data_6oyd_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6oyd _Structure_validation_residue.Date_analyzed 2020-05-15 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 ' 1' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo . . . . . 0 C--O 1.208 -0.981 0 CA-C-O 119.685 -0.214 . . . . 39.46 112.651 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -90.05 137.88 31.97 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 105.412 -2.07 . . . . 43.55 105.412 161.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 76.1 mt -125.34 120.22 57.45 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 108.664 -0.865 . . . . 26.7 108.664 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.5 p -86.84 171.78 10.6 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 105.575 -2.009 . . . . 27.38 105.575 177.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.6 mt -119.45 23.82 11.02 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.434 -0.791 . . . . 17.45 112.095 -165.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -68.95 -25.97 64.82 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 122.205 -0.309 . . . . 23.81 110.671 175.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -121.49 163.03 19.47 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.506 1.522 . . . . 33.63 110.71 171.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -54.33 135.39 60.95 Favored Pre-proline 0 N--CA 1.498 1.958 0 O-C-N 124.668 1.23 . . . . 46.48 108.799 173.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -81.61 73.12 5.99 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 122.238 1.959 . . . . 16.21 111.076 -179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 24.5 mt -89.17 141.09 28.82 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 108.405 -0.961 . . . . 26.17 108.405 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.76 159.07 41.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.201 -1.037 . . . . 23.69 108.201 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 79.4 p -83.3 136.9 34.21 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 113.975 -1.466 . . . . 32.82 108.995 172.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.21 154.36 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 N-CA-C 107.112 -1.44 . . . . 19.44 107.112 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -125.53 123.53 39.33 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 105.285 -2.117 . . . . 28.55 105.285 170.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.9 tt -147.49 135.94 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 CA-C-N 114.499 -1.228 . . . . 21.2 108.396 -177.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 53.51 37.51 56.23 Favored Glycine 0 N--CA 1.478 1.473 0 CA-C-O 116.636 -2.202 . . . . 22.16 110.731 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.71 1.42 61.84 Favored Glycine 0 C--O 1.274 2.626 0 CA-C-O 117.217 -1.88 . . . . 18.34 115.385 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -110.44 148.96 30.99 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 118.004 0.902 . . . . 28.24 110.996 -173.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 24.2 mt -100.33 133.34 44.89 Favored 'General case' 0 C--O 1.247 0.928 0 O-C-N 126.093 2.121 . . . . 21.07 108.772 175.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -142.72 163.91 31.55 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-N 115.059 -0.973 . . . . 33.62 110.627 -178.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -106.07 144.88 32.15 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 108.281 -1.007 . . . . 36.51 108.281 169.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -145.05 154.41 42.49 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 124.874 1.359 . . . . 14.73 110.381 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.8 tp -91.81 127.02 37.11 Favored 'General case' 0 C--O 1.274 2.359 0 CA-C-O 116.77 -1.586 . . . . 22.56 107.594 -177.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.1 mt -74.03 109.83 7.84 Favored 'General case' 0 C--O 1.261 1.699 0 N-CA-C 107.017 -1.475 . . . . 20.44 107.017 170.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -123.28 97.81 5.58 Favored 'General case' 0 C--O 1.263 1.806 0 C-N-CA 120.345 -0.542 . . . . 18.4 110.504 -164.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.0 p -68.38 -16.65 64.0 Favored 'General case' 0 C--O 1.265 1.919 0 CA-C-O 117.35 -1.309 . . . . 13.94 110.844 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -87.87 1.88 85.43 Favored Glycine 0 N--CA 1.473 1.132 0 CA-C-N 120.968 1.713 . . . . 17.59 113.435 179.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -106.22 120.46 41.89 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.4 1.48 . . . . 15.1 107.927 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -67.72 -41.25 83.81 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 120.055 -0.658 . . . . 24.56 109.554 174.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -120.07 164.58 15.94 Favored 'General case' 0 C--O 1.258 1.544 0 O-C-N 126.093 2.121 . . . . 33.11 109.002 -170.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.1 m -94.4 126.18 39.5 Favored 'General case' 0 C--O 1.266 1.943 0 CA-C-N 114.412 -1.267 . . . . 17.26 109.307 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 10.4 t -130.07 119.89 48.06 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.13 0 N-CA-C 106.911 -1.514 . . . . 24.78 106.911 -172.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.7 mt -117.19 148.23 41.79 Favored 'General case' 0 C--O 1.259 1.578 0 CA-C-O 117.578 -1.201 . . . . 24.2 111.718 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -57.96 158.33 6.76 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 127.608 3.067 . . . . 43.11 107.893 177.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -49.5 130.78 20.65 Favored 'General case' 0 C--O 1.276 2.471 0 N-CA-C 108.099 -1.074 . . . . 42.35 108.099 -178.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 25.5 ptm -156.67 161.04 39.88 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 126.431 2.332 . . . . 33.2 106.089 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -83.84 108.79 17.08 Favored 'General case' 0 C--O 1.279 2.613 0 O-C-N 126.504 2.377 . . . . 53.76 108.886 -178.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.7 mt -120.3 142.77 34.41 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 124.386 1.054 . . . . 42.06 108.538 175.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -80.9 151.42 18.7 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.402 1.402 . . . . 43.92 109.416 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 99.97 -168.39 21.25 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 125.792 1.932 . . . . 45.91 113.793 160.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 12.0 ttm-85 -75.97 152.0 37.12 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.075 1.75 . . . . 83.21 108.408 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -149.78 170.98 17.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 117.644 -1.17 . . . . 48.66 108.63 174.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -136.94 132.15 18.2 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 125.588 1.805 . . . . 53.55 107.887 -173.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -65.43 143.84 77.59 Favored 'Trans proline' 0 C--O 1.202 -1.299 0 C-N-CA 122.322 2.015 . . . . 41.65 109.625 -178.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -150.38 147.14 27.22 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 106.789 -1.559 . . . . 52.75 106.789 -177.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' MET . . . . . 0.416 ' CE ' ' CG ' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -114.75 135.5 54.11 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 104.439 -2.43 . . . . 54.77 104.439 172.391 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 45.6 pt -130.41 147.95 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 125.07 1.482 . . . . 30.43 108.883 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -112.86 148.74 18.51 Favored Glycine 0 C--O 1.22 -0.77 0 C-N-CA 120.318 -0.944 . . . . 23.26 112.695 -174.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -144.74 -155.56 6.5 Favored Glycine 0 C--O 1.198 -2.136 0 O-C-N 125.22 1.188 . . . . 22.18 111.172 177.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . 0.312 0.1 OUTLIER -56.39 -43.4 77.38 Favored 'Isoleucine or valine' 0 C--O 1.256 1.416 0 CA-C-O 115.985 -1.96 . . . . 27.71 115.219 -173.975 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -108.16 8.98 36.14 Favored Glycine 0 C--O 1.206 -1.604 0 N-CA-C 116.637 1.415 . . . . 29.56 116.637 -171.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.61 -148.6 19.69 Favored Glycine 0 C--N 1.299 -1.482 0 C-N-CA 125.788 1.661 . . . . 29.12 111.156 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -113.08 161.91 16.54 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.858 0.863 . . . . 26.57 110.969 -166.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 17.5 pt -136.48 151.96 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 108.947 -0.76 . . . . 27.94 108.947 172.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . 0.416 ' CG ' ' CE ' ' A' ' 46' ' ' MET . 0.0 OUTLIER -89.44 126.31 35.51 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 106.128 -1.805 . . . . 47.15 106.128 172.8 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.4 m -124.67 161.23 28.46 Favored 'Isoleucine or valine' 0 C--O 1.279 2.642 0 O-C-N 126.28 2.237 . . . . 28.57 110.418 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 73.4 mtm-85 -97.86 128.02 44.19 Favored 'General case' 0 C--O 1.263 1.765 0 N-CA-C 107.989 -1.115 . . . . 37.08 107.989 167.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -92.53 119.17 31.74 Favored 'General case' 0 C--O 1.256 1.431 0 C-N-CA 124.856 1.262 . . . . 36.24 108.055 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -114.3 125.38 53.82 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.168 1.787 . . . . 33.63 109.25 173.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -102.13 156.33 17.62 Favored 'General case' 0 C--O 1.28 2.689 0 CA-C-O 117.864 -1.065 . . . . 41.25 109.062 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.7 tp60 53.68 49.91 18.28 Favored 'General case' 0 C--O 1.266 1.924 0 O-C-N 127.619 3.074 . . . . 47.85 106.926 173.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 43.7 mm -94.67 132.7 37.94 Favored 'Isoleucine or valine' 0 C--O 1.27 2.183 0 N-CA-C 108.287 -1.005 . . . . 28.86 108.287 175.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.5 tp -85.22 133.53 34.18 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 108.769 -0.826 . . . . 22.23 108.769 177.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 9.6 tt -135.97 135.81 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.582 -1.266 . . . . 29.77 107.582 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -109.32 113.54 26.45 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 105.228 -2.138 . . . . 54.59 105.228 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 50.9 mt -109.91 108.32 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 125.608 1.818 . . . . 28.33 106.238 -168.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.6 t 46.89 41.83 11.27 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 117.271 -1.347 . . . . 39.87 108.858 -175.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.06 7.6 73.53 Favored Glycine 0 N--CA 1.481 1.648 0 CA-C-N 119.259 0.936 . . . . 44.46 112.922 169.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' HIS . . . . . 0.725 ' CD2' ' O ' ' A' ' 231' ' ' HOH . 47.7 m80 -112.58 130.92 55.86 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 107.363 -1.347 . . . . 31.32 107.363 177.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -89.41 138.97 30.98 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 118.844 0.747 . . . . 43.72 110.577 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -139.85 155.41 47.24 Favored 'General case' 0 C--O 1.265 1.909 0 N-CA-C 107.717 -1.216 . . . . 22.63 107.717 175.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.9 mt -130.62 130.43 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 N-CA-C 106.113 -1.81 . . . . 31.35 106.113 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -178.57 -165.63 33.46 Favored Glycine 0 CA--C 1.494 -1.229 0 CA-C-O 122.596 1.109 . . . . 20.62 114.14 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.1 m -74.52 133.78 42.28 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-N 114.754 -0.723 . . . . 26.34 110.094 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 59.3 t -123.65 129.14 74.69 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 C-N-CA 125.741 1.616 . . . . 25.72 106.812 172.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.2 mt -98.04 133.99 41.74 Favored 'General case' 0 C--O 1.256 1.446 0 CA-C-O 122.295 1.045 . . . . 22.35 108.53 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 58.7 t -119.81 129.99 74.71 Favored 'Isoleucine or valine' 0 C--O 1.26 1.656 0 CA-C-O 116.711 -1.614 . . . . 25.46 109.36 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 172.9 -173.27 45.52 Favored Glycine 0 N--CA 1.471 0.991 0 O-C-N 124.792 1.308 . . . . 29.39 112.36 -176.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -69.72 50.1 0.77 Allowed 'Trans proline' 0 C--O 1.165 -3.154 0 C-N-CA 123.355 2.704 . . . . 30.7 116.636 -175.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.3 t -78.85 144.9 65.03 Favored Pre-proline 0 C--O 1.205 -1.258 0 N-CA-C 106.766 -1.568 . . . . 28.83 106.766 174.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -68.45 -22.78 38.52 Favored 'Trans proline' 0 C--O 1.199 -1.463 0 CA-C-N 121.504 1.573 . . . . 33.76 114.34 176.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 35.9 m -143.49 149.52 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 108.585 -0.895 . . . . 31.57 108.585 -176.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -74.6 129.54 37.92 Favored 'General case' 0 C--O 1.198 -1.617 0 N-CA-C 106.479 -1.675 . . . . 21.17 106.479 175.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 9.5 mt -124.83 127.16 72.42 Favored 'Isoleucine or valine' 0 C--O 1.17 -3.12 0 O-C-N 126.111 2.132 . . . . 25.27 110.803 -175.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 35.9 mm -96.84 115.48 36.47 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.538 0 N-CA-C 105.834 -1.913 . . . . 16.59 105.834 172.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -96.7 179.88 34.53 Favored Glycine 0 C--O 1.186 -2.885 0 O-C-N 124.883 1.364 . . . . 14.44 113.435 -177.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.1 mtm105 -64.45 -26.43 68.44 Favored 'General case' 0 C--O 1.263 1.779 0 CA-C-O 117.363 -1.303 . . . . 19.03 112.82 -170.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -55.82 -34.86 65.76 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 125.966 2.041 . . . . 18.84 109.426 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 77.7 mt -100.92 -30.29 11.74 Favored 'General case' 0 C--O 1.183 -2.409 0 CA-C-O 118.595 -0.717 . . . . 20.05 110.756 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.1 mt -61.86 -36.96 82.77 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 120.268 1.394 . . . . 17.43 110.353 -179.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 41.1 p -63.31 -31.09 72.15 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 117.616 -1.183 . . . . 21.14 110.41 178.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -74.47 -29.22 61.36 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.399 0.888 . . . . 30.57 113.399 -178.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 31.0 pt -92.58 1.65 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-O 116.903 -1.523 . . . . 25.72 110.132 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.69 24.11 50.97 Favored Glycine 0 C--O 1.204 -1.736 0 CA-C-N 119.926 1.239 . . . . 23.97 112.041 174.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 11.3 t -74.88 131.58 40.84 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 118.4 1.1 . . . . 25.18 113.088 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 69.4 p -129.64 159.06 37.57 Favored 'General case' 0 C--O 1.206 -1.228 0 O-C-N 124.505 1.128 . . . . 25.56 111.261 176.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.3 mt -102.7 140.28 37.18 Favored 'General case' 0 C--O 1.192 -1.945 0 N-CA-C 105.778 -1.934 . . . . 21.65 105.778 172.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -139.63 133.52 30.78 Favored 'General case' 0 C--O 1.203 -1.391 0 C-N-CA 118.961 -1.096 . . . . 38.32 110.251 -178.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 49.1 p90 . . . . . 0 C--O 1.182 -2.481 0 O-C-N 125.019 1.449 . . . . 33.41 109.742 173.624 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' NKA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . 0.725 ' O ' ' CD2' ' A' ' 69' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo . . . . . 0 C--O 1.208 -0.981 0 CA-C-O 119.685 -0.214 . . . . 39.460000000000001 112.651 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -90.05 137.88 31.97 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 105.412 -2.07 . . . . 43.549999999999997 105.412 161.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 76.1 mt -125.34 120.22 57.45 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 108.664 -0.865 . . . . 26.699999999999999 108.664 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.5 p -86.84 171.78 10.6 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 105.575 -2.009 . . . . 27.379999999999999 105.575 177.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.6 mt -119.45 23.82 11.02 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.434 -0.791 . . . . 17.449999999999999 112.095 -165.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -68.95 -25.97 64.82 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 122.205 -0.309 . . . . 23.809999999999999 110.671 175.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -121.49 163.03 19.47 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.506 1.522 . . . . 33.630000000000003 110.71 171.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -54.33 135.39 60.95 Favored Pre-proline 0 N--CA 1.498 1.958 0 O-C-N 124.668 1.23 . . . . 46.479999999999997 108.799 173.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -81.61 73.12 5.99 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 122.238 1.959 . . . . 16.210000000000001 111.076 -179.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 24.5 mt -89.17 141.09 28.82 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 108.405 -0.961 . . . . 26.170000000000002 108.405 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.76 159.07 41.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.201 -1.037 . . . . 23.690000000000001 108.201 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 79.4 p -83.3 136.9 34.21 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 113.975 -1.466 . . . . 32.82 108.995 172.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.21 154.36 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 N-CA-C 107.112 -1.44 . . . . 19.440000000000001 107.112 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -125.53 123.53 39.33 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 105.285 -2.117 . . . . 28.550000000000001 105.285 170.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.9 tt -147.49 135.94 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 CA-C-N 114.499 -1.228 . . . . 21.199999999999999 108.396 -177.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 53.51 37.51 56.23 Favored Glycine 0 N--CA 1.478 1.473 0 CA-C-O 116.636 -2.202 . . . . 22.16 110.731 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.71 1.42 61.84 Favored Glycine 0 C--O 1.274 2.626 0 CA-C-O 117.217 -1.88 . . . . 18.34 115.385 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -110.44 148.96 30.99 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 118.004 0.902 . . . . 28.239999999999998 110.996 -173.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 24.2 mt -100.33 133.34 44.89 Favored 'General case' 0 C--O 1.247 0.928 0 O-C-N 126.093 2.121 . . . . 21.07 108.772 175.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -142.72 163.91 31.55 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-N 115.059 -0.973 . . . . 33.619999999999997 110.627 -178.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -106.07 144.88 32.15 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 108.281 -1.007 . . . . 36.509999999999998 108.281 169.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -145.05 154.41 42.49 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 124.874 1.359 . . . . 14.73 110.381 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.8 tp -91.81 127.02 37.11 Favored 'General case' 0 C--O 1.274 2.359 0 CA-C-O 116.77 -1.586 . . . . 22.559999999999999 107.594 -177.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.1 mt -74.03 109.83 7.84 Favored 'General case' 0 C--O 1.261 1.699 0 N-CA-C 107.017 -1.475 . . . . 20.440000000000001 107.017 170.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -123.28 97.81 5.58 Favored 'General case' 0 C--O 1.263 1.806 0 C-N-CA 120.345 -0.542 . . . . 18.399999999999999 110.504 -164.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.0 p -68.38 -16.65 64.0 Favored 'General case' 0 C--O 1.265 1.919 0 CA-C-O 117.35 -1.309 . . . . 13.94 110.844 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -87.87 1.88 85.43 Favored Glycine 0 N--CA 1.473 1.132 0 CA-C-N 120.968 1.713 . . . . 17.59 113.435 179.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -106.22 120.46 41.89 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.4 1.48 . . . . 15.1 107.927 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -67.72 -41.25 83.81 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 120.055 -0.658 . . . . 24.559999999999999 109.554 174.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -120.07 164.58 15.94 Favored 'General case' 0 C--O 1.258 1.544 0 O-C-N 126.093 2.121 . . . . 33.109999999999999 109.002 -170.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.1 m -94.4 126.18 39.5 Favored 'General case' 0 C--O 1.266 1.943 0 CA-C-N 114.412 -1.267 . . . . 17.260000000000002 109.307 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 10.4 t -130.07 119.89 48.06 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.13 0 N-CA-C 106.911 -1.514 . . . . 24.780000000000001 106.911 -172.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.7 mt -117.19 148.23 41.79 Favored 'General case' 0 C--O 1.259 1.578 0 CA-C-O 117.578 -1.201 . . . . 24.199999999999999 111.718 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -57.96 158.33 6.76 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 127.608 3.067 . . . . 43.109999999999999 107.893 177.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -49.5 130.78 20.65 Favored 'General case' 0 C--O 1.276 2.471 0 N-CA-C 108.099 -1.074 . . . . 42.350000000000001 108.099 -178.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 25.5 ptm -156.67 161.04 39.88 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 126.431 2.332 . . . . 33.200000000000003 106.089 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -83.84 108.79 17.08 Favored 'General case' 0 C--O 1.279 2.613 0 O-C-N 126.504 2.377 . . . . 53.759999999999998 108.886 -178.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.7 mt -120.3 142.77 34.41 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 124.386 1.054 . . . . 42.060000000000002 108.538 175.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -80.9 151.42 18.7 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.402 1.402 . . . . 43.920000000000002 109.416 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 99.97 -168.39 21.25 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 125.792 1.932 . . . . 45.909999999999997 113.793 160.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 12.0 ttm-85 -75.97 152.0 37.12 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.075 1.75 . . . . 83.209999999999994 108.408 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -149.78 170.98 17.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 117.644 -1.17 . . . . 48.659999999999997 108.63 174.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -136.94 132.15 18.2 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 125.588 1.805 . . . . 53.549999999999997 107.887 -173.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -65.43 143.84 77.59 Favored 'Trans proline' 0 C--O 1.202 -1.299 0 C-N-CA 122.322 2.015 . . . . 41.649999999999999 109.625 -178.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -150.38 147.14 27.22 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 106.789 -1.559 . . . . 52.75 106.789 -177.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' MET . . . . . 0.767 ' CE ' ' HG3' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -114.75 135.5 54.11 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 104.439 -2.43 . . . . 54.770000000000003 104.439 172.391 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 45.6 pt -130.41 147.95 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 125.07 1.482 . . . . 30.43 108.883 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -112.86 148.74 18.51 Favored Glycine 0 C--O 1.22 -0.77 0 C-N-CA 120.318 -0.944 . . . . 23.260000000000002 112.695 -174.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -144.74 -155.56 6.5 Favored Glycine 0 C--O 1.198 -2.136 0 O-C-N 125.22 1.188 . . . . 22.18 111.172 177.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . 0.312 0.1 OUTLIER -56.39 -43.4 77.38 Favored 'Isoleucine or valine' 0 C--O 1.256 1.416 0 CA-C-O 115.985 -1.96 . . . . 27.710000000000001 115.219 -173.975 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -108.16 8.98 36.14 Favored Glycine 0 C--O 1.206 -1.604 0 N-CA-C 116.637 1.415 . . . . 29.559999999999999 116.637 -171.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.61 -148.6 19.69 Favored Glycine 0 C--N 1.299 -1.482 0 C-N-CA 125.788 1.661 . . . . 29.120000000000001 111.156 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -113.08 161.91 16.54 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.858 0.863 . . . . 34.799999999999997 110.969 -166.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 17.5 pt -136.48 151.96 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 108.947 -0.76 . . . . 27.940000000000001 108.947 172.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . 0.767 ' HG3' ' CE ' ' A' ' 46' ' ' MET . 0.0 OUTLIER -89.44 126.31 35.51 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 106.128 -1.805 . . . . 47.149999999999999 106.128 172.8 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.4 m -124.67 161.23 28.46 Favored 'Isoleucine or valine' 0 C--O 1.279 2.642 0 O-C-N 126.28 2.237 . . . . 28.57 110.418 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 73.4 mtm-85 -97.86 128.02 44.19 Favored 'General case' 0 C--O 1.263 1.765 0 N-CA-C 107.989 -1.115 . . . . 37.079999999999998 107.989 167.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -92.53 119.17 31.74 Favored 'General case' 0 C--O 1.256 1.431 0 C-N-CA 124.856 1.262 . . . . 36.240000000000002 108.055 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -114.3 125.38 53.82 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.168 1.787 . . . . 33.630000000000003 109.25 173.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -102.13 156.33 17.62 Favored 'General case' 0 C--O 1.28 2.689 0 CA-C-O 117.864 -1.065 . . . . 41.25 109.062 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.7 tp60 53.68 49.91 18.28 Favored 'General case' 0 C--O 1.266 1.924 0 O-C-N 127.619 3.074 . . . . 47.850000000000001 106.926 173.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 43.7 mm -94.67 132.7 37.94 Favored 'Isoleucine or valine' 0 C--O 1.27 2.183 0 N-CA-C 108.287 -1.005 . . . . 28.859999999999999 108.287 175.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.5 tp -85.22 133.53 34.18 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 108.769 -0.826 . . . . 22.23 108.769 177.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . 0.558 HG21 HD13 ' A' ' 89' ' ' LEU . 9.6 tt -135.97 135.81 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.582 -1.266 . . . . 29.77 107.582 177.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -109.32 113.54 26.45 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 105.228 -2.138 . . . . 54.590000000000003 105.228 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 50.9 mt -109.91 108.32 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 125.608 1.818 . . . . 28.329999999999998 106.238 -168.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.6 t 46.89 41.83 11.27 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 117.271 -1.347 . . . . 39.869999999999997 108.858 -175.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.06 7.6 73.53 Favored Glycine 0 N--CA 1.481 1.648 0 CA-C-N 119.259 0.936 . . . . 44.460000000000001 112.922 169.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -112.58 130.92 55.86 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 107.363 -1.347 . . . . 31.32 107.363 177.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -89.41 138.97 30.98 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 118.844 0.747 . . . . 43.719999999999999 110.577 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -139.85 155.41 47.24 Favored 'General case' 0 C--O 1.265 1.909 0 N-CA-C 107.717 -1.216 . . . . 22.629999999999999 107.717 175.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.9 mt -130.62 130.43 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 N-CA-C 106.113 -1.81 . . . . 31.350000000000001 106.113 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -178.57 -165.63 33.46 Favored Glycine 0 CA--C 1.494 -1.229 0 CA-C-O 122.596 1.109 . . . . 20.620000000000001 114.14 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.1 m -74.52 133.78 42.28 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-N 114.754 -0.723 . . . . 26.34 110.094 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 59.3 t -123.65 129.14 74.69 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 C-N-CA 125.741 1.616 . . . . 25.719999999999999 106.812 172.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.2 mt -98.04 133.99 41.74 Favored 'General case' 0 C--O 1.256 1.446 0 CA-C-O 122.295 1.045 . . . . 22.350000000000001 108.53 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 58.7 t -119.81 129.99 74.71 Favored 'Isoleucine or valine' 0 C--O 1.26 1.656 0 CA-C-O 116.711 -1.614 . . . . 25.460000000000001 109.36 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 172.9 -173.27 45.52 Favored Glycine 0 N--CA 1.471 0.991 0 O-C-N 124.792 1.308 . . . . 29.390000000000001 112.36 -176.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -69.72 50.1 0.77 Allowed 'Trans proline' 0 C--O 1.165 -3.154 0 C-N-CA 123.355 2.704 . . . . 30.699999999999999 116.636 -175.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.3 t -78.85 144.9 65.03 Favored Pre-proline 0 C--O 1.205 -1.258 0 N-CA-C 106.766 -1.568 . . . . 28.829999999999998 106.766 174.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -68.45 -22.78 38.52 Favored 'Trans proline' 0 C--O 1.199 -1.463 0 CA-C-N 121.504 1.573 . . . . 33.759999999999998 114.34 176.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 35.9 m -143.49 149.52 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 108.585 -0.895 . . . . 31.57 108.585 -176.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -74.6 129.54 37.92 Favored 'General case' 0 C--O 1.198 -1.617 0 N-CA-C 106.479 -1.675 . . . . 21.170000000000002 106.479 175.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 9.5 mt -124.83 127.16 72.42 Favored 'Isoleucine or valine' 0 C--O 1.17 -3.12 0 O-C-N 126.111 2.132 . . . . 25.27 110.803 -175.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 35.9 mm -96.84 115.48 36.47 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.538 0 N-CA-C 105.834 -1.913 . . . . 16.59 105.834 172.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -96.7 179.88 34.53 Favored Glycine 0 C--O 1.186 -2.885 0 O-C-N 124.883 1.364 . . . . 14.44 113.435 -177.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.1 mtm105 -64.45 -26.43 68.44 Favored 'General case' 0 C--O 1.263 1.779 0 CA-C-O 117.363 -1.303 . . . . 19.030000000000001 112.82 -170.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -55.82 -34.86 65.76 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 125.966 2.041 . . . . 18.84 109.426 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . 0.558 HD13 HG21 ' A' ' 64' ' ' ILE . 77.7 mt -100.92 -30.29 11.74 Favored 'General case' 0 C--O 1.183 -2.409 0 CA-C-O 118.595 -0.717 . . . . 20.050000000000001 110.756 179.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.1 mt -61.86 -36.96 82.77 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 120.268 1.394 . . . . 17.43 110.353 -179.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 41.1 p -63.31 -31.09 72.15 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 117.616 -1.183 . . . . 21.140000000000001 110.41 178.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -74.47 -29.22 61.36 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.399 0.888 . . . . 30.57 113.399 -178.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 31.0 pt -92.58 1.65 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-O 116.903 -1.523 . . . . 25.719999999999999 110.132 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.69 24.11 50.97 Favored Glycine 0 C--O 1.204 -1.736 0 CA-C-N 119.926 1.239 . . . . 23.969999999999999 112.041 174.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 11.3 t -74.88 131.58 40.84 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 118.4 1.1 . . . . 25.18 113.088 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 69.4 p -129.64 159.06 37.57 Favored 'General case' 0 C--O 1.206 -1.228 0 O-C-N 124.505 1.128 . . . . 25.559999999999999 111.261 176.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.3 mt -102.7 140.28 37.18 Favored 'General case' 0 C--O 1.192 -1.945 0 N-CA-C 105.778 -1.934 . . . . 21.649999999999999 105.778 172.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -139.63 133.52 30.78 Favored 'General case' 0 C--O 1.203 -1.391 0 C-N-CA 118.961 -1.096 . . . . 38.32 110.251 -178.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 49.1 p90 . . . . . 0 C--O 1.182 -2.481 0 O-C-N 125.019 1.449 . . . . 33.409999999999997 109.742 173.624 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' NKA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo . . . . . 0 C--O 1.208 -0.981 0 CA-C-O 119.685 -0.214 . . . . 39.46 112.651 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -90.05 137.88 31.97 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 105.412 -2.07 . . . . 43.55 105.412 161.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 76.1 mt -125.34 120.22 57.45 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 108.664 -0.865 . . . . 26.7 108.664 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.5 p -86.84 171.78 10.6 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 105.575 -2.009 . . . . 27.38 105.575 177.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.6 mt -119.45 23.82 11.02 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 121.434 -0.791 . . . . 17.45 112.095 -165.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -68.95 -25.97 64.82 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 122.205 -0.309 . . . . 23.81 110.671 175.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -121.49 163.03 19.47 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.506 1.522 . . . . 33.63 110.71 171.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -54.33 135.39 60.95 Favored Pre-proline 0 N--CA 1.498 1.958 0 O-C-N 124.668 1.23 . . . . 46.48 108.799 173.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -81.61 73.12 5.99 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 122.238 1.959 . . . . 16.21 111.076 -179.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 24.5 mt -89.17 141.09 28.82 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 108.405 -0.961 . . . . 26.17 108.405 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.76 159.07 41.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.201 -1.037 . . . . 23.69 108.201 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 79.4 p -83.3 136.9 34.21 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 113.975 -1.466 . . . . 32.82 108.995 172.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.21 154.36 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 N-CA-C 107.112 -1.44 . . . . 19.44 107.112 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -125.53 123.53 39.33 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 105.285 -2.117 . . . . 28.55 105.285 170.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.9 tt -147.49 135.94 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 CA-C-N 114.499 -1.228 . . . . 21.2 108.396 -177.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 53.51 37.51 56.23 Favored Glycine 0 N--CA 1.478 1.473 0 CA-C-O 116.636 -2.202 . . . . 22.16 110.731 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.71 1.42 61.84 Favored Glycine 0 C--O 1.274 2.626 0 CA-C-O 117.217 -1.88 . . . . 18.34 115.385 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -110.44 148.96 30.99 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 118.004 0.902 . . . . 28.24 110.996 -173.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 24.2 mt -100.33 133.34 44.89 Favored 'General case' 0 C--O 1.247 0.928 0 O-C-N 126.093 2.121 . . . . 21.07 108.772 175.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -142.72 163.91 31.55 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-N 115.059 -0.973 . . . . 33.62 110.627 -178.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -106.07 144.88 32.15 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 108.281 -1.007 . . . . 36.51 108.281 169.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -145.05 154.41 42.49 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 124.874 1.359 . . . . 14.73 110.381 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.8 tp -91.81 127.02 37.11 Favored 'General case' 0 C--O 1.274 2.359 0 CA-C-O 116.77 -1.586 . . . . 22.56 107.594 -177.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.1 mt -74.03 109.83 7.84 Favored 'General case' 0 C--O 1.261 1.699 0 N-CA-C 107.017 -1.475 . . . . 20.44 107.017 170.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -123.28 97.81 5.58 Favored 'General case' 0 C--O 1.263 1.806 0 C-N-CA 120.345 -0.542 . . . . 18.4 110.504 -164.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.0 p -68.38 -16.65 64.0 Favored 'General case' 0 C--O 1.265 1.919 0 CA-C-O 117.35 -1.309 . . . . 13.94 110.844 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -87.87 1.88 85.43 Favored Glycine 0 N--CA 1.473 1.132 0 CA-C-N 120.968 1.713 . . . . 17.59 113.435 179.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -106.22 120.46 41.89 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.4 1.48 . . . . 15.1 107.927 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -67.72 -41.25 83.81 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 120.055 -0.658 . . . . 24.56 109.554 174.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -120.07 164.58 15.94 Favored 'General case' 0 C--O 1.258 1.544 0 O-C-N 126.093 2.121 . . . . 33.11 109.002 -170.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.1 m -94.4 126.18 39.5 Favored 'General case' 0 C--O 1.266 1.943 0 CA-C-N 114.412 -1.267 . . . . 17.26 109.307 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 10.4 t -130.07 119.89 48.06 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.13 0 N-CA-C 106.911 -1.514 . . . . 24.78 106.911 -172.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.7 mt -117.19 148.23 41.79 Favored 'General case' 0 C--O 1.259 1.578 0 CA-C-O 117.578 -1.201 . . . . 24.2 111.718 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -57.96 158.33 6.76 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 127.608 3.067 . . . . 43.11 107.893 177.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -49.5 130.78 20.65 Favored 'General case' 0 C--O 1.276 2.471 0 N-CA-C 108.099 -1.074 . . . . 42.35 108.099 -178.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 25.5 ptm -156.67 161.04 39.88 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 126.431 2.332 . . . . 33.2 106.089 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -83.84 108.79 17.08 Favored 'General case' 0 C--O 1.279 2.613 0 O-C-N 126.504 2.377 . . . . 53.76 108.886 -178.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.7 mt -120.3 142.77 34.41 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 124.386 1.054 . . . . 42.06 108.538 175.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -80.9 151.42 18.7 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.402 1.402 . . . . 43.92 109.416 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 99.97 -168.39 21.25 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 125.792 1.932 . . . . 45.91 113.793 160.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 12.0 ttm-85 -75.97 152.0 37.12 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.075 1.75 . . . . 83.21 108.408 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -149.78 170.98 17.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 117.644 -1.17 . . . . 48.66 108.63 174.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -136.94 132.15 18.2 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 125.588 1.805 . . . . 53.55 107.887 -173.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -65.43 143.84 77.59 Favored 'Trans proline' 0 C--O 1.202 -1.299 0 C-N-CA 122.322 2.015 . . . . 41.65 109.625 -178.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -150.38 147.14 27.22 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 106.789 -1.559 . . . . 52.75 106.789 -177.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' MET . . . . . 0.767 ' CE ' ' HG3' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -114.75 135.5 54.11 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 104.439 -2.43 . . . . 54.77 104.439 172.391 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 45.6 pt -130.41 147.95 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 125.07 1.482 . . . . 30.43 108.883 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -112.86 148.74 18.51 Favored Glycine 0 C--O 1.22 -0.77 0 C-N-CA 120.318 -0.944 . . . . 23.26 112.695 -174.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -144.74 -155.56 6.5 Favored Glycine 0 C--O 1.198 -2.136 0 O-C-N 125.22 1.188 . . . . 22.18 111.172 177.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . 0.312 0.1 OUTLIER -56.39 -43.4 77.38 Favored 'Isoleucine or valine' 0 C--O 1.256 1.416 0 CA-C-O 115.985 -1.96 . . . . 27.71 115.219 -173.975 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -108.16 8.98 36.14 Favored Glycine 0 C--O 1.206 -1.604 0 N-CA-C 116.637 1.415 . . . . 29.56 116.637 -171.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.61 -148.6 19.69 Favored Glycine 0 C--N 1.299 -1.482 0 C-N-CA 125.788 1.661 . . . . 29.12 111.156 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -113.08 161.91 16.54 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.858 0.863 . . . . 34.8 110.969 -166.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 17.5 pt -136.48 151.96 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 108.947 -0.76 . . . . 27.94 108.947 172.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.767 ' HG3' ' CE ' ' A' ' 46' ' ' MET . 0.0 OUTLIER -89.44 126.31 35.51 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 106.128 -1.805 . . . . 47.15 106.128 172.8 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.4 m -124.67 161.23 28.46 Favored 'Isoleucine or valine' 0 C--O 1.279 2.642 0 O-C-N 126.28 2.237 . . . . 28.57 110.418 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 73.4 mtm-85 -97.86 128.02 44.19 Favored 'General case' 0 C--O 1.263 1.765 0 N-CA-C 107.989 -1.115 . . . . 37.08 107.989 167.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -92.53 119.17 31.74 Favored 'General case' 0 C--O 1.256 1.431 0 C-N-CA 124.856 1.262 . . . . 36.24 108.055 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -114.3 125.38 53.82 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.168 1.787 . . . . 33.63 109.25 173.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -102.13 156.33 17.62 Favored 'General case' 0 C--O 1.28 2.689 0 CA-C-O 117.864 -1.065 . . . . 41.25 109.062 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.7 tp60 53.68 49.91 18.28 Favored 'General case' 0 C--O 1.266 1.924 0 O-C-N 127.619 3.074 . . . . 47.85 106.926 173.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 43.7 mm -94.67 132.7 37.94 Favored 'Isoleucine or valine' 0 C--O 1.27 2.183 0 N-CA-C 108.287 -1.005 . . . . 28.86 108.287 175.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.5 tp -85.22 133.53 34.18 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 108.769 -0.826 . . . . 22.23 108.769 177.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.558 HG21 HD13 ' A' ' 89' ' ' LEU . 9.6 tt -135.97 135.81 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.582 -1.266 . . . . 29.77 107.582 177.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -109.32 113.54 26.45 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 105.228 -2.138 . . . . 54.59 105.228 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 50.9 mt -109.91 108.32 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 125.608 1.818 . . . . 28.33 106.238 -168.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.6 t 46.89 41.83 11.27 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 117.271 -1.347 . . . . 39.87 108.858 -175.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.06 7.6 73.53 Favored Glycine 0 N--CA 1.481 1.648 0 CA-C-N 119.259 0.936 . . . . 44.46 112.922 169.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.94 ' HD2' ' O ' ' A' ' 231' ' ' HOH . 47.7 m80 -112.58 130.92 55.86 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 107.363 -1.347 . . . . 31.32 107.363 177.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -89.41 138.97 30.98 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 118.844 0.747 . . . . 43.72 110.577 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -139.85 155.41 47.24 Favored 'General case' 0 C--O 1.265 1.909 0 N-CA-C 107.717 -1.216 . . . . 22.63 107.717 175.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.9 mt -130.62 130.43 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 N-CA-C 106.113 -1.81 . . . . 31.35 106.113 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -178.57 -165.63 33.46 Favored Glycine 0 CA--C 1.494 -1.229 0 CA-C-O 122.596 1.109 . . . . 20.62 114.14 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.1 m -74.52 133.78 42.28 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-N 114.754 -0.723 . . . . 26.34 110.094 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 59.3 t -123.65 129.14 74.69 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 C-N-CA 125.741 1.616 . . . . 25.72 106.812 172.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.2 mt -98.04 133.99 41.74 Favored 'General case' 0 C--O 1.256 1.446 0 CA-C-O 122.295 1.045 . . . . 22.35 108.53 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 58.7 t -119.81 129.99 74.71 Favored 'Isoleucine or valine' 0 C--O 1.26 1.656 0 CA-C-O 116.711 -1.614 . . . . 25.46 109.36 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 172.9 -173.27 45.52 Favored Glycine 0 N--CA 1.471 0.991 0 O-C-N 124.792 1.308 . . . . 29.39 112.36 -176.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -69.72 50.1 0.77 Allowed 'Trans proline' 0 C--O 1.165 -3.154 0 C-N-CA 123.355 2.704 . . . . 30.7 116.636 -175.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.3 t -78.85 144.9 65.03 Favored Pre-proline 0 C--O 1.205 -1.258 0 N-CA-C 106.766 -1.568 . . . . 28.83 106.766 174.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -68.45 -22.78 38.52 Favored 'Trans proline' 0 C--O 1.199 -1.463 0 CA-C-N 121.504 1.573 . . . . 33.76 114.34 176.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 35.9 m -143.49 149.52 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 108.585 -0.895 . . . . 31.57 108.585 -176.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -74.6 129.54 37.92 Favored 'General case' 0 C--O 1.198 -1.617 0 N-CA-C 106.479 -1.675 . . . . 21.17 106.479 175.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 9.5 mt -124.83 127.16 72.42 Favored 'Isoleucine or valine' 0 C--O 1.17 -3.12 0 O-C-N 126.111 2.132 . . . . 25.27 110.803 -175.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 35.9 mm -96.84 115.48 36.47 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.538 0 N-CA-C 105.834 -1.913 . . . . 16.59 105.834 172.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -96.7 179.88 34.53 Favored Glycine 0 C--O 1.186 -2.885 0 O-C-N 124.883 1.364 . . . . 14.44 113.435 -177.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.1 mtm105 -64.45 -26.43 68.44 Favored 'General case' 0 C--O 1.263 1.779 0 CA-C-O 117.363 -1.303 . . . . 19.03 112.82 -170.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -55.82 -34.86 65.76 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 125.966 2.041 . . . . 18.84 109.426 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.558 HD13 HG21 ' A' ' 64' ' ' ILE . 77.7 mt -100.92 -30.29 11.74 Favored 'General case' 0 C--O 1.183 -2.409 0 CA-C-O 118.595 -0.717 . . . . 20.05 110.756 179.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.1 mt -61.86 -36.96 82.77 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 120.268 1.394 . . . . 17.43 110.353 -179.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 41.1 p -63.31 -31.09 72.15 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 117.616 -1.183 . . . . 21.14 110.41 178.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -74.47 -29.22 61.36 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.399 0.888 . . . . 30.57 113.399 -178.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 31.0 pt -92.58 1.65 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-O 116.903 -1.523 . . . . 25.72 110.132 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 83.69 24.11 50.97 Favored Glycine 0 C--O 1.204 -1.736 0 CA-C-N 119.926 1.239 . . . . 23.97 112.041 174.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 11.3 t -74.88 131.58 40.84 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 118.4 1.1 . . . . 25.18 113.088 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 69.4 p -129.64 159.06 37.57 Favored 'General case' 0 C--O 1.206 -1.228 0 O-C-N 124.505 1.128 . . . . 25.56 111.261 176.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.3 mt -102.7 140.28 37.18 Favored 'General case' 0 C--O 1.192 -1.945 0 N-CA-C 105.778 -1.934 . . . . 21.65 105.778 172.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -139.63 133.52 30.78 Favored 'General case' 0 C--O 1.203 -1.391 0 C-N-CA 118.961 -1.096 . . . . 38.32 110.251 -178.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 49.1 p90 . . . . . 0 C--O 1.182 -2.481 0 O-C-N 125.019 1.449 . . . . 33.41 109.742 173.624 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' NKA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . 0.94 ' O ' ' HD2' ' A' ' 69' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_