data_6sbw_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 6sbw _Structure_validation_residue.Date_analyzed 2020-04-17 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.5 t0 . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 118.038 -0.982 . . . . 147.49 108.974 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.57 160.45 30.13 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 125.386 1.474 . . . . 137.9 110.853 -166.624 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.3 mmt-85 -158.28 131.64 7.55 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 126.049 1.74 . . . . 163.66 110.284 176.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.8 tttt -86.2 140.79 29.83 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.153 1.381 . . . . 118.04 109.519 -177.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -151.48 118.91 6.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 124.659 1.225 . . . . 78.27 109.248 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 38.2 m -74.73 128.53 35.79 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.613 1.965 . . . . 101.29 109.711 170.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 98.0 mt -127.25 166.55 17.54 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.982 1.426 . . . . 86.79 108.263 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -115.33 135.24 54.35 Favored 'General case' 0 C--O 1.253 1.24 0 O-C-N 125.036 1.46 . . . . 130.27 107.531 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -130.66 149.31 73.2 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.994 1.318 . . . . 78.39 109.01 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.9 146.79 92.29 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 N-CA-C 108.481 -1.392 . . . . 84.81 108.481 159.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -43.16 -62.73 0.96 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.951 1.301 . . . . 147.19 108.323 173.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -47.98 -44.48 30.57 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.086 1.354 . . . . 132.67 109.099 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 54.9 ttm -71.8 -46.63 57.62 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 117.434 -1.269 . . . . 82.91 108.754 -171.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 14.9 tp -55.51 -44.84 76.98 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 124.567 1.167 . . . . 83.29 108.721 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -65.62 -42.76 91.18 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 117.641 -1.171 . . . . 121.61 108.55 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -54.85 -45.26 74.51 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 118.346 -0.835 . . . . 112.32 109.309 175.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.9 mt -64.23 -45.51 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 107.699 -1.222 . . . . 61.05 107.699 -175.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.9 tp60 -66.44 -37.68 85.71 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.693 1.197 . . . . 82.46 109.409 -173.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -56.55 -48.76 76.6 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.799 1.239 . . . . 141.51 108.895 174.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -66.6 -35.85 81.2 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 118.925 -0.559 . . . . 79.39 110.117 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.59 -49.7 72.31 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.089 -1.078 . . . . 58.66 108.089 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 p -71.83 -41.31 68.33 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 108.28 -1.007 . . . . 82.66 108.28 -175.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.0 ttp85 -53.71 -43.84 69.34 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.891 0.769 . . . . 99.7 109.569 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -95.0 0.49 54.66 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.477 1.111 . . . . 73.36 109.77 -172.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 51.5 m-20 54.1 52.3 13.0 Favored 'General case' 0 C--O 1.252 1.223 0 C-N-CA 125.235 1.414 . . . . 72.68 110.144 -175.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 -124.11 159.37 30.14 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.617 1.198 . . . . 69.92 109.156 -175.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.0 p -67.32 150.35 49.12 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 124.849 1.343 . . . . 61.37 108.143 162.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.8 mt -44.04 -53.65 6.13 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 126.617 1.967 . . . . 69.86 110.045 162.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 58.0 m -52.93 -45.57 67.69 Favored 'General case' 0 C--O 1.251 1.137 0 O-C-N 124.385 1.053 . . . . 64.09 108.565 -176.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -66.18 -42.86 88.33 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 124.072 0.857 . . . . 58.54 109.304 -174.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.72 -46.44 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.475 0 N-CA-C 108.407 -0.96 . . . . 61.63 108.407 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 76.0 t -64.67 -41.16 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 CA-C-O 117.736 -1.126 . . . . 59.38 108.11 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -56.75 -41.51 77.68 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 124.424 1.077 . . . . 67.2 108.764 174.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -70.87 -36.17 72.69 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 108.66 -0.867 . . . . 86.34 108.66 -176.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.29 -44.37 92.5 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.392 1.077 . . . . 63.05 108.928 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 72.8 t-105 -63.17 -54.77 32.39 Favored 'General case' 0 C--O 1.259 1.559 0 N-CA-C 109.16 -0.681 . . . . 70.36 109.16 179.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -51.3 -37.54 48.09 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 117.349 -1.31 . . . . 109.78 109.063 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.5 mt -74.24 -41.22 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 CA-C-O 117.17 -1.395 . . . . 81.21 108.597 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -96.17 -24.81 16.09 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 117.298 -1.334 . . . . 82.28 111.781 -163.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -29.42 -60.85 0.14 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.964 1.705 . . . . 137.82 111.724 -176.045 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -61.09 -53.54 55.89 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.621 1.168 . . . . 134.66 109.245 -171.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.66 -41.7 67.09 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 124.842 1.339 . . . . 140.9 108.51 179.373 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 64.4 mt -73.3 -42.76 57.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 CA-C-O 117.223 -1.37 . . . . 76.84 108.855 -175.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -63.88 -12.2 34.6 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 125.17 1.544 . . . . 132.16 109.026 -178.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.1 p -96.75 -11.72 24.64 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.441 1.496 . . . . 100.17 111.369 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -54.9 156.85 6.28 Favored Pre-proline 0 N--CA 1.494 1.734 0 CA-C-N 119.723 1.147 . . . . 119.25 109.436 171.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -93.36 -76.29 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.081 0 N-CA-C 120.461 3.216 . . . . 122.0 120.461 -168.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.213 0 C-N-CA 124.248 1.019 . . . . 102.34 110.197 -163.247 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.5 t0 . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 118.038 -0.982 . . . . 147.49 108.974 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.57 160.45 30.13 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 125.386 1.474 . . . . 137.9 110.853 -166.624 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.3 mmt-85 -158.28 131.64 7.55 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 126.049 1.74 . . . . 163.66 110.284 176.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.8 tttt -86.2 140.79 29.83 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.153 1.381 . . . . 118.04 109.519 -177.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -151.48 118.91 6.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 124.659 1.225 . . . . 78.27 109.248 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 38.2 m -74.73 128.53 35.79 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.613 1.965 . . . . 101.29 109.711 170.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 98.0 mt -127.25 166.55 17.54 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.982 1.426 . . . . 86.79 108.263 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -115.33 135.24 54.35 Favored 'General case' 0 C--O 1.253 1.24 0 O-C-N 125.036 1.46 . . . . 130.27 107.531 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -130.66 149.31 73.2 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.994 1.318 . . . . 78.39 109.01 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.9 146.79 92.29 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 N-CA-C 108.481 -1.392 . . . . 84.81 108.481 159.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -43.16 -62.73 0.96 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.951 1.301 . . . . 147.19 108.323 173.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -47.98 -44.48 30.57 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.086 1.354 . . . . 132.67 109.099 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 54.9 ttm -71.8 -46.63 57.62 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 117.434 -1.269 . . . . 82.91 108.754 -171.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 14.9 tp -55.51 -44.84 76.98 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 124.567 1.167 . . . . 83.29 108.721 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -65.62 -42.76 91.18 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 117.641 -1.171 . . . . 121.61 108.55 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -54.85 -45.26 74.51 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 118.346 -0.835 . . . . 112.32 109.309 175.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.9 mt -64.23 -45.51 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 107.699 -1.222 . . . . 61.05 107.699 -175.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -66.44 -37.68 85.71 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.693 1.197 . . . . 82.46 109.409 -173.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -56.55 -48.76 76.6 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.799 1.239 . . . . 141.51 108.895 174.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -66.6 -35.85 81.2 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 118.925 -0.559 . . . . 79.39 110.117 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.59 -49.7 72.31 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.089 -1.078 . . . . 58.66 108.089 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 p -71.83 -41.31 68.33 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 108.28 -1.007 . . . . 82.66 108.28 -175.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.0 ttp85 -53.71 -43.84 69.34 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.891 0.769 . . . . 99.7 109.569 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -95.0 0.49 54.66 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.477 1.111 . . . . 73.36 109.77 -172.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 51.5 m-20 54.1 52.3 13.0 Favored 'General case' 0 C--O 1.252 1.223 0 C-N-CA 125.235 1.414 . . . . 72.68 110.144 -175.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 -124.11 159.37 30.14 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.617 1.198 . . . . 69.92 109.156 -175.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.0 p -67.32 150.35 49.12 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 124.849 1.343 . . . . 61.37 108.143 162.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.8 mt -44.04 -53.65 6.13 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 126.617 1.967 . . . . 69.86 110.045 162.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 58.0 m -52.93 -45.57 67.69 Favored 'General case' 0 C--O 1.251 1.137 0 O-C-N 124.385 1.053 . . . . 64.09 108.565 -176.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' TRP . . . . . 0.533 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 69.1 t90 -66.18 -42.86 88.33 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 124.072 0.857 . . . . 58.54 109.304 -174.121 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.72 -46.44 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.475 0 N-CA-C 108.407 -0.96 . . . . 61.63 108.407 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 76.0 t -64.67 -41.16 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 CA-C-O 117.736 -1.126 . . . . 59.38 108.11 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -56.75 -41.51 77.68 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 124.424 1.077 . . . . 67.2 108.764 174.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 34' ' ' TRP . 96.0 mm-40 -70.87 -36.17 72.69 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 108.66 -0.867 . . . . 86.34 108.66 -176.556 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.29 -44.37 92.5 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.392 1.077 . . . . 63.05 108.928 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 72.8 t-105 -63.17 -54.77 32.39 Favored 'General case' 0 C--O 1.259 1.559 0 N-CA-C 109.16 -0.681 . . . . 70.36 109.16 179.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -51.3 -37.54 48.09 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 117.349 -1.31 . . . . 109.78 109.063 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.5 mt -74.24 -41.22 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 CA-C-O 117.17 -1.395 . . . . 81.21 108.597 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -96.17 -24.81 16.09 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 117.298 -1.334 . . . . 82.28 111.781 -163.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -29.42 -60.85 0.14 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.964 1.705 . . . . 137.82 111.724 -176.045 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -61.09 -53.54 55.89 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.621 1.168 . . . . 134.66 109.245 -171.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.66 -41.7 67.09 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 124.842 1.339 . . . . 140.9 108.51 179.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 64.4 mt -73.3 -42.76 57.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 CA-C-O 117.223 -1.37 . . . . 76.84 108.855 -175.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -63.88 -12.2 34.6 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 125.17 1.544 . . . . 132.16 109.026 -178.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.1 p -96.75 -11.72 24.64 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.441 1.496 . . . . 100.17 111.369 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -54.9 156.85 6.28 Favored Pre-proline 0 N--CA 1.494 1.734 0 CA-C-N 119.723 1.147 . . . . 119.25 109.436 171.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -93.36 -76.29 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.081 0 N-CA-C 120.461 3.216 . . . . 122.0 120.461 -168.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.213 0 C-N-CA 124.248 1.019 . . . . 102.34 110.197 -163.247 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.5 t0 . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 118.038 -0.982 . . . . 147.49 108.974 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.57 160.45 30.13 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 125.386 1.474 . . . . 137.9 110.853 -166.624 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.3 mmt-85 -158.28 131.64 7.55 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 126.049 1.74 . . . . 163.66 110.284 176.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.8 tttt -86.2 140.79 29.83 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.153 1.381 . . . . 118.04 109.519 -177.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -151.48 118.91 6.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 124.659 1.225 . . . . 78.27 109.248 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 38.2 m -74.73 128.53 35.79 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.613 1.965 . . . . 101.29 109.711 170.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 98.0 mt -127.25 166.55 17.54 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.982 1.426 . . . . 86.79 108.263 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -115.33 135.24 54.35 Favored 'General case' 0 C--O 1.253 1.24 0 O-C-N 125.036 1.46 . . . . 130.27 107.531 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -130.66 149.31 73.2 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.994 1.318 . . . . 78.39 109.01 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.9 146.79 92.29 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 N-CA-C 108.481 -1.392 . . . . 84.81 108.481 159.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -43.16 -62.73 0.96 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.951 1.301 . . . . 147.19 108.323 173.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -47.98 -44.48 30.57 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.086 1.354 . . . . 132.67 109.099 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 54.9 ttm -71.8 -46.63 57.62 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 117.434 -1.269 . . . . 82.91 108.754 -171.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 14.9 tp -55.51 -44.84 76.98 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 124.567 1.167 . . . . 83.29 108.721 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -65.62 -42.76 91.18 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 117.641 -1.171 . . . . 121.61 108.55 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -54.85 -45.26 74.51 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 118.346 -0.835 . . . . 112.32 109.309 175.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.9 mt -64.23 -45.51 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 107.699 -1.222 . . . . 61.05 107.699 -175.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.407 ' NE2' HG23 ' A' ' 26' ' ' THR . 30.9 tp60 -66.44 -37.68 85.71 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.693 1.197 . . . . 82.46 109.409 -173.591 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -56.55 -48.76 76.6 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.799 1.239 . . . . 141.51 108.895 174.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -66.6 -35.85 81.2 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 118.925 -0.559 . . . . 79.39 110.117 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.59 -49.7 72.31 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.089 -1.078 . . . . 58.66 108.089 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . 0.407 HG23 ' NE2' ' A' ' 22' ' ' GLN . 1.1 p -71.83 -41.31 68.33 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 108.28 -1.007 . . . . 82.66 108.28 -175.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.0 ttp85 -53.71 -43.84 69.34 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.891 0.769 . . . . 99.7 109.569 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -95.0 0.49 54.66 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.477 1.111 . . . . 73.36 109.77 -172.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 51.5 m-20 54.1 52.3 13.0 Favored 'General case' 0 C--O 1.252 1.223 0 C-N-CA 125.235 1.414 . . . . 72.68 110.144 -175.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 -124.11 159.37 30.14 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.617 1.198 . . . . 69.92 109.156 -175.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.0 p -67.32 150.35 49.12 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 124.849 1.343 . . . . 61.37 108.143 162.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 34.8 mt -44.04 -53.65 6.13 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 126.617 1.967 . . . . 69.86 110.045 162.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 58.0 m -52.93 -45.57 67.69 Favored 'General case' 0 C--O 1.251 1.137 0 O-C-N 124.385 1.053 . . . . 64.09 108.565 -176.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.533 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 69.1 t90 -66.18 -42.86 88.33 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 124.072 0.857 . . . . 58.54 109.304 -174.121 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.72 -46.44 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.475 0 N-CA-C 108.407 -0.96 . . . . 61.63 108.407 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 76.0 t -64.67 -41.16 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 CA-C-O 117.736 -1.126 . . . . 59.38 108.11 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -56.75 -41.51 77.68 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 124.424 1.077 . . . . 67.2 108.764 174.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 34' ' ' TRP . 96.0 mm-40 -70.87 -36.17 72.69 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 108.66 -0.867 . . . . 86.34 108.66 -176.556 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.29 -44.37 92.5 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.392 1.077 . . . . 63.05 108.928 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 72.8 t-105 -63.17 -54.77 32.39 Favored 'General case' 0 C--O 1.259 1.559 0 N-CA-C 109.16 -0.681 . . . . 70.36 109.16 179.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -51.3 -37.54 48.09 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 117.349 -1.31 . . . . 109.78 109.063 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.5 mt -74.24 -41.22 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 CA-C-O 117.17 -1.395 . . . . 81.21 108.597 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -96.17 -24.81 16.09 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 117.298 -1.334 . . . . 82.28 111.781 -163.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -29.42 -60.85 0.14 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.964 1.705 . . . . 137.82 111.724 -176.045 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -61.09 -53.54 55.89 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.621 1.168 . . . . 134.66 109.245 -171.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.66 -41.7 67.09 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 124.842 1.339 . . . . 140.9 108.51 179.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 64.4 mt -73.3 -42.76 57.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 CA-C-O 117.223 -1.37 . . . . 76.84 108.855 -175.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -63.88 -12.2 34.6 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 125.17 1.544 . . . . 132.16 109.026 -178.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.1 p -96.75 -11.72 24.64 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.441 1.496 . . . . 100.17 111.369 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.9 m-30 -54.9 156.85 6.28 Favored Pre-proline 0 N--CA 1.494 1.734 0 CA-C-N 119.723 1.147 . . . . 119.25 109.436 171.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -93.36 -76.29 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.081 0 N-CA-C 120.461 3.216 . . . . 122.0 120.461 -168.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.213 0 C-N-CA 124.248 1.019 . . . . 102.34 110.197 -163.247 . . . . . . . . 0 0 . 1 stop_ save_