data_5zqh_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 5zqh _Structure_validation_residue.Date_analyzed 2019-04-26 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 ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 . . . . . 0 N--CA 1.493 1.697 0 N-CA-C 112.093 0.405 . . . . 4.82 112.093 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 60.4 p -77.67 160.57 28.4 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 113.323 0.86 . . . . 4.76 113.323 -172.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -58.43 -40.41 82.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.407 0.683 . . . . 4.75 112.73 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 32.9 tp -58.94 -50.59 73.49 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 123.913 0.758 . . . . 4.86 111.924 175.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 38.0 tp -58.67 -47.19 85.32 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 123.818 0.699 . . . . 5.07 112.085 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -58.87 -42.88 90.5 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.82 0.7 . . . . 5.27 112.504 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -61.55 -41.75 99.63 Favored Glycine 0 C--N 1.332 0.31 0 O-C-N 123.528 0.518 . . . . 5.47 112.445 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.6 t -66.44 -54.05 29.94 Favored 'Isoleucine or valine' 0 C--O 1.246 0.903 0 CA-C-O 118.79 -0.624 . . . . 5.68 112.034 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . 0.314 0.1 OUTLIER -61.8 -30.14 70.62 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.876 1.436 . . . . 5.79 114.876 177.814 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -59.51 -58.64 7.73 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.344 0.403 . . . . 5.94 110.02 174.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.34 -46.29 64.19 Favored Glycine 0 C--N 1.335 0.481 0 O-C-N 124.258 0.974 . . . . 5.84 114.28 175.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.5 m -64.27 -46.74 82.36 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.603 0.964 . . . . 5.92 113.603 178.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.8 t -59.67 -45.97 93.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 C-N-CA 123.108 0.563 . . . . 6.04 111.907 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -45.34 87.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.894 0.877 . . . . 6.2 113.337 174.516 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.31 -45.89 89.26 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.563 0.579 . . . . 6.39 112.563 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 60.2 mtt -58.94 -41.63 87.84 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.259 0.837 . . . . 6.62 113.259 178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.0 mt -65.62 -34.3 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.504 1.122 . . . . 6.9 111.292 175.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.0 -44.0 92.41 Favored Glycine 0 N--CA 1.468 0.829 0 N-CA-C 115.472 0.949 . . . . 7.21 115.472 173.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -63.06 -51.31 67.16 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.396 0.678 . . . . 7.66 111.205 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.9 tttm -147.37 129.69 15.71 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.297 -0.865 . . . . 7.73 110.33 -179.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -52.44 116.75 2.42 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.166 1.386 . . . . 8.09 109.753 171.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 61.6 mtt85 -130.77 146.28 52.19 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.082 1.142 . . . . 8.27 114.082 -173.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -93.65 162.62 13.87 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.427 0.529 . . . . 8.09 112.427 170.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -44.13 -49.26 8.01 Favored Glycine 0 N--CA 1.469 0.882 0 N-CA-C 118.412 2.125 . . . . 8.0 118.412 -173.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -62.22 -47.87 82.51 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.62 0.368 . . . . 8.07 111.755 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -72.36 -24.57 61.3 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.802 1.038 . . . . 8.35 113.802 -175.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mt -67.44 -44.18 79.32 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.703 0.631 . . . . 8.62 112.703 172.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 85.2 t -60.24 -41.18 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 O-C-N 123.506 0.504 . . . . 9.03 110.599 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -70.2 -37.42 75.09 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.029 0.751 . . . . 9.58 113.029 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.0 m -65.31 -35.22 80.33 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.377 0.671 . . . . 10.08 110.827 173.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.72 -45.91 67.13 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.222 1.009 . . . . 10.81 110.562 179.218 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 48.4 mtt-85 -58.11 -46.03 86.24 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 122.863 0.465 . . . . 11.55 111.857 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -65.69 -19.03 65.75 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 114.828 1.418 . . . . 11.93 114.828 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.52 -14.78 42.04 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.417 0.687 . . . . 12.17 111.968 176.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 133.18 -13.49 4.93 Favored Glycine 0 N--CA 1.466 0.659 0 N-CA-C 115.984 1.153 . . . . 12.61 115.984 178.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -77.04 64.9 2.58 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.799 0.809 . . . . 13.41 110.682 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -65.85 -34.27 77.77 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.42 1.088 . . . . 14.52 112.622 -176.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 24.5 p -103.74 22.96 13.52 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.349 1.611 . . . . 15.04 115.349 -168.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.7 pt -81.94 121.14 34.78 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 109.731 -0.47 . . . . 15.86 109.731 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.47 0.537 0 CA-C-N 115.288 -0.869 . . . . 16.33 110.925 -175.183 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.642 0 N-CA-C 113.634 0.214 . . . . 13.81 113.634 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.3 p -97.6 -11.02 24.11 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.242 1.017 . . . . 13.67 112.908 -178.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.1 mm -88.31 -43.23 15.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 124.027 0.931 . . . . 12.94 112.662 -176.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -63.1 -32.79 9.27 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 114.735 1.383 . . . . 12.1 114.735 -179.921 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_exo -55.26 -40.88 83.33 Favored 'Trans proline' 0 C--N 1.363 1.315 0 N-CA-C 114.403 0.886 . . . . 11.76 114.403 167.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.5 tp -64.28 -45.64 87.14 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.719 0.637 . . . . 11.74 112.431 174.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 97.9 mt -59.48 -39.86 85.08 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 122.51 0.324 . . . . 12.09 111.655 175.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -44.4 94.6 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.808 0.843 . . . . 13.03 111.434 176.435 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -63.85 -49.09 74.15 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 124.265 1.026 . . . . 12.45 112.352 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -41.7 95.28 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.501 1.121 . . . . 13.0 113.223 177.744 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 69.9 tt0 -64.56 -45.88 85.17 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 111.744 0.276 . . . . 13.73 111.744 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -64.9 -37.08 86.44 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.788 0.835 . . . . 14.14 111.615 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -67.5 -7.75 28.17 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.582 1.327 . . . . 13.86 114.582 172.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 60.87 33.37 19.96 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.756 1.222 . . . . 14.19 112.93 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -88.96 -36.89 15.63 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.594 -0.521 . . . . 13.21 109.594 174.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 41.1 pt -126.39 164.11 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-N 115.687 -0.688 . . . . 13.65 110.364 175.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -131.28 142.06 50.07 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 112.133 0.42 . . . . 15.4 112.133 173.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -104.86 122.92 7.47 Favored Glycine 0 N--CA 1.463 0.47 0 O-C-N 124.021 0.825 . . . . 14.89 111.747 177.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -129.51 139.5 51.54 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.001 0.52 . . . . 15.71 110.652 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 84.7 mmm -81.76 123.06 28.43 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.029 -0.532 . . . . 16.42 111.315 -177.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 41.1 ptt85 -154.22 160.7 30.65 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 123.569 0.747 . . . . 17.5 112.672 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -72.01 124.7 10.29 Favored 'Trans proline' 0 C--N 1.365 1.419 0 N-CA-C 115.726 1.395 . . . . 16.99 115.726 -172.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.4 p -67.3 168.38 11.8 Favored Pre-proline 0 CA--C 1.555 1.172 0 C-N-CA 123.677 0.791 . . . . 17.01 111.216 172.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -64.97 -16.1 53.77 Favored 'Trans proline' 0 C--N 1.367 1.508 0 N-CA-C 115.293 1.228 . . . . 16.69 115.293 -171.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -87.29 -21.52 25.71 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.155 0.798 . . . . 16.39 113.155 174.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 114.35 -8.08 22.7 Favored Glycine 0 CA--C 1.524 0.654 1 N-CA-C 126.455 5.342 . . . . 15.51 126.455 -176.53 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -82.29 141.59 11.54 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 124.772 3.648 . . . . 14.8 115.505 161.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -71.27 127.04 31.24 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 124.197 0.935 . . . . 14.34 111.394 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -124.28 157.35 35.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.059 -0.973 . . . . 14.16 108.99 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -86.22 99.62 11.68 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 123.382 0.426 . . . . 12.87 110.509 177.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -82.48 129.79 34.98 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.036 -0.529 . . . . 12.58 111.875 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -96.44 130.18 43.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.645 -0.707 . . . . 11.93 111.157 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 59.9 p -131.83 154.19 49.39 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.937 0.895 . . . . 11.92 109.703 174.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 64.4 mt -70.47 137.1 50.01 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 114.327 1.232 . . . . 11.57 114.327 -178.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.67 179.94 7.26 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 106.678 -1.601 . . . . 11.37 106.678 170.31 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -60.48 -44.88 95.46 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.728 0.27 . . . . 20.0 111.728 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.24 -37.66 88.09 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 114.42 1.267 . . . . 10.72 114.42 176.413 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -64.41 -39.97 97.37 Favored Glycine 0 N--CA 1.467 0.729 0 N-CA-C 115.232 0.853 . . . . 10.01 115.232 -179.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.01 -21.91 58.83 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.958 0.725 . . . . 9.71 112.958 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -73.02 -42.96 62.65 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.788 0.835 . . . . 9.43 111.59 167.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -64.2 -30.12 71.19 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.51 0.93 . . . . 9.12 113.51 179.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.2 p -82.43 -34.17 11.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 112.198 0.444 . . . . 8.85 112.198 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 46.4 p -66.8 -40.17 88.02 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 110.164 -0.31 . . . . 8.52 110.164 171.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 13.7 t -56.28 -47.49 81.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.772 0.829 . . . . 8.17 110.915 169.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -55.42 -50.6 69.37 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.639 0.978 . . . . 7.96 113.639 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -67.02 -34.13 77.05 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.013 1.116 . . . . 7.83 114.013 -178.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -68.86 -43.85 74.53 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 123.375 0.422 . . . . 8.05 111.124 173.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -66.73 -36.24 81.99 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.545 0.528 . . . . 8.01 112.351 177.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -67.5 -46.75 72.0 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.821 0.304 . . . . 8.0 111.821 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.39 -41.0 88.39 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.436 0.694 . . . . 8.28 112.523 175.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -66.92 -52.15 46.6 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.34 0.656 . . . . 8.29 111.399 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.03 -31.28 69.97 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.467 0.914 . . . . 8.36 113.467 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 58.3 m -59.15 -48.71 80.62 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.62 0.6 . . . . 8.31 112.62 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -71.29 -29.7 65.36 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.162 1.171 . . . . 8.49 114.162 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -65.7 -47.47 75.28 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.908 0.483 . . . . 8.5 111.797 171.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.2 t -64.91 -43.94 96.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 C-N-CA 124.148 0.979 . . . . 8.53 110.957 -178.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -50.82 -50.89 55.49 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.927 0.891 . . . . 8.82 111.672 172.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.55 -39.04 92.67 Favored Glycine 0 N--CA 1.466 0.671 0 N-CA-C 115.047 0.779 . . . . 8.72 115.047 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 39.6 mt -73.5 -45.26 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.377 0.671 . . . . 8.77 111.208 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 27.8 tttt -51.33 -44.63 62.05 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.654 1.181 . . . . 8.96 112.722 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 N--CA 1.468 0.441 0 O-C-N 123.794 0.684 . . . . 8.99 111.899 -179.026 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 . . . . . 0 N--CA 1.493 1.697 0 N-CA-C 112.093 0.405 . . . . 4.82 112.093 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 60.4 p -77.67 160.57 28.4 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 113.323 0.86 . . . . 4.76 113.323 -172.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -58.43 -40.41 82.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.407 0.683 . . . . 4.75 112.73 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 32.9 tp -58.94 -50.59 73.49 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 123.913 0.758 . . . . 4.86 111.924 175.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 38.0 tp -58.67 -47.19 85.32 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 123.818 0.699 . . . . 5.07 112.085 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -58.87 -42.88 90.5 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.82 0.7 . . . . 5.27 112.504 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -61.55 -41.75 99.63 Favored Glycine 0 C--N 1.332 0.31 0 O-C-N 123.528 0.518 . . . . 5.47 112.445 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.6 t -66.44 -54.05 29.94 Favored 'Isoleucine or valine' 0 C--O 1.246 0.903 0 CA-C-O 118.79 -0.624 . . . . 5.68 112.034 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . 0.314 0.1 OUTLIER -61.8 -30.14 70.62 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.876 1.436 . . . . 5.79 114.876 177.814 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -59.51 -58.64 7.73 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.344 0.403 . . . . 5.94 110.02 174.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.34 -46.29 64.19 Favored Glycine 0 C--N 1.335 0.481 0 O-C-N 124.258 0.974 . . . . 5.84 114.28 175.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.5 m -64.27 -46.74 82.36 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.603 0.964 . . . . 5.92 113.603 178.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.8 t -59.67 -45.97 93.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 C-N-CA 123.108 0.563 . . . . 6.04 111.907 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -45.34 87.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.894 0.877 . . . . 6.2 113.337 174.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.31 -45.89 89.26 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.563 0.579 . . . . 6.39 112.563 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 60.2 mtt -58.94 -41.63 87.84 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.259 0.837 . . . . 6.62 113.259 178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.0 mt -65.62 -34.3 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.504 1.122 . . . . 6.9 111.292 175.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.0 -44.0 92.41 Favored Glycine 0 N--CA 1.468 0.829 0 N-CA-C 115.472 0.949 . . . . 7.21 115.472 173.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -63.06 -51.31 67.16 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.396 0.678 . . . . 7.66 111.205 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.9 tttm -147.37 129.69 15.71 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.297 -0.865 . . . . 7.73 110.33 -179.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . 0.463 ' HG3' ' HB3' ' A' ' 77' ' ' SER . 27.5 tt0 -52.44 116.75 2.42 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.166 1.386 . . . . 8.09 109.753 171.412 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 61.6 mtt85 -130.77 146.28 52.19 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.082 1.142 . . . . 8.27 114.082 -173.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -93.65 162.62 13.87 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.427 0.529 . . . . 8.09 112.427 170.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -44.13 -49.26 8.01 Favored Glycine 0 N--CA 1.469 0.882 0 N-CA-C 118.412 2.125 . . . . 8.0 118.412 -173.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -62.22 -47.87 82.51 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.62 0.368 . . . . 8.07 111.755 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -72.36 -24.57 61.3 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.802 1.038 . . . . 8.35 113.802 -175.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mt -67.44 -44.18 79.32 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.703 0.631 . . . . 8.62 112.703 172.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 85.2 t -60.24 -41.18 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 O-C-N 123.506 0.504 . . . . 9.03 110.599 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -70.2 -37.42 75.09 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.029 0.751 . . . . 9.58 113.029 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.0 m -65.31 -35.22 80.33 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.377 0.671 . . . . 10.08 110.827 173.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.72 -45.91 67.13 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.222 1.009 . . . . 10.81 110.562 179.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 48.4 mtt-85 -58.11 -46.03 86.24 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 122.863 0.465 . . . . 11.55 111.857 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -65.69 -19.03 65.75 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 114.828 1.418 . . . . 11.93 114.828 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.52 -14.78 42.04 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.417 0.687 . . . . 12.17 111.968 176.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 133.18 -13.49 4.93 Favored Glycine 0 N--CA 1.466 0.659 0 N-CA-C 115.984 1.153 . . . . 12.61 115.984 178.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -77.04 64.9 2.58 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.799 0.809 . . . . 13.41 110.682 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -65.85 -34.27 77.77 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.42 1.088 . . . . 14.52 112.622 -176.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 24.5 p -103.74 22.96 13.52 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.349 1.611 . . . . 15.04 115.349 -168.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.7 pt -81.94 121.14 34.78 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 109.731 -0.47 . . . . 15.86 109.731 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.47 0.537 0 CA-C-N 115.288 -0.869 . . . . 16.33 110.925 -175.183 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.642 0 N-CA-C 113.634 0.214 . . . . 13.81 113.634 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.3 p -97.6 -11.02 24.11 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.242 1.017 . . . . 13.67 112.908 -178.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.1 mm -88.31 -43.23 15.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 124.027 0.931 . . . . 12.94 112.662 -176.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -63.1 -32.79 9.27 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 114.735 1.383 . . . . 12.1 114.735 -179.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_exo -55.26 -40.88 83.33 Favored 'Trans proline' 0 C--N 1.363 1.315 0 N-CA-C 114.403 0.886 . . . . 11.76 114.403 167.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.5 tp -64.28 -45.64 87.14 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.719 0.637 . . . . 11.74 112.431 174.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 97.9 mt -59.48 -39.86 85.08 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 122.51 0.324 . . . . 12.09 111.655 175.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -44.4 94.6 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.808 0.843 . . . . 13.03 111.434 176.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -63.85 -49.09 74.15 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 124.265 1.026 . . . . 12.45 112.352 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . 0.486 ' HB3' HG12 ' A' ' 60' ' ' ILE . 0.2 OUTLIER -60.6 -41.7 95.28 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.501 1.121 . . . . 13.0 113.223 177.744 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 69.9 tt0 -64.56 -45.88 85.17 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 111.744 0.276 . . . . 13.73 111.744 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -64.9 -37.08 86.44 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.788 0.835 . . . . 14.14 111.615 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -67.5 -7.75 28.17 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.582 1.327 . . . . 13.86 114.582 172.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 60.87 33.37 19.96 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.756 1.222 . . . . 14.19 112.93 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -88.96 -36.89 15.63 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.594 -0.521 . . . . 13.21 109.594 174.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . 0.486 HG12 ' HB3' ' A' ' 54' ' ' LEU . 41.1 pt -126.39 164.11 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-N 115.687 -0.688 . . . . 13.65 110.364 175.01 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -131.28 142.06 50.07 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 112.133 0.42 . . . . 15.4 112.133 173.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -104.86 122.92 7.47 Favored Glycine 0 N--CA 1.463 0.47 0 O-C-N 124.021 0.825 . . . . 14.89 111.747 177.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -129.51 139.5 51.54 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.001 0.52 . . . . 15.71 110.652 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 84.7 mmm -81.76 123.06 28.43 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.029 -0.532 . . . . 16.42 111.315 -177.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 41.1 ptt85 -154.22 160.7 30.65 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 123.569 0.747 . . . . 17.5 112.672 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -72.01 124.7 10.29 Favored 'Trans proline' 0 C--N 1.365 1.419 0 N-CA-C 115.726 1.395 . . . . 16.99 115.726 -172.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.4 p -67.3 168.38 11.8 Favored Pre-proline 0 CA--C 1.555 1.172 0 C-N-CA 123.677 0.791 . . . . 17.01 111.216 172.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -64.97 -16.1 53.77 Favored 'Trans proline' 0 C--N 1.367 1.508 0 N-CA-C 115.293 1.228 . . . . 16.69 115.293 -171.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -87.29 -21.52 25.71 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.155 0.798 . . . . 16.39 113.155 174.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 114.35 -8.08 22.7 Favored Glycine 0 CA--C 1.524 0.654 1 N-CA-C 126.455 5.342 . . . . 15.51 126.455 -176.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -82.29 141.59 11.54 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 124.772 3.648 . . . . 14.8 115.505 161.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -71.27 127.04 31.24 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 124.197 0.935 . . . . 14.34 111.394 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -124.28 157.35 35.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.059 -0.973 . . . . 14.16 108.99 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -86.22 99.62 11.68 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 123.382 0.426 . . . . 12.87 110.509 177.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -82.48 129.79 34.98 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.036 -0.529 . . . . 12.58 111.875 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -96.44 130.18 43.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.645 -0.707 . . . . 11.93 111.157 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . 0.463 ' HB3' ' HG3' ' A' ' 24' ' ' GLU . 59.9 p -131.83 154.19 49.39 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.937 0.895 . . . . 11.92 109.703 174.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . 0.473 HD23 HG22 ' A' ' 60' ' ' ILE . 64.4 mt -70.47 137.1 50.01 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 114.327 1.232 . . . . 11.57 114.327 -178.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.67 179.94 7.26 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 106.678 -1.601 . . . . 11.37 106.678 170.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -60.48 -44.88 95.46 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.728 0.27 . . . . 20.0 111.728 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.24 -37.66 88.09 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 114.42 1.267 . . . . 10.72 114.42 176.413 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -64.41 -39.97 97.37 Favored Glycine 0 N--CA 1.467 0.729 0 N-CA-C 115.232 0.853 . . . . 10.01 115.232 -179.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.01 -21.91 58.83 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.958 0.725 . . . . 9.71 112.958 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -73.02 -42.96 62.65 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.788 0.835 . . . . 9.43 111.59 167.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -64.2 -30.12 71.19 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.51 0.93 . . . . 9.12 113.51 179.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.2 p -82.43 -34.17 11.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 112.198 0.444 . . . . 8.85 112.198 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 46.4 p -66.8 -40.17 88.02 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 110.164 -0.31 . . . . 8.52 110.164 171.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 13.7 t -56.28 -47.49 81.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.772 0.829 . . . . 8.17 110.915 169.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -55.42 -50.6 69.37 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.639 0.978 . . . . 7.96 113.639 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -67.02 -34.13 77.05 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.013 1.116 . . . . 7.83 114.013 -178.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -68.86 -43.85 74.53 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 123.375 0.422 . . . . 8.05 111.124 173.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -66.73 -36.24 81.99 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.545 0.528 . . . . 8.01 112.351 177.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -67.5 -46.75 72.0 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.821 0.304 . . . . 8.0 111.821 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.39 -41.0 88.39 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.436 0.694 . . . . 8.28 112.523 175.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -66.92 -52.15 46.6 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.34 0.656 . . . . 8.29 111.399 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.03 -31.28 69.97 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.467 0.914 . . . . 8.36 113.467 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 58.3 m -59.15 -48.71 80.62 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.62 0.6 . . . . 8.31 112.62 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -71.29 -29.7 65.36 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.162 1.171 . . . . 8.49 114.162 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -65.7 -47.47 75.28 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.908 0.483 . . . . 8.5 111.797 171.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.2 t -64.91 -43.94 96.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 C-N-CA 124.148 0.979 . . . . 8.53 110.957 -178.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -50.82 -50.89 55.49 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.927 0.891 . . . . 8.82 111.672 172.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.55 -39.04 92.67 Favored Glycine 0 N--CA 1.466 0.671 0 N-CA-C 115.047 0.779 . . . . 8.72 115.047 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 39.6 mt -73.5 -45.26 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.377 0.671 . . . . 8.77 111.208 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 27.8 tttt -51.33 -44.63 62.05 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.654 1.181 . . . . 8.96 112.722 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 N--CA 1.468 0.441 0 O-C-N 123.794 0.684 . . . . 8.99 111.899 -179.026 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 . . . . . 0 N--CA 1.493 1.697 0 N-CA-C 112.093 0.405 . . . . 4.82 112.093 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 60.4 p -77.67 160.57 28.4 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 113.323 0.86 . . . . 4.76 113.323 -172.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -58.43 -40.41 82.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.407 0.683 . . . . 4.75 112.73 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 32.9 tp -58.94 -50.59 73.49 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 123.913 0.758 . . . . 4.86 111.924 175.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 38.0 tp -58.67 -47.19 85.32 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 123.818 0.699 . . . . 5.07 112.085 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -58.87 -42.88 90.5 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.82 0.7 . . . . 5.27 112.504 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -61.55 -41.75 99.63 Favored Glycine 0 C--N 1.332 0.31 0 O-C-N 123.528 0.518 . . . . 5.47 112.445 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.6 t -66.44 -54.05 29.94 Favored 'Isoleucine or valine' 0 C--O 1.246 0.903 0 CA-C-O 118.79 -0.624 . . . . 5.68 112.034 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . 0.314 0.1 OUTLIER -61.8 -30.14 70.62 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.876 1.436 . . . . 5.79 114.876 177.814 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -59.51 -58.64 7.73 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.344 0.403 . . . . 5.94 110.02 174.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.34 -46.29 64.19 Favored Glycine 0 C--N 1.335 0.481 0 O-C-N 124.258 0.974 . . . . 5.84 114.28 175.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.5 m -64.27 -46.74 82.36 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.603 0.964 . . . . 5.92 113.603 178.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.8 t -59.67 -45.97 93.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 C-N-CA 123.108 0.563 . . . . 6.04 111.907 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -45.34 87.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.894 0.877 . . . . 6.2 113.337 174.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.31 -45.89 89.26 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.563 0.579 . . . . 6.39 112.563 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 60.2 mtt -58.94 -41.63 87.84 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.259 0.837 . . . . 6.62 113.259 178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.0 mt -65.62 -34.3 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.504 1.122 . . . . 6.9 111.292 175.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.0 -44.0 92.41 Favored Glycine 0 N--CA 1.468 0.829 0 N-CA-C 115.472 0.949 . . . . 7.21 115.472 173.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -63.06 -51.31 67.16 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.396 0.678 . . . . 7.66 111.205 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.9 tttm -147.37 129.69 15.71 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.297 -0.865 . . . . 7.73 110.33 -179.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.463 ' HG3' ' HB3' ' A' ' 77' ' ' SER . 27.5 tt0 -52.44 116.75 2.42 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.166 1.386 . . . . 8.09 109.753 171.412 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 61.6 mtt85 -130.77 146.28 52.19 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.082 1.142 . . . . 8.27 114.082 -173.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -93.65 162.62 13.87 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.427 0.529 . . . . 8.09 112.427 170.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -44.13 -49.26 8.01 Favored Glycine 0 N--CA 1.469 0.882 0 N-CA-C 118.412 2.125 . . . . 8.0 118.412 -173.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -62.22 -47.87 82.51 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.62 0.368 . . . . 8.07 111.755 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -72.36 -24.57 61.3 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.802 1.038 . . . . 8.35 113.802 -175.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mt -67.44 -44.18 79.32 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.703 0.631 . . . . 8.62 112.703 172.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 85.2 t -60.24 -41.18 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 O-C-N 123.506 0.504 . . . . 9.03 110.599 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -70.2 -37.42 75.09 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.029 0.751 . . . . 9.58 113.029 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.0 m -65.31 -35.22 80.33 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.377 0.671 . . . . 10.08 110.827 173.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.72 -45.91 67.13 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.222 1.009 . . . . 10.81 110.562 179.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 48.4 mtt-85 -58.11 -46.03 86.24 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 122.863 0.465 . . . . 11.55 111.857 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -65.69 -19.03 65.75 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 114.828 1.418 . . . . 11.93 114.828 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.52 -14.78 42.04 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.417 0.687 . . . . 12.17 111.968 176.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 133.18 -13.49 4.93 Favored Glycine 0 N--CA 1.466 0.659 0 N-CA-C 115.984 1.153 . . . . 12.61 115.984 178.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -77.04 64.9 2.58 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.799 0.809 . . . . 13.41 110.682 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -65.85 -34.27 77.77 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.42 1.088 . . . . 14.52 112.622 -176.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 24.5 p -103.74 22.96 13.52 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.349 1.611 . . . . 15.04 115.349 -168.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.7 pt -81.94 121.14 34.78 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 109.731 -0.47 . . . . 15.86 109.731 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.47 0.537 0 CA-C-N 115.288 -0.869 . . . . 16.33 110.925 -175.183 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.642 0 N-CA-C 113.634 0.214 . . . . 13.81 113.634 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.3 p -97.6 -11.02 24.11 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.242 1.017 . . . . 13.67 112.908 -178.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.1 mm -88.31 -43.23 15.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 124.027 0.931 . . . . 12.94 112.662 -176.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -63.1 -32.79 9.27 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 114.735 1.383 . . . . 12.1 114.735 -179.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_exo -55.26 -40.88 83.33 Favored 'Trans proline' 0 C--N 1.363 1.315 0 N-CA-C 114.403 0.886 . . . . 11.76 114.403 167.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.5 tp -64.28 -45.64 87.14 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.719 0.637 . . . . 11.74 112.431 174.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 97.9 mt -59.48 -39.86 85.08 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 122.51 0.324 . . . . 12.09 111.655 175.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -44.4 94.6 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.808 0.843 . . . . 13.03 111.434 176.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -63.85 -49.09 74.15 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 124.265 1.026 . . . . 12.45 112.352 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.486 ' HB3' HG12 ' A' ' 60' ' ' ILE . 0.2 OUTLIER -60.6 -41.7 95.28 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.501 1.121 . . . . 13.0 113.223 177.744 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 69.9 tt0 -64.56 -45.88 85.17 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 111.744 0.276 . . . . 13.73 111.744 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -64.9 -37.08 86.44 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.788 0.835 . . . . 14.14 111.615 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -67.5 -7.75 28.17 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.582 1.327 . . . . 13.86 114.582 172.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 60.87 33.37 19.96 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.756 1.222 . . . . 14.19 112.93 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -88.96 -36.89 15.63 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.594 -0.521 . . . . 13.21 109.594 174.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.486 HG12 ' HB3' ' A' ' 54' ' ' LEU . 41.1 pt -126.39 164.11 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-N 115.687 -0.688 . . . . 13.65 110.364 175.01 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -131.28 142.06 50.07 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 112.133 0.42 . . . . 15.4 112.133 173.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -104.86 122.92 7.47 Favored Glycine 0 N--CA 1.463 0.47 0 O-C-N 124.021 0.825 . . . . 14.89 111.747 177.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -129.51 139.5 51.54 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.001 0.52 . . . . 15.71 110.652 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 84.7 mmm -81.76 123.06 28.43 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.029 -0.532 . . . . 16.42 111.315 -177.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 41.1 ptt85 -154.22 160.7 30.65 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 123.569 0.747 . . . . 17.5 112.672 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -72.01 124.7 10.29 Favored 'Trans proline' 0 C--N 1.365 1.419 0 N-CA-C 115.726 1.395 . . . . 16.99 115.726 -172.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.4 p -67.3 168.38 11.8 Favored Pre-proline 0 CA--C 1.555 1.172 0 C-N-CA 123.677 0.791 . . . . 17.01 111.216 172.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -64.97 -16.1 53.77 Favored 'Trans proline' 0 C--N 1.367 1.508 0 N-CA-C 115.293 1.228 . . . . 16.69 115.293 -171.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -87.29 -21.52 25.71 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.155 0.798 . . . . 16.39 113.155 174.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 114.35 -8.08 22.7 Favored Glycine 0 CA--C 1.524 0.654 1 N-CA-C 126.455 5.342 . . . . 15.51 126.455 -176.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -82.29 141.59 11.54 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 124.772 3.648 . . . . 14.8 115.505 161.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -71.27 127.04 31.24 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 124.197 0.935 . . . . 14.34 111.394 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -124.28 157.35 35.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.059 -0.973 . . . . 14.16 108.99 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -86.22 99.62 11.68 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 123.382 0.426 . . . . 12.87 110.509 177.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -82.48 129.79 34.98 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.036 -0.529 . . . . 12.58 111.875 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -96.44 130.18 43.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.645 -0.707 . . . . 11.93 111.157 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . 0.463 ' HB3' ' HG3' ' A' ' 24' ' ' GLU . 59.9 p -131.83 154.19 49.39 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.937 0.895 . . . . 11.92 109.703 174.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.473 HD23 HG22 ' A' ' 60' ' ' ILE . 64.4 mt -70.47 137.1 50.01 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 114.327 1.232 . . . . 11.57 114.327 -178.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.67 179.94 7.26 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 106.678 -1.601 . . . . 11.37 106.678 170.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -60.48 -44.88 95.46 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.728 0.27 . . . . 20.0 111.728 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.24 -37.66 88.09 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 114.42 1.267 . . . . 10.72 114.42 176.413 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -64.41 -39.97 97.37 Favored Glycine 0 N--CA 1.467 0.729 0 N-CA-C 115.232 0.853 . . . . 10.01 115.232 -179.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.01 -21.91 58.83 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.958 0.725 . . . . 9.71 112.958 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -73.02 -42.96 62.65 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.788 0.835 . . . . 9.43 111.59 167.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -64.2 -30.12 71.19 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.51 0.93 . . . . 9.12 113.51 179.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.2 p -82.43 -34.17 11.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 112.198 0.444 . . . . 8.85 112.198 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 46.4 p -66.8 -40.17 88.02 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 110.164 -0.31 . . . . 8.52 110.164 171.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 13.7 t -56.28 -47.49 81.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.772 0.829 . . . . 8.17 110.915 169.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -55.42 -50.6 69.37 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.639 0.978 . . . . 7.96 113.639 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -67.02 -34.13 77.05 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.013 1.116 . . . . 7.83 114.013 -178.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -68.86 -43.85 74.53 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 123.375 0.422 . . . . 8.05 111.124 173.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -66.73 -36.24 81.99 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.545 0.528 . . . . 8.01 112.351 177.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -67.5 -46.75 72.0 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.821 0.304 . . . . 8.0 111.821 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.39 -41.0 88.39 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.436 0.694 . . . . 8.28 112.523 175.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -66.92 -52.15 46.6 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.34 0.656 . . . . 8.29 111.399 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.03 -31.28 69.97 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.467 0.914 . . . . 8.36 113.467 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 58.3 m -59.15 -48.71 80.62 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.62 0.6 . . . . 8.31 112.62 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -71.29 -29.7 65.36 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.162 1.171 . . . . 8.49 114.162 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -65.7 -47.47 75.28 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.908 0.483 . . . . 8.5 111.797 171.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.2 t -64.91 -43.94 96.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 C-N-CA 124.148 0.979 . . . . 8.53 110.957 -178.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -50.82 -50.89 55.49 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.927 0.891 . . . . 8.82 111.672 172.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.55 -39.04 92.67 Favored Glycine 0 N--CA 1.466 0.671 0 N-CA-C 115.047 0.779 . . . . 8.72 115.047 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 39.6 mt -73.5 -45.26 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.377 0.671 . . . . 8.77 111.208 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 27.8 tttt -51.33 -44.63 62.05 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.654 1.181 . . . . 8.96 112.722 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 N--CA 1.468 0.441 0 O-C-N 123.794 0.684 . . . . 8.99 111.899 -179.026 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_