1.447 . . . . 40.909999999999997 114.906 -173.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 25.8 tp10 -69.1 -29.5 67.59 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.95 -0.3 . . . . 62.579999999999998 111.754 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.82 -37.99 79.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.677 0.275 . . . . 44.869999999999997 110.475 176.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 22.8 mt -66.89 -46.79 73.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.303 -0.408 . . . . 45.969999999999999 110.819 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt -57.77 -34.6 69.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.368 -0.378 . . . . 39.039999999999999 110.326 177.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -65.46 -44.62 86.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.002 -0.544 . . . . 52.810000000000002 109.561 176.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ARG . . . . . 0.44 ' NH2' ' OD1' ' A' ' 87' ' ' ASP . 52.4 mtp85 -68.07 -42.53 80.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.749 -0.66 . . . . 69.829999999999998 111.417 -179.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 90.1 mt -63.57 -50.32 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.13 -0.487 . . . . 46.039999999999999 111.541 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -51.55 -24.05 4.86 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.312 1.227 . . . . 53.490000000000002 114.312 -176.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -77.77 -9.75 59.18 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.734 0.642 . . . . 64.760000000000005 112.734 -175.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 -124.93 26.32 7.08 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.217 0.451 . . . . 65.019999999999996 112.217 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.384 -0.371 . . . . 59.43 110.944 177.944 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1107 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2001 ' ' HOH . . . . . 0.557 ' O ' ' N ' ' A' ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' 2001 ' ' HOH . 8.8 t . . . . . 0 C--O 1.23 0.076 0 CA-C-O 121.018 0.437 . . . . 52.799999999999997 110.634 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.7 t -97.25 122.35 48.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 109.294 -0.632 . . . . 34.259999999999998 109.294 173.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.9 mm -89.0 119.4 36.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.147 -0.479 . . . . 28.399999999999999 112.1 -175.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -78.58 123.67 27.35 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.689 -0.486 . . . . 36.020000000000003 109.689 175.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 83.3 t -119.88 139.7 46.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 112.376 0.509 . . . . 30.940000000000001 112.376 -170.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.3 p -116.72 178.24 4.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 38.090000000000003 111.373 179.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -57.35 -33.16 67.47 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.49 0.662 . . . . 34.039999999999999 110.154 174.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -63.46 -32.21 73.59 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.853 -1.067 . . . . 57.299999999999997 113.0 -174.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -132.99 19.28 4.1 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 114.44 1.274 . . . . 34.439999999999998 114.44 -174.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -64.07 -39.61 94.44 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.176 0.436 . . . . 30.93 112.176 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.83 -45.44 89.57 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.531 0.567 . . . . 53.240000000000002 112.531 -175.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -73.27 -40.89 64.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.912 0.387 . . . . 56.229999999999997 111.537 -178.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -77.79 -32.75 52.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.247 0.832 . . . . 33.700000000000003 113.247 -174.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 91.1 t -111.07 -59.32 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 113.198 0.814 . . . . 31.82 113.198 -175.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.7 mt -64.92 -31.19 72.31 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.526 0.565 . . . . 40.950000000000003 112.526 -176.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -102.33 10.47 39.12 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.408 -0.517 . . . . 41.670000000000002 111.837 -176.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.5 t -76.58 135.49 39.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.917 -0.583 . . . . 35.170000000000002 110.319 173.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -75.82 -19.95 58.54 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.043 -0.526 . . . . 51.469999999999999 111.386 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -100.91 156.96 34.53 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.515 -0.766 . . . . 45.939999999999998 110.429 176.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -58.76 145.47 96.05 Favored 'Trans proline' 0 C--N 1.342 0.197 0 O-C-N 122.613 0.796 . . . . 33.450000000000003 110.974 170.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.3 t -121.77 127.91 75.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 113.389 0.885 . . . . 29.030000000000001 113.389 -176.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.3 tp -95.75 122.31 38.39 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.336 -0.616 . . . . 25.219999999999999 109.336 170.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.4 t -112.72 114.53 47.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.726 0.298 . . . . 23.760000000000002 111.436 -176.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.464 ' HA ' HD23 ' A' ' 77' ' ' LEU . 25.6 t0 -94.42 106.41 18.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.27 -0.423 . . . . 29.41 110.657 177.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -83.42 129.83 35.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.26 -0.427 . . . . 26.699999999999999 110.165 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 26.0 p-90 -150.81 177.24 10.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 28.640000000000001 111.814 -172.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.57 149.57 16.29 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.288 -0.634 . . . . 31.68 109.288 175.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -41.31 -48.12 5.29 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 125.174 3.916 . . . . 56.520000000000003 116.773 -172.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -98.13 47.6 1.0 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.401 -0.52 . . . . 69.650000000000006 112.156 -174.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.3 t -116.68 98.34 6.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.96 -0.564 . . . . 40.490000000000002 111.134 179.963 -179.967 -149.751 73.738 88.742 2.033 100.975 73.765 -60.111 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -52.33 -53.34 31.96 Favored Glycine 0 CA--C 1.519 0.295 0 CA-C-N 116.042 -0.527 . . . . 35.049999999999997 114.089 176.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -57.69 -34.47 98.2 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.049 1.166 . . . . 35.149999999999999 113.32 173.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 82.3 m -62.76 -40.73 98.18 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.444 -0.576 . . . . 28.43 109.444 175.667 -60.111 73.765 73.738 100.975 2.033 88.742 -149.751 -179.967 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.8 mtm105 -64.71 -31.64 72.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.433 -0.803 . . . . 61.890000000000001 111.552 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 37.9 mtp -69.23 -33.64 73.59 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 113.649 0.981 . . . . 51.780000000000001 113.649 -175.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.2 pt -104.93 -4.59 9.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 113.718 1.007 . . . . 37.159999999999997 113.718 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.6 99.72 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.104 0.409 . . . . 31.550000000000001 112.104 177.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -68.81 -27.62 31.06 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 116.297 -2.002 . . . . 33.549999999999997 112.652 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.8 mt -67.65 -43.0 87.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 109.596 -0.52 . . . . 34.659999999999997 109.596 175.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 34.6 mm -61.83 -37.26 77.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.935 -0.575 . . . . 35.140000000000001 110.425 174.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -63.53 -43.65 96.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.232 -0.44 . . . . 47.960000000000001 112.039 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -68.3 -30.67 69.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.533 -0.303 . . . . 57.259999999999998 111.662 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 44' ' ' LEU . 27.9 mt -62.67 -42.5 99.66 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.925 0.343 . . . . 35.479999999999997 111.925 -179.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.52 -36.83 83.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.068 -0.515 . . . . 40.990000000000002 110.56 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 12.4 tttm -67.81 -41.08 83.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.802 -0.636 . . . . 64.489999999999995 110.772 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -83.51 -19.9 34.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.856 0.687 . . . . 49.789999999999999 112.856 -174.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.518 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 3.1 m-85 -108.13 11.12 27.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.487 -0.324 . . . . 46.210000000000001 111.709 179.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -56.67 125.21 21.24 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.839 0.681 . . . . 57.909999999999997 112.839 -175.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.67 -19.29 52.05 Favored Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.803 -0.635 . . . . 39.859999999999999 111.963 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -110.05 -45.54 3.59 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.853 0.316 . . . . 54.439999999999998 111.853 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.518 ' HB ' ' HB3' ' A' ' 48' ' ' TYR . 39.3 t -128.39 127.41 67.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.956 0.407 . . . . 31.309999999999999 111.648 177.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -81.65 136.9 35.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 28.59 109.76 174.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 97.6 t -121.55 123.25 69.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.453 -0.34 . . . . 22.719999999999999 111.001 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.0 m -129.34 163.75 33.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.622 0.601 . . . . 26.039999999999999 112.622 -178.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.408 ' HG2' ' HB3' ' A' ' 25' ' ' ASP . 58.1 mtpt -129.19 145.92 51.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.691 -0.686 . . . . 30.329999999999998 110.503 177.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 87.1 t -132.84 118.5 33.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.374 -0.375 . . . . 27.800000000000001 111.957 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.0 t-20 -74.53 109.04 7.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.599 -0.519 . . . . 29.32 109.599 174.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.5 m -71.15 -24.97 24.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 112.09 0.404 . . . . 30.420000000000002 112.09 -175.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -65.62 -41.52 92.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.921 0.391 . . . . 40.829999999999998 111.005 178.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 81.0 mt-10 -95.65 -12.13 26.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.444 0.535 . . . . 48.740000000000002 112.444 -177.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 60.4 m-80 -127.2 68.73 73.07 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 112.068 0.396 . . . . 40.700000000000003 112.068 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -70.76 -21.53 28.71 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.713 2.276 . . . . 42.390000000000001 112.763 -174.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -69.97 -45.64 66.93 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.364 0.415 . . . . 59.909999999999997 112.111 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 33.0 m -68.56 -37.72 80.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.301 -0.408 . . . . 36.509999999999998 110.563 178.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.07 -43.69 91.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.963 -0.562 . . . . 34.5 110.851 178.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.57 -41.49 84.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.878 -0.601 . . . . 35.509999999999998 112.12 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.4 -24.9 67.79 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.083 0.771 . . . . 66.780000000000001 113.083 -177.215 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -119.01 18.19 13.21 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.83 0.678 . . . . 37.420000000000002 112.83 -176.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 55.11 42.02 80.1 Favored Glycine 0 N--CA 1.452 -0.244 0 N-CA-C 115.38 0.912 . . . . 32.530000000000001 115.38 173.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.8 mm -71.67 100.47 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.097 -0.705 . . . . 30.940000000000001 109.097 175.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.59 -19.39 23.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.371 -0.377 . . . . 39.600000000000001 111.986 -175.452 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.7 p -155.53 165.69 35.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.914 0.387 . . . . 27.68 111.717 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.1 pt -133.31 145.89 58.53 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.068 -0.515 . . . . 22.73 111.195 -178.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -76.77 138.76 55.99 Favored 'Cis proline' 0 C--N 1.343 0.282 0 O-C-N 122.361 0.664 . . . . 24.710000000000001 113.249 -0.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.9 m -121.5 125.32 46.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.799 -0.637 . . . . 31.579999999999998 109.643 175.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 25' ' ' ASP . 14.6 mt -108.09 122.71 47.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.1 -0.5 . . . . 29.949999999999999 111.339 -176.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 50.2 mt -112.7 138.64 49.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.122 -0.49 . . . . 30.390000000000001 110.652 175.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.2 tp -106.46 118.35 36.42 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.389 -0.597 . . . . 33.93 109.389 173.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -101.56 131.6 47.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.887 -0.597 . . . . 32.539999999999999 111.435 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -125.27 100.92 6.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.911 -0.586 . . . . 43.100000000000001 109.612 173.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.0 m120 56.76 55.84 5.96 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.512 0.93 . . . . 58.43 113.512 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 90.23 -2.32 81.06 Favored Glycine 0 N--CA 1.452 -0.267 0 N-CA-C 116.428 1.331 . . . . 45.880000000000003 116.428 170.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -138.71 153.06 48.48 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 117.498 0.649 . . . . 64.290000000000006 112.695 -177.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.4 t -81.24 122.95 37.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.903 -0.589 . . . . 36.649999999999999 112.086 -176.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.37 -9.27 11.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 33.909999999999997 111.819 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.44 ' OD1' ' NH2' ' A' ' 101' ' ' ARG . 19.1 t0 -159.27 152.18 21.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.115 0.483 . . . . 47.780000000000001 111.128 177.299 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 41.3 ttm-85 -142.4 137.45 30.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.65 -0.704 . . . . 36.219999999999999 110.436 -177.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -152.27 125.7 8.79 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.558 -0.457 . . . . 46.609999999999999 111.735 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.3 m -108.79 153.67 10.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.193 0.52 . . . . 42.049999999999997 111.071 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 94.96 157.02 32.35 Favored Glycine 0 N--CA 1.448 -0.547 0 CA-C-N 115.847 -0.615 . . . . 39.07 113.581 176.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.72 103.28 0.54 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.985 0.421 . . . . 49.060000000000002 110.253 176.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -101.54 142.6 24.94 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.885 -0.598 . . . . 68.420000000000002 112.035 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -67.92 145.24 67.5 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 120.96 1.107 . . . . 42.890000000000001 111.994 175.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -52.03 -49.63 63.02 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 114.906 1.447 . . . . 40.909999999999997 114.906 -173.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 25.8 tp10 -69.1 -29.5 67.59 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.95 -0.3 . . . . 62.579999999999998 111.754 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.82 -37.99 79.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.677 0.275 . . . . 44.869999999999997 110.475 176.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 22.8 mt -66.89 -46.79 73.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.303 -0.408 . . . . 45.969999999999999 110.819 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt -57.77 -34.6 69.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.368 -0.378 . . . . 39.039999999999999 110.326 177.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -65.46 -44.62 86.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.002 -0.544 . . . . 52.810000000000002 109.561 176.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.44 ' NH2' ' OD1' ' A' ' 87' ' ' ASP . 52.4 mtp85 -68.07 -42.53 80.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.749 -0.66 . . . . 69.829999999999998 111.417 -179.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 90.1 mt -63.57 -50.32 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.13 -0.487 . . . . 46.039999999999999 111.541 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -51.55 -24.05 4.86 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.312 1.227 . . . . 53.490000000000002 114.312 -176.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -77.77 -9.75 59.18 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.734 0.642 . . . . 64.760000000000005 112.734 -175.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 -124.93 26.32 7.08 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.217 0.451 . . . . 65.019999999999996 112.217 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.384 -0.371 . . . . 59.43 110.944 177.944 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1107 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' HOH . . . . . 0.557 ' O ' ' N ' ' A' ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_