data_3ksp_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3ksp _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.248 0 N-CA-C 106.363 -2.695 . . . . 30.27 106.363 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 1.8 tpt -70.23 116.95 11.18 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.913 0.709 . . . . 32.35 112.913 -175.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -135.58 153.46 77.61 Favored Pre-proline 0 C--O 1.237 0.426 0 CA-C-O 119.139 -0.458 . . . . 36.14 110.03 -171.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -48.86 134.18 28.27 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 123.308 2.672 . . . . 40.43 110.616 174.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.8 t -66.37 118.63 10.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.826 -0.607 . . . . 44.97 109.661 179.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.87 -32.29 69.33 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 123.568 0.542 . . . . 47.17 111.561 175.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -63.99 -45.38 89.31 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 119.313 -0.375 . . . . 52.62 110.873 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 18.1 m80 -73.55 -36.98 65.7 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.511 -0.552 . . . . 49.28 109.511 -176.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 77.7 mt -62.01 -42.92 99.68 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.094 0.405 . . . . 48.0 112.094 176.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -67.27 -31.56 71.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 111.837 0.31 . . . . 48.05 111.837 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 29.9 tp -63.98 -47.5 80.13 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 118.451 -0.785 . . . . 46.71 110.29 170.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -52.15 -45.46 65.05 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.951 1.25 . . . . 45.74 110.834 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 61.0 m -61.92 -42.8 99.51 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 113.119 0.785 . . . . 46.5 113.119 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 tt -64.31 -43.03 95.96 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 119.261 -0.4 . . . . 46.52 111.612 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.9 mt -61.44 -32.22 72.19 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.018 0.747 . . . . 48.76 113.018 176.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.03 -47.75 49.57 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 115.249 1.574 . . . . 48.04 115.249 171.143 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -64.29 -38.37 90.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.872 -0.604 . . . . 50.87 109.995 -178.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -61.29 -42.5 98.75 Favored 'General case' 0 C--O 1.244 0.778 0 N-CA-C 112.943 0.72 . . . . 58.19 112.943 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 43.1 t60 -64.55 -52.35 58.13 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.822 -0.626 . . . . 47.18 111.102 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.76 -45.32 39.66 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.324 -0.398 . . . . 44.15 110.52 172.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 17.9 m-30 -69.65 -33.21 72.28 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 119.63 -0.224 . . . . 44.63 111.52 -175.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.9 tp -69.39 -49.92 50.83 Favored 'General case' 0 C--O 1.261 1.687 0 C-N-CA 123.375 0.67 . . . . 44.33 112.096 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' MSE . . . . . . . . . . . . . 24.4 mmt -53.66 -41.88 67.28 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.608 0.718 . . . . 43.46 111.512 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -89.15 -19.19 25.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.868 -1.06 . . . . 43.78 112.875 -170.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 71.46 39.14 61.71 Favored Glycine 0 N--CA 1.468 0.811 0 N-CA-C 111.808 -0.517 . . . . 42.15 111.808 -175.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -86.98 88.54 7.73 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 109.012 -0.736 . . . . 40.97 109.012 -177.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.8 ttt85 -64.03 -43.59 95.1 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.607 0.966 . . . . 40.58 113.607 -177.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . . . -62.23 -50.39 71.94 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.403 -0.962 . . . . 41.77 108.403 -178.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.23 -37.39 83.48 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.176 0.435 . . . . 42.89 112.176 -177.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' MSE . . . . . . . . . . . . . 41.3 tpp -66.48 -47.62 72.46 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 118.879 -0.582 . . . . 42.46 112.081 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -47.53 -39.2 15.67 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 112.726 0.639 . . . . 47.29 112.726 172.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -66.37 -28.24 68.49 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 118.71 -0.662 . . . . 48.01 111.065 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 68.4 mt -75.56 -20.65 58.49 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.25 1.204 . . . . 41.7 114.25 176.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.6 mt -83.63 135.35 34.63 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 114.324 1.231 . . . . 41.61 114.324 -169.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.7 p -69.78 159.6 33.27 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 107.782 -1.192 . . . . 43.62 107.782 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.7 p -71.51 -23.83 61.86 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.453 0.538 . . . . 44.34 112.453 -170.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -103.74 27.74 7.23 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.015 0.746 . . . . 50.61 113.015 170.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -49.73 139.43 12.95 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 122.063 -0.398 . . . . 43.42 111.948 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.8 p -144.36 152.76 41.17 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 113.989 1.107 . . . . 44.73 113.989 162.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -134.1 123.1 23.87 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 107.114 -1.439 . . . . 42.23 107.114 -172.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 2.5 mp -106.95 118.48 54.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 116.07 -0.514 . . . . 42.56 110.729 175.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -80.58 174.77 11.28 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 121.957 -0.464 . . . . 45.84 110.028 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -66.45 -8.13 43.74 Favored Glycine 0 C--O 1.22 -0.752 0 N-CA-C 117.263 1.665 . . . . 41.15 117.263 -176.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -95.37 -3.28 47.44 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 119.104 1.452 . . . . 51.28 111.301 168.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.18 11.01 76.87 Favored Glycine 0 N--CA 1.474 1.182 0 N-CA-C 116.594 1.398 . . . . 41.17 116.594 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -75.45 132.73 41.02 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 121.437 0.637 . . . . 50.11 111.529 173.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -96.56 127.45 42.57 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.927 1.291 . . . . 55.11 113.713 -177.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -114.2 141.35 47.65 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.086 0.955 . . . . 46.18 110.079 176.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.5 p30 -89.44 178.84 6.21 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 108.653 -0.869 . . . . 43.84 108.653 166.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -42.74 -63.22 0.82 Allowed 'General case' 0 N--CA 1.478 0.929 0 O-C-N 121.91 -0.494 . . . . 43.12 111.431 172.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -55.46 -47.98 75.23 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.367 1.247 . . . . 48.89 114.367 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 14.2 p -77.16 -28.71 54.19 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 118.694 0.679 . . . . 44.49 111.402 -176.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -60.68 -50.83 71.93 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.247 -1.39 . . . . 42.26 107.247 174.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 77.2 mt -59.72 -42.17 92.49 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.87 0.731 . . . . 41.93 111.794 -178.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -59.31 -36.63 75.97 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 113.031 0.752 . . . . 42.43 113.031 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -95.32 -33.09 12.67 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.322 0.86 . . . . 47.25 113.322 -169.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -112.3 -18.76 12.43 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.685 0.994 . . . . 42.67 113.685 -174.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 t -135.91 51.65 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 113.27 0.841 . . . . 44.72 113.27 -173.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -140.38 111.03 7.01 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 104.172 -2.529 . . . . 44.15 104.172 175.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -70.68 -1.24 8.92 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 N-CA-C 116.977 1.876 . . . . 45.28 116.977 -172.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -85.5 -12.17 52.44 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 113.212 0.819 . . . . 47.35 113.212 171.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -112.91 -46.59 3.1 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.892 0.877 . . . . 53.0 112.737 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 13.3 tt -125.09 135.69 63.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 C-N-CA 123.461 0.704 . . . . 47.29 110.028 -174.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.7 mp0 -127.67 109.55 11.79 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 107.492 -1.299 . . . . 48.0 107.492 176.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -80.7 133.51 35.7 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.291 0.478 . . . . 43.88 112.291 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.8 p -100.22 -26.29 13.97 Favored 'General case' 0 CA--C 1.551 0.993 0 CA-C-O 121.572 0.701 . . . . 44.22 111.593 167.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -171.06 150.07 3.0 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 114.708 1.373 . . . . 46.95 114.708 179.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -129.44 101.82 6.13 Favored 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 106.377 -1.712 . . . . 48.51 106.377 159.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 3.1 mp -82.79 118.77 31.07 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.824 0 N-CA-C 109.928 -0.397 . . . . 44.42 109.928 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.3 t -81.98 99.04 8.88 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 123.141 0.576 . . . . 46.1 110.341 171.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -69.83 -25.41 63.74 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-O 121.767 0.794 . . . . 46.9 112.972 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 28.6 t -173.93 144.85 1.06 Allowed 'General case' 0 C--O 1.246 0.891 0 N-CA-C 108.176 -1.046 . . . . 48.82 108.176 -162.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' MSE . . . . . . . . . . . . . 47.3 ttp -160.48 140.95 11.6 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 115.181 1.548 . . . . 57.91 115.181 -177.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 47.1 t -128.03 129.12 69.53 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 N-CA-C 106.977 -1.49 . . . . 49.13 106.977 171.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 54.2 t -115.27 130.17 70.29 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 C-N-CA 124.294 1.037 . . . . 48.84 108.861 175.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -127.12 119.57 26.83 Favored 'General case' 0 C--O 1.248 0.99 0 N-CA-C 109.24 -0.652 . . . . 58.22 109.24 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 57.3 t -98.29 128.04 50.17 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.868 0 N-CA-C 109.032 -0.729 . . . . 49.07 109.032 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -105.8 -156.4 0.57 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.985 -1.487 . . . . 51.58 106.985 175.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -70.26 -60.43 2.28 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 119.567 -0.853 . . . . 50.2 110.7 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.33 -2.34 16.75 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.021 1.489 . . . . 49.13 115.021 -173.349 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 61.8 p -141.53 159.84 41.39 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 123.972 0.909 . . . . 45.59 110.655 -174.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.03 143.57 44.79 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.576 -1.639 . . . . 43.08 106.576 171.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.2 tp -119.17 121.45 39.77 Favored 'General case' 0 C--O 1.251 1.165 0 N-CA-C 107.437 -1.32 . . . . 43.47 107.437 -178.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 84.1 t -116.1 128.91 73.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 O-C-N 123.788 0.68 . . . . 42.9 110.208 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -114.21 134.64 54.78 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.883 -1.155 . . . . 46.49 107.883 174.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -145.87 144.45 30.23 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.372 -0.377 . . . . 47.63 110.533 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.3 mt -105.12 117.58 51.04 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 N-CA-C 105.379 -2.082 . . . . 43.31 105.379 165.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.2 m -115.52 146.05 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-O 121.109 0.481 . . . . 42.26 111.318 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -111.4 111.78 23.06 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.335 -1.357 . . . . 44.56 107.335 166.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -92.89 134.4 35.13 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.911 0.708 . . . . 47.98 112.911 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -126.81 112.61 15.57 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.193 -1.04 . . . . 43.48 108.193 176.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -150.58 159.66 44.34 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.751 1.76 . . . . 45.59 115.751 172.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.1 m -96.99 144.36 26.97 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 123.909 0.755 . . . . 48.31 110.346 173.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -149.62 100.89 3.03 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 106.032 -1.84 . . . . 63.87 106.032 -178.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.51 32.14 52.05 Favored Glycine 0 N--CA 1.467 0.754 0 N-CA-C 115.475 0.95 . . . . 51.15 115.475 -177.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . . . 79.71 -9.01 1.5 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 114.279 1.215 . . . . 51.66 114.279 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.4 m -89.04 162.42 16.02 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 107.764 -1.198 . . . . 49.79 107.764 167.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER -127.61 128.84 46.23 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 108.718 -0.845 . . . . 50.38 108.718 -175.871 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -117.88 145.01 44.92 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.666 0.988 . . . . 45.78 113.666 -172.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.9 mt -125.54 145.65 32.57 Favored 'Isoleucine or valine' 0 C--O 1.257 1.463 0 N-CA-C 108.295 -1.002 . . . . 45.6 108.295 170.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -163.29 137.61 4.88 Favored Glycine 0 CA--C 1.505 -0.572 0 N-CA-C 109.979 -1.248 . . . . 42.68 109.979 178.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 33.6 mtp-105 -106.8 146.76 30.5 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-O 121.125 0.488 . . . . 45.46 111.719 177.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -144.84 149.75 35.94 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-O 120.891 0.377 . . . . 45.05 111.293 -176.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . 0.976 ' NH2' ' CG ' ' A' ' 103' ' ' ARG . 10.1 tpt180 -96.2 120.63 36.84 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 104.023 -2.584 . . . . 42.48 104.023 163.8 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.1 p -121.12 150.73 40.8 Favored 'General case' 0 C--O 1.247 0.947 0 C-N-CA 120.436 -0.506 . . . . 43.92 111.853 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.5 p -127.74 140.44 49.15 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.885 0 O-C-N 124.277 0.985 . . . . 41.29 109.219 171.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -135.91 155.59 50.06 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.494 0.664 . . . . 46.76 110.302 177.224 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.4 tp -125.52 134.66 51.93 Favored 'General case' 0 C--O 1.244 0.778 0 N-CA-C 108.043 -1.095 . . . . 42.83 108.043 172.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -113.12 148.93 34.3 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.458 -0.942 . . . . 53.01 108.458 173.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -119.86 122.08 40.5 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.138 -1.06 . . . . 49.75 108.138 -175.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -96.59 106.63 18.92 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.956 1.303 . . . . 46.49 110.298 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -139.88 146.88 39.85 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 107.369 -1.345 . . . . 45.84 107.369 178.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 53.39 41.05 32.15 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.131 -0.486 . . . . 49.2 112.243 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 62.97 25.52 15.09 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 114.101 1.149 . . . . 53.41 114.101 177.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -144.91 156.71 27.04 Favored Glycine 0 N--CA 1.464 0.509 0 N-CA-C 109.39 -1.484 . . . . 46.37 109.39 -179.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -100.84 148.3 25.11 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 109.586 -0.524 . . . . 43.71 109.586 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -133.59 151.42 51.7 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 116.301 -0.409 . . . . 48.65 110.482 165.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -79.88 123.25 27.59 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.074 -1.084 . . . . 44.58 108.074 173.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -112.76 -42.39 3.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.726 0.639 . . . . 43.76 112.726 -167.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -142.77 146.28 34.11 Favored 'General case' 0 C--O 1.249 1.038 0 C-N-CA 122.759 0.423 . . . . 39.88 110.608 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -145.72 144.37 30.31 Favored 'General case' 0 C--O 1.212 -0.896 0 O-C-N 123.851 0.719 . . . . 41.37 109.462 172.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -145.77 137.13 24.91 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 123.477 0.485 . . . . 39.53 110.192 175.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 23.6 mt -106.8 139.48 41.16 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-N 114.889 -1.05 . . . . 39.24 112.662 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 62.4 m -126.58 117.11 22.84 Favored Pre-proline 0 C--O 1.225 -0.216 0 N-CA-C 109.177 -0.675 . . . . 41.2 109.177 167.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.46 140.97 96.63 Favored 'Trans proline' 0 N--CA 1.481 0.789 0 C-N-CA 121.034 1.156 . . . . 44.64 113.336 -172.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 89.7 mt -117.61 157.63 26.06 Favored 'General case' 0 C--O 1.257 1.454 0 N-CA-C 107.863 -1.162 . . . . 47.28 107.863 172.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -62.33 148.31 89.94 Favored Pre-proline 0 CA--C 1.556 1.195 0 N-CA-C 114.138 1.162 . . . . 52.94 114.138 172.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -60.35 154.06 55.55 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 121.724 1.616 . . . . 54.47 113.663 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 58.7 m . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 122.655 1.217 . . . . 59.3 113.078 173.011 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' NHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . 0.412 ' O ' ' NE ' ' A' ' 103' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.248 0 N-CA-C 106.363 -2.695 . . . . 30.27 106.363 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 1.8 tpt -70.23 116.95 11.18 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.913 0.709 . . . . 32.350000000000001 112.913 -175.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -135.58 153.46 77.61 Favored Pre-proline 0 C--O 1.237 0.426 0 CA-C-O 119.139 -0.458 . . . . 36.140000000000001 110.03 -171.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -48.86 134.18 28.27 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 123.308 2.672 . . . . 40.43 110.616 174.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.8 t -66.37 118.63 10.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.826 -0.607 . . . . 44.969999999999999 109.661 179.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.87 -32.29 69.33 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 123.568 0.542 . . . . 47.170000000000002 111.561 175.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -63.99 -45.38 89.31 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 119.313 -0.375 . . . . 52.619999999999997 110.873 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 18.1 m80 -73.55 -36.98 65.7 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.511 -0.552 . . . . 49.280000000000001 109.511 -176.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 77.7 mt -62.01 -42.92 99.68 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.094 0.405 . . . . 48.0 112.094 176.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -67.27 -31.56 71.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 111.837 0.31 . . . . 48.049999999999997 111.837 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 29.9 tp -63.98 -47.5 80.13 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 118.451 -0.785 . . . . 46.710000000000001 110.29 170.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -52.15 -45.46 65.05 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.951 1.25 . . . . 45.740000000000002 110.834 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 61.0 m -61.92 -42.8 99.51 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 113.119 0.785 . . . . 46.5 113.119 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 tt -64.31 -43.03 95.96 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 119.261 -0.4 . . . . 46.520000000000003 111.612 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.9 mt -61.44 -32.22 72.19 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.018 0.747 . . . . 48.759999999999998 113.018 176.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.03 -47.75 49.57 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 115.249 1.574 . . . . 48.039999999999999 115.249 171.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -64.29 -38.37 90.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.872 -0.604 . . . . 50.869999999999997 109.995 -178.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -61.29 -42.5 98.75 Favored 'General case' 0 C--O 1.244 0.778 0 N-CA-C 112.943 0.72 . . . . 58.189999999999998 112.943 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 43.1 t60 -64.55 -52.35 58.13 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.822 -0.626 . . . . 47.18 111.102 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.76 -45.32 39.66 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.324 -0.398 . . . . 44.149999999999999 110.52 172.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . 0.461 ' CZ ' ' HB1' ' A' ' 28' ' ' ALA . 17.9 m-30 -69.65 -33.21 72.28 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 119.63 -0.224 . . . . 44.630000000000003 111.52 -175.291 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.9 tp -69.39 -49.92 50.83 Favored 'General case' 0 C--O 1.261 1.687 0 C-N-CA 123.375 0.67 . . . . 44.329999999999998 112.096 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' MSE . . . . . . . . . . . . . 24.4 mmt -53.66 -41.88 67.28 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.608 0.718 . . . . 43.460000000000001 111.512 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -89.15 -19.19 25.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.868 -1.06 . . . . 43.780000000000001 112.875 -170.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 71.46 39.14 61.71 Favored Glycine 0 N--CA 1.468 0.811 0 N-CA-C 111.808 -0.517 . . . . 42.149999999999999 111.808 -175.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -86.98 88.54 7.73 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 109.012 -0.736 . . . . 40.969999999999999 109.012 -177.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.8 ttt85 -64.03 -43.59 95.1 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.607 0.966 . . . . 40.579999999999998 113.607 -177.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . . . -62.23 -50.39 71.94 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.403 -0.962 . . . . 41.770000000000003 108.403 -178.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . 0.461 ' HB1' ' CZ ' ' A' ' 20' ' ' TYR . . . -67.23 -37.39 83.48 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.176 0.435 . . . . 42.890000000000001 112.176 -177.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' MSE . . . . . . . . . . . . . 41.3 tpp -66.48 -47.62 72.46 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 118.879 -0.582 . . . . 42.460000000000001 112.081 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -47.53 -39.2 15.67 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 112.726 0.639 . . . . 47.289999999999999 112.726 172.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -66.37 -28.24 68.49 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 118.71 -0.662 . . . . 48.009999999999998 111.065 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 68.4 mt -75.56 -20.65 58.49 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.25 1.204 . . . . 41.700000000000003 114.25 176.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.6 mt -83.63 135.35 34.63 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 114.324 1.231 . . . . 41.609999999999999 114.324 -169.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.7 p -69.78 159.6 33.27 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 107.782 -1.192 . . . . 43.619999999999997 107.782 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.7 p -71.51 -23.83 61.86 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.453 0.538 . . . . 44.340000000000003 112.453 -170.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -103.74 27.74 7.23 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.015 0.746 . . . . 50.609999999999999 113.015 170.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -49.73 139.43 12.95 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 122.063 -0.398 . . . . 43.420000000000002 111.948 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.8 p -144.36 152.76 41.17 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 113.989 1.107 . . . . 44.729999999999997 113.989 162.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -134.1 123.1 23.87 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 107.114 -1.439 . . . . 42.229999999999997 107.114 -172.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ILE . . . . . 0.455 ' N ' HD12 ' A' ' 40' ' ' ILE . 2.5 mp -106.95 118.48 54.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 116.07 -0.514 . . . . 42.560000000000002 110.729 175.121 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -80.58 174.77 11.28 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 121.957 -0.464 . . . . 45.840000000000003 110.028 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -66.45 -8.13 43.74 Favored Glycine 0 C--O 1.22 -0.752 0 N-CA-C 117.263 1.665 . . . . 41.149999999999999 117.263 -176.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -95.37 -3.28 47.44 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 119.104 1.452 . . . . 51.280000000000001 111.301 168.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.18 11.01 76.87 Favored Glycine 0 N--CA 1.474 1.182 0 N-CA-C 116.594 1.398 . . . . 41.170000000000002 116.594 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -75.45 132.73 41.02 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 121.437 0.637 . . . . 50.109999999999999 111.529 173.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -96.56 127.45 42.57 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.927 1.291 . . . . 55.109999999999999 113.713 -177.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -114.2 141.35 47.65 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.086 0.955 . . . . 46.18 110.079 176.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.5 p30 -89.44 178.84 6.21 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 108.653 -0.869 . . . . 43.840000000000003 108.653 166.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -42.74 -63.22 0.82 Allowed 'General case' 0 N--CA 1.478 0.929 0 O-C-N 121.91 -0.494 . . . . 43.119999999999997 111.431 172.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -55.46 -47.98 75.23 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.367 1.247 . . . . 48.890000000000001 114.367 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 14.2 p -77.16 -28.71 54.19 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 118.694 0.679 . . . . 44.490000000000002 111.402 -176.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -60.68 -50.83 71.93 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.247 -1.39 . . . . 42.259999999999998 107.247 174.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 77.2 mt -59.72 -42.17 92.49 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.87 0.731 . . . . 41.93 111.794 -178.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -59.31 -36.63 75.97 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 113.031 0.752 . . . . 42.43 113.031 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -95.32 -33.09 12.67 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.322 0.86 . . . . 47.25 113.322 -169.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -112.3 -18.76 12.43 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.685 0.994 . . . . 42.670000000000002 113.685 -174.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 t -135.91 51.65 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 113.27 0.841 . . . . 44.719999999999999 113.27 -173.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -140.38 111.03 7.01 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 104.172 -2.529 . . . . 44.149999999999999 104.172 175.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -70.68 -1.24 8.92 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 N-CA-C 116.977 1.876 . . . . 45.280000000000001 116.977 -172.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -85.5 -12.17 52.44 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 113.212 0.819 . . . . 47.350000000000001 113.212 171.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -112.91 -46.59 3.1 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.892 0.877 . . . . 53.0 112.737 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 13.3 tt -125.09 135.69 63.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 C-N-CA 123.461 0.704 . . . . 47.289999999999999 110.028 -174.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.7 mp0 -127.67 109.55 11.79 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 107.492 -1.299 . . . . 48.0 107.492 176.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -80.7 133.51 35.7 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.291 0.478 . . . . 43.880000000000003 112.291 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . 0.599 ' HB3' ' HE1' ' A' ' 97' ' ' MSE . 16.8 p -100.22 -26.29 13.97 Favored 'General case' 0 CA--C 1.551 0.993 0 CA-C-O 121.572 0.701 . . . . 44.219999999999999 111.593 167.9 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -171.06 150.07 3.0 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 114.708 1.373 . . . . 46.950000000000003 114.708 179.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -129.44 101.82 6.13 Favored 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 106.377 -1.712 . . . . 48.509999999999998 106.377 159.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 3.1 mp -82.79 118.77 31.07 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.824 0 N-CA-C 109.928 -0.397 . . . . 44.420000000000002 109.928 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.3 t -81.98 99.04 8.88 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 123.141 0.576 . . . . 46.100000000000001 110.341 171.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -69.83 -25.41 63.74 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-O 121.767 0.794 . . . . 46.899999999999999 112.972 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 28.6 t -173.93 144.85 1.06 Allowed 'General case' 0 C--O 1.246 0.891 0 N-CA-C 108.176 -1.046 . . . . 48.82 108.176 -162.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' MSE . . . . . . . . . . . . . 47.3 ttp -160.48 140.95 11.6 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 115.181 1.548 . . . . 57.909999999999997 115.181 -177.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 47.1 t -128.03 129.12 69.53 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 N-CA-C 106.977 -1.49 . . . . 49.130000000000003 106.977 171.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 54.2 t -115.27 130.17 70.29 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 C-N-CA 124.294 1.037 . . . . 48.840000000000003 108.861 175.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -127.12 119.57 26.83 Favored 'General case' 0 C--O 1.248 0.99 0 N-CA-C 109.24 -0.652 . . . . 58.219999999999999 109.24 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 57.3 t -98.29 128.04 50.17 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.868 0 N-CA-C 109.032 -0.729 . . . . 49.07 109.032 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -105.8 -156.4 0.57 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.985 -1.487 . . . . 51.579999999999998 106.985 175.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -70.26 -60.43 2.28 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 119.567 -0.853 . . . . 50.200000000000003 110.7 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.33 -2.34 16.75 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.021 1.489 . . . . 49.130000000000003 115.021 -173.349 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 61.8 p -141.53 159.84 41.39 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 123.972 0.909 . . . . 45.590000000000003 110.655 -174.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.03 143.57 44.79 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.576 -1.639 . . . . 43.079999999999998 106.576 171.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.2 tp -119.17 121.45 39.77 Favored 'General case' 0 C--O 1.251 1.165 0 N-CA-C 107.437 -1.32 . . . . 43.469999999999999 107.437 -178.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 84.1 t -116.1 128.91 73.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 O-C-N 123.788 0.68 . . . . 42.899999999999999 110.208 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -114.21 134.64 54.78 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.883 -1.155 . . . . 46.490000000000002 107.883 174.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -145.87 144.45 30.23 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.372 -0.377 . . . . 47.630000000000003 110.533 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.3 mt -105.12 117.58 51.04 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 N-CA-C 105.379 -2.082 . . . . 43.310000000000002 105.379 165.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.2 m -115.52 146.05 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-O 121.109 0.481 . . . . 42.259999999999998 111.318 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -111.4 111.78 23.06 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.335 -1.357 . . . . 44.560000000000002 107.335 166.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -92.89 134.4 35.13 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.911 0.708 . . . . 47.979999999999997 112.911 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -126.81 112.61 15.57 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.193 -1.04 . . . . 43.479999999999997 108.193 176.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -150.58 159.66 44.34 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.751 1.76 . . . . 45.590000000000003 115.751 172.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.1 m -96.99 144.36 26.97 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 123.909 0.755 . . . . 48.310000000000002 110.346 173.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -149.62 100.89 3.03 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 106.032 -1.84 . . . . 63.869999999999997 106.032 -178.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.51 32.14 52.05 Favored Glycine 0 N--CA 1.467 0.754 0 N-CA-C 115.475 0.95 . . . . 51.149999999999999 115.475 -177.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . . . 79.71 -9.01 1.5 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 114.279 1.215 . . . . 51.659999999999997 114.279 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.4 m -89.04 162.42 16.02 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 107.764 -1.198 . . . . 49.789999999999999 107.764 167.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' MSE . . . . . 0.599 ' HE1' ' HB3' ' A' ' 65' ' ' SER . 0.0 OUTLIER -127.61 128.84 46.23 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 108.718 -0.845 . . . . 50.380000000000003 108.718 -175.871 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -117.88 145.01 44.92 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.666 0.988 . . . . 45.780000000000001 113.666 -172.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.9 mt -125.54 145.65 32.57 Favored 'Isoleucine or valine' 0 C--O 1.257 1.463 0 N-CA-C 108.295 -1.002 . . . . 45.600000000000001 108.295 170.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -163.29 137.61 4.88 Favored Glycine 0 CA--C 1.505 -0.572 0 N-CA-C 109.979 -1.248 . . . . 42.68 109.979 178.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 33.6 mtp-105 -106.8 146.76 30.5 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-O 121.125 0.488 . . . . 45.460000000000001 111.719 177.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -144.84 149.75 35.94 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-O 120.891 0.377 . . . . 45.049999999999997 111.293 -176.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . 1.167 ' CG ' HH21 ' A' ' 103' ' ' ARG . 10.1 tpt180 -96.2 120.63 36.84 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 104.023 -2.584 . . . . 46.469999999999999 104.023 163.8 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.1 p -121.12 150.73 40.8 Favored 'General case' 0 C--O 1.247 0.947 0 C-N-CA 120.436 -0.506 . . . . 43.920000000000002 111.853 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.5 p -127.74 140.44 49.15 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.885 0 O-C-N 124.277 0.985 . . . . 41.289999999999999 109.219 171.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -135.91 155.59 50.06 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.494 0.664 . . . . 46.759999999999998 110.302 177.224 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.4 tp -125.52 134.66 51.93 Favored 'General case' 0 C--O 1.244 0.778 0 N-CA-C 108.043 -1.095 . . . . 42.829999999999998 108.043 172.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -113.12 148.93 34.3 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.458 -0.942 . . . . 53.009999999999998 108.458 173.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -119.86 122.08 40.5 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.138 -1.06 . . . . 49.75 108.138 -175.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -96.59 106.63 18.92 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.956 1.303 . . . . 46.490000000000002 110.298 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -139.88 146.88 39.85 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 107.369 -1.345 . . . . 45.840000000000003 107.369 178.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 53.39 41.05 32.15 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.131 -0.486 . . . . 49.200000000000003 112.243 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 62.97 25.52 15.09 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 114.101 1.149 . . . . 53.409999999999997 114.101 177.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -144.91 156.71 27.04 Favored Glycine 0 N--CA 1.464 0.509 0 N-CA-C 109.39 -1.484 . . . . 46.369999999999997 109.39 -179.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -100.84 148.3 25.11 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 109.586 -0.524 . . . . 43.710000000000001 109.586 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -133.59 151.42 51.7 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 116.301 -0.409 . . . . 48.649999999999999 110.482 165.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -79.88 123.25 27.59 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.074 -1.084 . . . . 44.579999999999998 108.074 173.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -112.76 -42.39 3.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.726 0.639 . . . . 43.759999999999998 112.726 -167.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -142.77 146.28 34.11 Favored 'General case' 0 C--O 1.249 1.038 0 C-N-CA 122.759 0.423 . . . . 39.880000000000003 110.608 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -145.72 144.37 30.31 Favored 'General case' 0 C--O 1.212 -0.896 0 O-C-N 123.851 0.719 . . . . 41.369999999999997 109.462 172.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -145.77 137.13 24.91 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 123.477 0.485 . . . . 39.530000000000001 110.192 175.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 23.6 mt -106.8 139.48 41.16 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-N 114.889 -1.05 . . . . 39.240000000000002 112.662 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 62.4 m -126.58 117.11 22.84 Favored Pre-proline 0 C--O 1.225 -0.216 0 N-CA-C 109.177 -0.675 . . . . 41.200000000000003 109.177 167.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.46 140.97 96.63 Favored 'Trans proline' 0 N--CA 1.481 0.789 0 C-N-CA 121.034 1.156 . . . . 44.640000000000001 113.336 -172.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 89.7 mt -117.61 157.63 26.06 Favored 'General case' 0 C--O 1.257 1.454 0 N-CA-C 107.863 -1.162 . . . . 47.280000000000001 107.863 172.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -62.33 148.31 89.94 Favored Pre-proline 0 CA--C 1.556 1.195 0 N-CA-C 114.138 1.162 . . . . 52.939999999999998 114.138 172.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -60.35 154.06 55.55 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 121.724 1.616 . . . . 54.469999999999999 113.663 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 58.7 m . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 122.655 1.217 . . . . 59.299999999999997 113.078 173.011 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' NHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.248 0 N-CA-C 106.363 -2.695 . . . . 30.27 106.363 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 1.8 tpt -70.23 116.95 11.18 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.913 0.709 . . . . 32.350000000000001 112.913 -175.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -135.58 153.46 77.61 Favored Pre-proline 0 C--O 1.237 0.426 0 CA-C-O 119.139 -0.458 . . . . 36.140000000000001 110.03 -171.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -48.86 134.18 28.27 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 123.308 2.672 . . . . 40.43 110.616 174.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.8 t -66.37 118.63 10.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.826 -0.607 . . . . 44.969999999999999 109.661 179.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.87 -32.29 69.33 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 123.568 0.542 . . . . 47.170000000000002 111.561 175.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -63.99 -45.38 89.31 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 119.313 -0.375 . . . . 52.619999999999997 110.873 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 18.1 m80 -73.55 -36.98 65.7 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.511 -0.552 . . . . 49.280000000000001 109.511 -176.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 77.7 mt -62.01 -42.92 99.68 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.094 0.405 . . . . 48.0 112.094 176.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -67.27 -31.56 71.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 111.837 0.31 . . . . 48.049999999999997 111.837 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 29.9 tp -63.98 -47.5 80.13 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 118.451 -0.785 . . . . 46.710000000000001 110.29 170.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -52.15 -45.46 65.05 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.951 1.25 . . . . 45.740000000000002 110.834 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 61.0 m -61.92 -42.8 99.51 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 113.119 0.785 . . . . 46.5 113.119 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 tt -64.31 -43.03 95.96 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 119.261 -0.4 . . . . 46.520000000000003 111.612 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.9 mt -61.44 -32.22 72.19 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.018 0.747 . . . . 48.759999999999998 113.018 176.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.03 -47.75 49.57 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 115.249 1.574 . . . . 48.039999999999999 115.249 171.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -64.29 -38.37 90.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.872 -0.604 . . . . 50.869999999999997 109.995 -178.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -61.29 -42.5 98.75 Favored 'General case' 0 C--O 1.244 0.778 0 N-CA-C 112.943 0.72 . . . . 58.189999999999998 112.943 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 43.1 t60 -64.55 -52.35 58.13 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.822 -0.626 . . . . 47.18 111.102 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.76 -45.32 39.66 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.324 -0.398 . . . . 44.149999999999999 110.52 172.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.461 ' CZ ' ' HB1' ' A' ' 28' ' ' ALA . 17.9 m-30 -69.65 -33.21 72.28 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 119.63 -0.224 . . . . 44.630000000000003 111.52 -175.291 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.9 tp -69.39 -49.92 50.83 Favored 'General case' 0 C--O 1.261 1.687 0 C-N-CA 123.375 0.67 . . . . 44.329999999999998 112.096 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' MSE . . . . . . . . . . . . . 24.4 mmt -53.66 -41.88 67.28 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.608 0.718 . . . . 43.460000000000001 111.512 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -89.15 -19.19 25.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.868 -1.06 . . . . 43.780000000000001 112.875 -170.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 71.46 39.14 61.71 Favored Glycine 0 N--CA 1.468 0.811 0 N-CA-C 111.808 -0.517 . . . . 42.149999999999999 111.808 -175.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -86.98 88.54 7.73 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 109.012 -0.736 . . . . 40.969999999999999 109.012 -177.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.8 ttt85 -64.03 -43.59 95.1 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.607 0.966 . . . . 40.579999999999998 113.607 -177.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . . . -62.23 -50.39 71.94 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.403 -0.962 . . . . 41.770000000000003 108.403 -178.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.461 ' HB1' ' CZ ' ' A' ' 20' ' ' TYR . . . -67.23 -37.39 83.48 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.176 0.435 . . . . 42.890000000000001 112.176 -177.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' MSE . . . . . . . . . . . . . 41.3 tpp -66.48 -47.62 72.46 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 118.879 -0.582 . . . . 42.460000000000001 112.081 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -47.53 -39.2 15.67 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 112.726 0.639 . . . . 47.289999999999999 112.726 172.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -66.37 -28.24 68.49 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 118.71 -0.662 . . . . 48.009999999999998 111.065 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 68.4 mt -75.56 -20.65 58.49 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.25 1.204 . . . . 41.700000000000003 114.25 176.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.6 mt -83.63 135.35 34.63 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 114.324 1.231 . . . . 41.609999999999999 114.324 -169.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.7 p -69.78 159.6 33.27 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 107.782 -1.192 . . . . 43.619999999999997 107.782 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.7 p -71.51 -23.83 61.86 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.453 0.538 . . . . 44.340000000000003 112.453 -170.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -103.74 27.74 7.23 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.015 0.746 . . . . 50.609999999999999 113.015 170.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -49.73 139.43 12.95 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 122.063 -0.398 . . . . 43.420000000000002 111.948 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.8 p -144.36 152.76 41.17 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 113.989 1.107 . . . . 44.729999999999997 113.989 162.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -134.1 123.1 23.87 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 107.114 -1.439 . . . . 42.229999999999997 107.114 -172.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.455 ' N ' HD12 ' A' ' 40' ' ' ILE . 2.5 mp -106.95 118.48 54.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 116.07 -0.514 . . . . 42.560000000000002 110.729 175.121 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -80.58 174.77 11.28 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 121.957 -0.464 . . . . 45.840000000000003 110.028 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -66.45 -8.13 43.74 Favored Glycine 0 C--O 1.22 -0.752 0 N-CA-C 117.263 1.665 . . . . 41.149999999999999 117.263 -176.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -95.37 -3.28 47.44 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 119.104 1.452 . . . . 51.280000000000001 111.301 168.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 85.18 11.01 76.87 Favored Glycine 0 N--CA 1.474 1.182 0 N-CA-C 116.594 1.398 . . . . 41.170000000000002 116.594 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -75.45 132.73 41.02 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 121.437 0.637 . . . . 50.109999999999999 111.529 173.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -96.56 127.45 42.57 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.927 1.291 . . . . 55.109999999999999 113.713 -177.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -114.2 141.35 47.65 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.086 0.955 . . . . 46.18 110.079 176.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.5 p30 -89.44 178.84 6.21 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 108.653 -0.869 . . . . 43.840000000000003 108.653 166.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -42.74 -63.22 0.82 Allowed 'General case' 0 N--CA 1.478 0.929 0 O-C-N 121.91 -0.494 . . . . 43.119999999999997 111.431 172.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -55.46 -47.98 75.23 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.367 1.247 . . . . 48.890000000000001 114.367 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 14.2 p -77.16 -28.71 54.19 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 118.694 0.679 . . . . 44.490000000000002 111.402 -176.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -60.68 -50.83 71.93 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.247 -1.39 . . . . 42.259999999999998 107.247 174.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 77.2 mt -59.72 -42.17 92.49 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.87 0.731 . . . . 41.93 111.794 -178.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -59.31 -36.63 75.97 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 113.031 0.752 . . . . 42.43 113.031 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -95.32 -33.09 12.67 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.322 0.86 . . . . 47.25 113.322 -169.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -112.3 -18.76 12.43 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.685 0.994 . . . . 42.670000000000002 113.685 -174.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 t -135.91 51.65 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 113.27 0.841 . . . . 44.719999999999999 113.27 -173.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -140.38 111.03 7.01 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 104.172 -2.529 . . . . 44.149999999999999 104.172 175.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -70.68 -1.24 8.92 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 N-CA-C 116.977 1.876 . . . . 45.280000000000001 116.977 -172.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -85.5 -12.17 52.44 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 113.212 0.819 . . . . 47.350000000000001 113.212 171.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -112.91 -46.59 3.1 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.892 0.877 . . . . 53.0 112.737 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 13.3 tt -125.09 135.69 63.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 C-N-CA 123.461 0.704 . . . . 47.289999999999999 110.028 -174.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.7 mp0 -127.67 109.55 11.79 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 107.492 -1.299 . . . . 48.0 107.492 176.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -80.7 133.51 35.7 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.291 0.478 . . . . 43.880000000000003 112.291 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . 0.599 ' HB3' ' HE1' ' A' ' 97' ' ' MSE . 16.8 p -100.22 -26.29 13.97 Favored 'General case' 0 CA--C 1.551 0.993 0 CA-C-O 121.572 0.701 . . . . 44.219999999999999 111.593 167.9 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -171.06 150.07 3.0 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 114.708 1.373 . . . . 46.950000000000003 114.708 179.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -129.44 101.82 6.13 Favored 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 106.377 -1.712 . . . . 48.509999999999998 106.377 159.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 3.1 mp -82.79 118.77 31.07 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.824 0 N-CA-C 109.928 -0.397 . . . . 44.420000000000002 109.928 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.3 t -81.98 99.04 8.88 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 123.141 0.576 . . . . 46.100000000000001 110.341 171.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -69.83 -25.41 63.74 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-O 121.767 0.794 . . . . 46.899999999999999 112.972 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 28.6 t -173.93 144.85 1.06 Allowed 'General case' 0 C--O 1.246 0.891 0 N-CA-C 108.176 -1.046 . . . . 48.82 108.176 -162.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' MSE . . . . . . . . . . . . . 47.3 ttp -160.48 140.95 11.6 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 115.181 1.548 . . . . 57.909999999999997 115.181 -177.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 47.1 t -128.03 129.12 69.53 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 N-CA-C 106.977 -1.49 . . . . 49.130000000000003 106.977 171.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 54.2 t -115.27 130.17 70.29 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 C-N-CA 124.294 1.037 . . . . 48.840000000000003 108.861 175.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -127.12 119.57 26.83 Favored 'General case' 0 C--O 1.248 0.99 0 N-CA-C 109.24 -0.652 . . . . 58.219999999999999 109.24 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 57.3 t -98.29 128.04 50.17 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.868 0 N-CA-C 109.032 -0.729 . . . . 49.07 109.032 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -105.8 -156.4 0.57 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.985 -1.487 . . . . 51.579999999999998 106.985 175.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -70.26 -60.43 2.28 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 119.567 -0.853 . . . . 50.200000000000003 110.7 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.33 -2.34 16.75 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.021 1.489 . . . . 49.130000000000003 115.021 -173.349 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 61.8 p -141.53 159.84 41.39 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 123.972 0.909 . . . . 45.590000000000003 110.655 -174.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -136.03 143.57 44.79 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.576 -1.639 . . . . 43.079999999999998 106.576 171.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.2 tp -119.17 121.45 39.77 Favored 'General case' 0 C--O 1.251 1.165 0 N-CA-C 107.437 -1.32 . . . . 43.469999999999999 107.437 -178.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 84.1 t -116.1 128.91 73.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 O-C-N 123.788 0.68 . . . . 42.899999999999999 110.208 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -114.21 134.64 54.78 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.883 -1.155 . . . . 46.490000000000002 107.883 174.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -145.87 144.45 30.23 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.372 -0.377 . . . . 47.630000000000003 110.533 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.3 mt -105.12 117.58 51.04 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 N-CA-C 105.379 -2.082 . . . . 43.310000000000002 105.379 165.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.2 m -115.52 146.05 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-O 121.109 0.481 . . . . 42.259999999999998 111.318 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -111.4 111.78 23.06 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.335 -1.357 . . . . 44.560000000000002 107.335 166.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -92.89 134.4 35.13 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.911 0.708 . . . . 47.979999999999997 112.911 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -126.81 112.61 15.57 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.193 -1.04 . . . . 43.479999999999997 108.193 176.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -150.58 159.66 44.34 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.751 1.76 . . . . 45.590000000000003 115.751 172.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.1 m -96.99 144.36 26.97 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 123.909 0.755 . . . . 48.310000000000002 110.346 173.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -149.62 100.89 3.03 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 106.032 -1.84 . . . . 63.869999999999997 106.032 -178.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.51 32.14 52.05 Favored Glycine 0 N--CA 1.467 0.754 0 N-CA-C 115.475 0.95 . . . . 51.149999999999999 115.475 -177.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . . . 79.71 -9.01 1.5 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 114.279 1.215 . . . . 51.659999999999997 114.279 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.4 m -89.04 162.42 16.02 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 107.764 -1.198 . . . . 49.789999999999999 107.764 167.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' MSE . . . . . 0.599 ' HE1' ' HB3' ' A' ' 65' ' ' SER . 0.0 OUTLIER -127.61 128.84 46.23 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 108.718 -0.845 . . . . 50.380000000000003 108.718 -175.871 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -117.88 145.01 44.92 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.666 0.988 . . . . 45.780000000000001 113.666 -172.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.9 mt -125.54 145.65 32.57 Favored 'Isoleucine or valine' 0 C--O 1.257 1.463 0 N-CA-C 108.295 -1.002 . . . . 45.600000000000001 108.295 170.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -163.29 137.61 4.88 Favored Glycine 0 CA--C 1.505 -0.572 0 N-CA-C 109.979 -1.248 . . . . 42.68 109.979 178.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 33.6 mtp-105 -106.8 146.76 30.5 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-O 121.125 0.488 . . . . 45.460000000000001 111.719 177.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -144.84 149.75 35.94 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-O 120.891 0.377 . . . . 45.049999999999997 111.293 -176.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . 1.167 ' CG ' HH21 ' A' ' 103' ' ' ARG . 10.1 tpt180 -96.2 120.63 36.84 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 104.023 -2.584 . . . . 46.469999999999999 104.023 163.8 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.1 p -121.12 150.73 40.8 Favored 'General case' 0 C--O 1.247 0.947 0 C-N-CA 120.436 -0.506 . . . . 43.920000000000002 111.853 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.5 p -127.74 140.44 49.15 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.885 0 O-C-N 124.277 0.985 . . . . 41.289999999999999 109.219 171.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -135.91 155.59 50.06 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.494 0.664 . . . . 46.759999999999998 110.302 177.224 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.4 tp -125.52 134.66 51.93 Favored 'General case' 0 C--O 1.244 0.778 0 N-CA-C 108.043 -1.095 . . . . 42.829999999999998 108.043 172.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -113.12 148.93 34.3 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.458 -0.942 . . . . 53.009999999999998 108.458 173.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -119.86 122.08 40.5 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.138 -1.06 . . . . 49.75 108.138 -175.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -96.59 106.63 18.92 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.956 1.303 . . . . 46.490000000000002 110.298 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -139.88 146.88 39.85 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 107.369 -1.345 . . . . 45.840000000000003 107.369 178.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 53.39 41.05 32.15 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.131 -0.486 . . . . 49.200000000000003 112.243 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 62.97 25.52 15.09 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 114.101 1.149 . . . . 53.409999999999997 114.101 177.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -144.91 156.71 27.04 Favored Glycine 0 N--CA 1.464 0.509 0 N-CA-C 109.39 -1.484 . . . . 46.369999999999997 109.39 -179.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -100.84 148.3 25.11 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 109.586 -0.524 . . . . 43.710000000000001 109.586 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -133.59 151.42 51.7 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 116.301 -0.409 . . . . 48.649999999999999 110.482 165.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -79.88 123.25 27.59 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.074 -1.084 . . . . 44.579999999999998 108.074 173.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -112.76 -42.39 3.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.726 0.639 . . . . 43.759999999999998 112.726 -167.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -142.77 146.28 34.11 Favored 'General case' 0 C--O 1.249 1.038 0 C-N-CA 122.759 0.423 . . . . 39.880000000000003 110.608 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -145.72 144.37 30.31 Favored 'General case' 0 C--O 1.212 -0.896 0 O-C-N 123.851 0.719 . . . . 41.369999999999997 109.462 172.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -145.77 137.13 24.91 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 123.477 0.485 . . . . 39.530000000000001 110.192 175.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 23.6 mt -106.8 139.48 41.16 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-N 114.889 -1.05 . . . . 39.240000000000002 112.662 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 62.4 m -126.58 117.11 22.84 Favored Pre-proline 0 C--O 1.225 -0.216 0 N-CA-C 109.177 -0.675 . . . . 41.200000000000003 109.177 167.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.46 140.97 96.63 Favored 'Trans proline' 0 N--CA 1.481 0.789 0 C-N-CA 121.034 1.156 . . . . 44.640000000000001 113.336 -172.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 89.7 mt -117.61 157.63 26.06 Favored 'General case' 0 C--O 1.257 1.454 0 N-CA-C 107.863 -1.162 . . . . 47.280000000000001 107.863 172.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -62.33 148.31 89.94 Favored Pre-proline 0 CA--C 1.556 1.195 0 N-CA-C 114.138 1.162 . . . . 52.939999999999998 114.138 172.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -60.35 154.06 55.55 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 121.724 1.616 . . . . 54.469999999999999 113.663 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 58.7 m . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 122.655 1.217 . . . . 59.299999999999997 113.078 173.011 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' NHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 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