data_1ert_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 1ert _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 ' 1' ' ' MET . . . . . . . . . . . . . 5.5 tpp . . . . . 0 CA--C 1.552 1.021 0 N-CA-C 105.204 -2.147 . . . . 64.33 105.204 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.9 t -92.03 121.53 42.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 121.327 1.876 . . . . 31.67 112.674 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.2 mtpp -87.77 113.74 23.72 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 120.719 -1.238 . . . . 34.86 110.785 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -73.39 116.74 14.31 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 119.868 -1.77 . . . . 21.38 113.058 176.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.7 mm -94.99 120.67 44.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 O-C-N 120.061 -1.649 . . . . 12.48 110.117 -176.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -118.82 23.7 11.28 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.468 1.285 . . . . 14.95 114.468 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.8 p -168.44 162.44 12.32 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 120.562 -1.336 . . . . 13.21 109.911 169.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -62.92 -41.45 99.47 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.23 1.412 . . . . 36.67 110.636 171.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 54.9 m -59.53 -45.46 91.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.248 1.019 . . . . 19.56 111.373 172.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.03 -30.96 70.32 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 121.519 1.963 . . . . 13.13 111.21 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -66.17 -49.5 67.16 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 120.507 1.503 . . . . 16.04 112.5 177.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -59.11 -45.61 90.44 Favored 'General case' 0 CA--C 1.506 -0.741 0 C-N-CA 124.113 0.965 . . . . 32.43 111.024 176.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -61.49 -41.88 97.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 111.826 0.306 . . . . 45.03 111.826 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.45 -37.54 85.39 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.626 -0.226 . . . . 12.26 110.527 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 67.7 mt -73.58 -27.56 61.37 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 119.137 -2.227 . . . . 16.85 109.565 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.86 -50.93 29.91 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.765 -0.584 . . . . 32.4 110.795 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.81 -13.16 61.9 Favored 'General case' 0 C--N 1.343 0.29 0 O-C-N 118.84 -2.413 . . . . 20.14 115.152 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.72 -22.06 64.35 Favored 'General case' 0 CA--C 1.512 -0.515 0 O-C-N 120.034 -1.666 . . . . 17.71 110.174 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.48 -115.44 7.37 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 123.133 1.407 . . . . 20.78 111.735 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -92.59 -8.83 43.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.015 1.326 . . . . 34.82 109.988 -177.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -82.1 152.95 26.32 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 122.228 2.286 . . . . 27.4 113.629 -170.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -67.07 139.49 57.58 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 107.11 -1.441 . . . . 13.62 107.11 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -118.45 127.03 75.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 105.596 -2.001 . . . . 8.71 105.596 174.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.6 t -109.57 122.6 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 104.963 -2.236 . . . . 10.28 104.963 177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.0 t -111.98 126.84 69.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 O-C-N 119.621 -1.924 . . . . 9.14 106.843 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -99.25 113.86 26.36 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 107.074 -1.454 . . . . 16.59 107.074 172.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -90.41 115.41 27.56 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 117.495 -1.241 . . . . 10.7 107.992 173.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.1 p -132.96 173.85 10.97 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 121.064 1.756 . . . . 20.83 111.452 -175.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -139.94 142.38 36.4 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 103.265 -2.865 . . . . 17.82 103.265 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 29.6 p -66.15 -30.16 70.59 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 122.292 1.044 . . . . 30.11 113.598 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 63.3 p-90 -78.62 -14.03 59.52 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 116.208 1.929 . . . . 26.33 116.208 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.1 t -91.91 117.29 29.66 Favored 'General case' 0 N--CA 1.424 -1.765 0 O-C-N 121.337 -0.852 . . . . 21.52 109.325 -170.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.32 -55.97 25.73 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.565 -1.13 . . . . 18.01 115.9 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -46.76 -32.67 12.54 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 124.617 3.545 . . . . 21.18 116.132 170.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.3 m -65.33 -40.52 93.78 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 120.002 1.273 . . . . 15.26 111.211 176.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -71.38 -37.38 71.6 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.697 0.76 . . . . 34.46 110.617 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 3.8 tpp -59.98 -45.11 93.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.295 1.438 . . . . 44.55 111.767 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 6.9 tt -89.71 -5.91 10.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 N-CA-C 115.412 1.634 . . . . 17.29 115.412 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -59.37 -47.22 98.5 Favored Pre-proline 0 CA--C 1.549 0.919 0 O-C-N 117.569 -3.207 . . . . 45.49 116.465 -178.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -57.24 -45.03 37.94 Favored 'Trans proline' 0 CA--C 1.514 -0.5 0 C-N-CA 124.03 3.153 . . . . 18.09 112.174 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -64.57 -39.07 93.08 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 121.212 1.824 . . . . 15.4 108.398 -179.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -63.45 -40.78 98.04 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 121.199 1.818 . . . . 10.2 109.316 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -72.68 -32.59 65.92 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-O 115.813 -2.041 . . . . 20.47 106.886 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 11.0 p -64.61 -35.16 80.1 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 125.091 3.587 . . . . 15.05 111.514 175.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.17 -34.74 79.11 Favored 'General case' 0 CA--C 1.5 -0.976 0 CA-C-N 119.486 1.039 . . . . 16.47 109.104 -178.504 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.7 p -67.48 -27.35 66.94 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.421 1.637 . . . . 15.24 115.421 177.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -83.78 -29.1 27.68 Favored 'General case' 0 C--O 1.213 -0.831 0 O-C-N 121.182 -0.949 . . . . 34.41 111.326 174.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -75.14 -42.72 55.57 Favored 'General case' 0 N--CA 1.437 -1.093 0 O-C-N 120.417 -1.427 . . . . 14.86 112.734 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -107.42 94.28 5.0 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 124.361 2.029 . . . . 19.37 108.975 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.9 p -79.35 -12.11 59.92 Favored 'General case' 0 C--O 1.215 -0.755 0 O-C-N 119.728 -1.858 . . . . 32.13 112.618 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.34 14.84 19.15 Favored 'General case' 0 CA--C 1.555 1.153 0 O-C-N 120.254 -1.528 . . . . 29.49 112.867 179.923 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.7 t -133.51 143.23 39.51 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 N-CA-C 103.248 -2.871 . . . . 15.08 103.248 -176.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 47.9 mm -100.73 135.95 34.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 104.938 -2.245 . . . . 21.17 104.938 -178.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -120.57 120.03 34.62 Favored 'General case' 0 C--N 1.312 -1.039 0 C-N-CA 124.64 1.176 . . . . 11.33 108.546 -177.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 mp -115.53 143.81 44.78 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 126.714 2.005 . . . . 15.13 109.302 -176.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -122.12 131.79 54.15 Favored 'General case' 0 C--N 1.347 0.469 0 O-C-N 124.63 1.206 . . . . 32.02 109.072 170.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 69.5 t -125.24 115.83 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 103.857 -2.646 . . . . 11.16 103.857 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -83.3 121.39 27.06 Favored 'General case' 0 C--O 1.25 1.108 0 N-CA-C 104.43 -2.433 . . . . 27.55 104.43 175.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.7 m -65.59 -21.54 29.32 Favored 'Isoleucine or valine' 0 C--N 1.346 0.446 0 CA-C-N 119.236 0.925 . . . . 15.88 113.406 -174.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -73.81 -40.87 63.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 117.705 -1.14 . . . . 33.35 109.969 175.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -75.98 -38.16 57.74 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 123.656 2.934 . . . . 22.27 113.737 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 94.5 m -111.9 62.35 0.62 Allowed 'General case' 0 N--CA 1.429 -1.525 0 O-C-N 121.307 -0.871 . . . . 20.23 112.202 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -55.51 -38.38 69.12 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.312 0.856 . . . . 26.0 113.312 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 p-10 -64.49 -38.86 92.47 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 117.018 -1.467 . . . . 28.57 113.04 176.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.5 t -70.05 -42.88 79.48 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 CA-C-N 120.894 1.679 . . . . 14.61 107.369 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -55.61 -51.84 65.81 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 117.758 -1.115 . . . . 14.12 112.278 175.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.3 m -61.4 -47.19 86.93 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-N 121.414 1.915 . . . . 24.04 111.6 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -67.91 -30.67 70.06 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 113.522 0.934 . . . . 41.07 113.522 -177.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 92.1 m -84.79 4.87 30.95 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.25 1.204 . . . . 14.13 114.25 174.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 52.62 45.03 29.42 Favored 'General case' 0 C--N 1.345 0.41 0 C-N-CA 125.802 1.641 . . . . 32.26 114.193 177.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 53.8 t -77.79 137.43 22.24 Favored 'Isoleucine or valine' 0 C--O 1.243 0.721 0 N-CA-C 105.149 -2.167 . . . . 12.1 105.149 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.58 -18.96 1.89 Allowed 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 115.351 1.611 . . . . 37.91 115.351 178.039 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 89.3 m -124.38 159.15 31.02 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 120.706 1.594 . . . . 21.44 107.272 179.461 -68.129 0.0 0.0 0.0 0.0 0.0 0.0 -68.129 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . 0.272 16.8 mmt -126.33 137.14 29.67 Favored Pre-proline 0 C--O 1.239 0.548 0 N-CA-C 104.907 -2.257 . . . . 34.34 104.907 -178.925 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -73.69 151.95 97.65 Favored 'Cis proline' 0 C--O 1.245 0.866 0 CA-C-N 120.703 1.287 . . . . 11.27 110.026 -16.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 m -118.47 138.69 52.32 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 104.449 -2.426 . . . . 10.6 104.449 169.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -113.63 124.03 51.34 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 105.096 -2.187 . . . . 11.51 105.096 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -113.2 144.79 42.09 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.436 -1.69 . . . . 11.09 106.436 174.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -118.12 132.53 56.34 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.521 -1.288 . . . . 13.68 107.521 -174.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -131.03 146.44 52.38 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 120.432 -1.418 . . . . 13.8 108.51 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.7 tttp -141.26 125.19 17.11 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 102.944 -2.984 . . . . 38.35 102.944 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 97.6 mttt 50.97 47.96 23.91 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 124.18 1.943 . . . . 48.31 112.553 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.43 -4.62 18.99 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-O 117.084 -1.953 . . . . 23.48 115.311 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -101.16 137.92 38.89 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 120.718 2.259 . . . . 50.95 109.709 -178.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -76.13 119.88 20.66 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 121.11 1.777 . . . . 27.82 107.981 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.7 m -113.31 1.6 8.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 O-C-N 121.13 -0.981 . . . . 14.99 113.255 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -172.84 161.23 32.46 Favored Glycine 0 N--CA 1.476 1.334 0 CA-C-N 120.655 1.57 . . . . 13.02 110.118 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -170.59 137.28 1.34 Allowed 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 107.341 -1.355 . . . . 23.57 107.341 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -152.46 165.28 35.56 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 125.532 1.77 . . . . 11.78 108.073 165.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 28.9 m -117.71 158.04 25.41 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 119.9 1.227 . . . . 11.32 109.483 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 108.11 147.82 13.3 Favored Glycine 0 C--O 1.238 0.398 0 CA-C-O 123.383 1.546 . . . . 12.64 113.235 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.88 68.61 10.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.116 -1.042 . . . . 19.6 110.369 -179.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -108.43 108.28 19.17 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.032 -1.668 . . . . 15.47 107.051 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -62.66 -42.66 99.73 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 123.923 1.821 . . . . 19.6 115.67 -177.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -69.37 -46.14 67.67 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 114.027 -1.442 . . . . 47.61 108.843 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -70.66 -31.11 67.91 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-O 116.729 -1.605 . . . . 24.41 109.713 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -56.86 16.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 122.862 2.574 . . . . 14.96 110.452 176.53 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.63 -40.16 96.13 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 114.912 -1.04 . . . . 17.86 111.51 -179.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.82 -36.19 83.54 Favored 'General case' 0 C--O 1.251 1.154 0 N-CA-C 114.065 1.135 . . . . 13.65 114.065 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 59.0 m -72.03 -39.2 69.32 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 108.861 -0.792 . . . . 11.48 108.861 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 46.9 mt -60.39 -47.33 92.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 106.417 -1.697 . . . . 13.57 106.417 177.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -67.81 -19.52 65.09 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 118.682 -2.511 . . . . 23.1 114.744 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -80.3 -35.75 35.34 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 117.1 -3.5 . . . . 16.75 110.213 175.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -96.23 -16.72 21.26 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 116.725 2.12 . . . . 18.7 116.725 -171.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 C--N 1.313 -1.006 0 N-CA-C 113.438 0.903 . . . . 22.32 113.438 -176.057 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 0 . 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 orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 tpp . . . . . 0 CA--C 1.552 1.021 0 N-CA-C 105.204 -2.147 . . . . 64.33 105.204 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.9 t -92.03 121.53 42.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 121.327 1.876 . . . . 31.67 112.674 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.2 mtpp -87.77 113.74 23.72 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 120.719 -1.238 . . . . 34.86 110.785 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -73.39 116.74 14.31 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 119.868 -1.77 . . . . 21.38 113.058 176.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.7 mm -94.99 120.67 44.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 O-C-N 120.061 -1.649 . . . . 12.48 110.117 -176.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -118.82 23.7 11.28 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.468 1.285 . . . . 14.95 114.468 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.8 p -168.44 162.44 12.32 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 120.562 -1.336 . . . . 13.21 109.911 169.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 61.3 tttm -62.92 -41.45 99.47 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.23 1.412 . . . . 36.67 110.636 171.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 54.9 m -59.53 -45.46 91.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.248 1.019 . . . . 19.56 111.373 172.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.03 -30.96 70.32 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 121.519 1.963 . . . . 13.13 111.21 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -66.17 -49.5 67.16 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 120.507 1.503 . . . . 16.04 112.5 177.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 31.5 mt-30 -59.11 -45.61 90.44 Favored 'General case' 0 CA--C 1.506 -0.741 0 C-N-CA 124.113 0.965 . . . . 32.43 111.024 176.838 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -61.49 -41.88 97.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 111.826 0.306 . . . . 45.03 111.826 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.45 -37.54 85.39 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.626 -0.226 . . . . 12.26 110.527 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 67.7 mt -73.58 -27.56 61.37 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 119.137 -2.227 . . . . 16.85 109.565 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.86 -50.93 29.91 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.765 -0.584 . . . . 32.4 110.795 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.81 -13.16 61.9 Favored 'General case' 0 C--N 1.343 0.29 0 O-C-N 118.84 -2.413 . . . . 20.14 115.152 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.72 -22.06 64.35 Favored 'General case' 0 CA--C 1.512 -0.515 0 O-C-N 120.034 -1.666 . . . . 17.71 110.174 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.48 -115.44 7.37 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 123.133 1.407 . . . . 20.78 111.735 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -92.59 -8.83 43.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.015 1.326 . . . . 34.82 109.988 -177.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -82.1 152.95 26.32 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 122.228 2.286 . . . . 27.4 113.629 -170.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -67.07 139.49 57.58 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 107.11 -1.441 . . . . 13.62 107.11 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -118.45 127.03 75.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 105.596 -2.001 . . . . 8.71 105.596 174.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.6 t -109.57 122.6 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 104.963 -2.236 . . . . 10.28 104.963 177.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.0 t -111.98 126.84 69.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 O-C-N 119.621 -1.924 . . . . 9.14 106.843 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -99.25 113.86 26.36 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 107.074 -1.454 . . . . 16.59 107.074 172.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -90.41 115.41 27.56 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 117.495 -1.241 . . . . 10.7 107.992 173.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.1 p -132.96 173.85 10.97 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 121.064 1.756 . . . . 20.83 111.452 -175.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -139.94 142.38 36.4 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 103.265 -2.865 . . . . 17.82 103.265 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 29.6 p -66.15 -30.16 70.59 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 122.292 1.044 . . . . 30.11 113.598 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 63.3 p-90 -78.62 -14.03 59.52 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 116.208 1.929 . . . . 26.33 116.208 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' CYS . . . . . 0.452 ' SG ' ' HB2' ' A' ' 74' ' ' MET . 20.1 t -91.91 117.29 29.66 Favored 'General case' 0 N--CA 1.424 -1.765 0 O-C-N 121.337 -0.852 . . . . 21.52 109.325 -170.274 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.32 -55.97 25.73 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.565 -1.13 . . . . 18.01 115.9 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -46.76 -32.67 12.54 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 124.617 3.545 . . . . 21.18 116.132 170.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' CYS . . . . . 0.403 ' SG ' ' HB3' ' A' ' 74' ' ' MET . 96.3 m -65.33 -40.52 93.78 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 120.002 1.273 . . . . 15.26 111.211 176.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -71.38 -37.38 71.6 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.697 0.76 . . . . 34.46 110.617 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 3.8 tpp -59.98 -45.11 93.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.295 1.438 . . . . 44.55 111.767 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 6.9 tt -89.71 -5.91 10.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 N-CA-C 115.412 1.634 . . . . 17.29 115.412 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -59.37 -47.22 98.5 Favored Pre-proline 0 CA--C 1.549 0.919 0 O-C-N 117.569 -3.207 . . . . 45.49 116.465 -178.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -57.24 -45.03 37.94 Favored 'Trans proline' 0 CA--C 1.514 -0.5 0 C-N-CA 124.03 3.153 . . . . 18.09 112.174 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -64.57 -39.07 93.08 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 121.212 1.824 . . . . 15.4 108.398 -179.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -63.45 -40.78 98.04 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 121.199 1.818 . . . . 10.2 109.316 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -72.68 -32.59 65.92 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-O 115.813 -2.041 . . . . 21.52 106.886 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 11.0 p -64.61 -35.16 80.1 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 125.091 3.587 . . . . 15.05 111.514 175.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.17 -34.74 79.11 Favored 'General case' 0 CA--C 1.5 -0.976 0 CA-C-N 119.486 1.039 . . . . 16.47 109.104 -178.504 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' SER . . . . . 0.407 ' HA ' ' CE1' ' A' ' 54' ' ' PHE . 59.7 p -67.48 -27.35 66.94 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.421 1.637 . . . . 15.24 115.421 177.284 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -83.78 -29.1 27.68 Favored 'General case' 0 C--O 1.213 -0.831 0 O-C-N 121.182 -0.949 . . . . 34.41 111.326 174.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -75.14 -42.72 55.57 Favored 'General case' 0 N--CA 1.437 -1.093 0 O-C-N 120.417 -1.427 . . . . 14.86 112.734 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -107.42 94.28 5.0 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 124.361 2.029 . . . . 19.37 108.975 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.9 p -79.35 -12.11 59.92 Favored 'General case' 0 C--O 1.215 -0.755 0 O-C-N 119.728 -1.858 . . . . 32.13 112.618 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -94.34 14.84 19.15 Favored 'General case' 0 CA--C 1.555 1.153 0 O-C-N 120.254 -1.528 . . . . 29.49 112.867 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.7 t -133.51 143.23 39.51 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 N-CA-C 103.248 -2.871 . . . . 15.08 103.248 -176.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 47.9 mm -100.73 135.95 34.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 104.938 -2.245 . . . . 21.17 104.938 -178.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PHE . . . . . 0.407 ' CE1' ' HA ' ' A' ' 46' ' ' SER . 81.5 m-85 -120.57 120.03 34.62 Favored 'General case' 0 C--N 1.312 -1.039 0 C-N-CA 124.64 1.176 . . . . 11.33 108.546 -177.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 mp -115.53 143.81 44.78 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 126.714 2.005 . . . . 15.13 109.302 -176.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -122.12 131.79 54.15 Favored 'General case' 0 C--N 1.347 0.469 0 O-C-N 124.63 1.206 . . . . 32.02 109.072 170.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 69.5 t -125.24 115.83 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 103.857 -2.646 . . . . 11.16 103.857 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -83.3 121.39 27.06 Favored 'General case' 0 C--O 1.25 1.108 0 N-CA-C 104.43 -2.433 . . . . 27.55 104.43 175.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.7 m -65.59 -21.54 29.32 Favored 'Isoleucine or valine' 0 C--N 1.346 0.446 0 CA-C-N 119.236 0.925 . . . . 15.88 113.406 -174.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -73.81 -40.87 63.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 117.705 -1.14 . . . . 33.35 109.969 175.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -75.98 -38.16 57.74 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 123.656 2.934 . . . . 22.27 113.737 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 94.5 m -111.9 62.35 0.62 Allowed 'General case' 0 N--CA 1.429 -1.525 0 O-C-N 121.307 -0.871 . . . . 20.23 112.202 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -55.51 -38.38 69.12 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.312 0.856 . . . . 26.0 113.312 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 p-10 -64.49 -38.86 92.47 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 117.018 -1.467 . . . . 28.57 113.04 176.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.5 t -70.05 -42.88 79.48 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 CA-C-N 120.894 1.679 . . . . 14.61 107.369 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -55.61 -51.84 65.81 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 117.758 -1.115 . . . . 14.12 112.278 175.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.3 m -61.4 -47.19 86.93 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-N 121.414 1.915 . . . . 24.04 111.6 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -67.91 -30.67 70.06 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 113.522 0.934 . . . . 41.07 113.522 -177.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 92.1 m -84.79 4.87 30.95 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.25 1.204 . . . . 14.13 114.25 174.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 52.62 45.03 29.42 Favored 'General case' 0 C--N 1.345 0.41 0 C-N-CA 125.802 1.641 . . . . 32.26 114.193 177.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 53.8 t -77.79 137.43 22.24 Favored 'Isoleucine or valine' 0 C--O 1.243 0.721 0 N-CA-C 105.149 -2.167 . . . . 12.1 105.149 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.58 -18.96 1.89 Allowed 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 115.351 1.611 . . . . 37.91 115.351 178.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 89.3 m -124.38 159.15 31.02 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 120.706 1.594 . . . . 21.44 107.272 179.461 -68.129 0.0 0.0 0.0 0.0 0.0 0.0 -68.129 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' MET . . . . . 0.452 ' HB2' ' SG ' ' A' ' 32' ' ' CYS 0.272 16.8 mmt -126.33 137.14 29.67 Favored Pre-proline 0 C--O 1.239 0.548 0 N-CA-C 104.907 -2.257 . . . . 34.34 104.907 -178.925 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -73.69 151.95 97.65 Favored 'Cis proline' 0 C--O 1.245 0.866 0 CA-C-N 120.703 1.287 . . . . 11.27 110.026 -16.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 m -118.47 138.69 52.32 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 104.449 -2.426 . . . . 10.6 104.449 169.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -113.63 124.03 51.34 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 105.096 -2.187 . . . . 11.51 105.096 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -113.2 144.79 42.09 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.436 -1.69 . . . . 11.09 106.436 174.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -118.12 132.53 56.34 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.521 -1.288 . . . . 13.68 107.521 -174.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -131.03 146.44 52.38 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 120.432 -1.418 . . . . 13.8 108.51 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.7 tttp -141.26 125.19 17.11 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 102.944 -2.984 . . . . 38.35 102.944 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 97.6 mttt 50.97 47.96 23.91 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 124.18 1.943 . . . . 48.31 112.553 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.43 -4.62 18.99 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-O 117.084 -1.953 . . . . 23.48 115.311 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -101.16 137.92 38.89 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 120.718 2.259 . . . . 50.95 109.709 -178.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -76.13 119.88 20.66 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 121.11 1.777 . . . . 27.82 107.981 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.7 m -113.31 1.6 8.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 O-C-N 121.13 -0.981 . . . . 14.99 113.255 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -172.84 161.23 32.46 Favored Glycine 0 N--CA 1.476 1.334 0 CA-C-N 120.655 1.57 . . . . 13.02 110.118 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -170.59 137.28 1.34 Allowed 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 107.341 -1.355 . . . . 23.57 107.341 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -152.46 165.28 35.56 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 125.532 1.77 . . . . 11.78 108.073 165.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 28.9 m -117.71 158.04 25.41 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 119.9 1.227 . . . . 13.98 109.483 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 108.11 147.82 13.3 Favored Glycine 0 C--O 1.238 0.398 0 CA-C-O 123.383 1.546 . . . . 12.64 113.235 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.88 68.61 10.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.116 -1.042 . . . . 19.6 110.369 -179.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -108.43 108.28 19.17 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.032 -1.668 . . . . 15.47 107.051 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -62.66 -42.66 99.73 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 123.923 1.821 . . . . 19.6 115.67 -177.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -69.37 -46.14 67.67 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 114.027 -1.442 . . . . 47.61 108.843 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -70.66 -31.11 67.91 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-O 116.729 -1.605 . . . . 24.41 109.713 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -56.86 16.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 122.862 2.574 . . . . 14.96 110.452 176.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.63 -40.16 96.13 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 114.912 -1.04 . . . . 17.86 111.51 -179.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.82 -36.19 83.54 Favored 'General case' 0 C--O 1.251 1.154 0 N-CA-C 114.065 1.135 . . . . 13.65 114.065 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 59.0 m -72.03 -39.2 69.32 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 108.861 -0.792 . . . . 11.48 108.861 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 46.9 mt -60.39 -47.33 92.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 106.417 -1.697 . . . . 13.57 106.417 177.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -67.81 -19.52 65.09 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 118.682 -2.511 . . . . 23.1 114.744 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -80.3 -35.75 35.34 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 117.1 -3.5 . . . . 16.75 110.213 175.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -96.23 -16.72 21.26 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 116.725 2.12 . . . . 18.7 116.725 -171.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 C--N 1.313 -1.006 0 N-CA-C 113.438 0.903 . . . . 22.32 113.438 -176.057 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 tpp . . . . . 0 CA--C 1.552 1.021 0 N-CA-C 105.204 -2.147 . . . . 64.33 105.204 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.9 t -92.03 121.53 42.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 121.327 1.876 . . . . 31.67 112.674 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.2 mtpp -87.77 113.74 23.72 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 120.719 -1.238 . . . . 34.86 110.785 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -73.39 116.74 14.31 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 119.868 -1.77 . . . . 21.38 113.058 176.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.7 mm -94.99 120.67 44.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 O-C-N 120.061 -1.649 . . . . 12.48 110.117 -176.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -118.82 23.7 11.28 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.468 1.285 . . . . 14.95 114.468 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.8 p -168.44 162.44 12.32 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 120.562 -1.336 . . . . 13.21 109.911 169.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 61.3 tttm -62.92 -41.45 99.47 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.23 1.412 . . . . 36.67 110.636 171.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 54.9 m -59.53 -45.46 91.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.248 1.019 . . . . 19.56 111.373 172.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.03 -30.96 70.32 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 121.519 1.963 . . . . 13.13 111.21 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -66.17 -49.5 67.16 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 120.507 1.503 . . . . 16.04 112.5 177.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 31.5 mt-30 -59.11 -45.61 90.44 Favored 'General case' 0 CA--C 1.506 -0.741 0 C-N-CA 124.113 0.965 . . . . 32.43 111.024 176.838 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -61.49 -41.88 97.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 111.826 0.306 . . . . 45.03 111.826 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.45 -37.54 85.39 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.626 -0.226 . . . . 12.26 110.527 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 67.7 mt -73.58 -27.56 61.37 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 119.137 -2.227 . . . . 16.85 109.565 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.86 -50.93 29.91 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.765 -0.584 . . . . 32.4 110.795 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.81 -13.16 61.9 Favored 'General case' 0 C--N 1.343 0.29 0 O-C-N 118.84 -2.413 . . . . 20.14 115.152 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.72 -22.06 64.35 Favored 'General case' 0 CA--C 1.512 -0.515 0 O-C-N 120.034 -1.666 . . . . 17.71 110.174 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.48 -115.44 7.37 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 123.133 1.407 . . . . 20.78 111.735 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -92.59 -8.83 43.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.015 1.326 . . . . 34.82 109.988 -177.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -82.1 152.95 26.32 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 122.228 2.286 . . . . 27.4 113.629 -170.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -67.07 139.49 57.58 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 107.11 -1.441 . . . . 13.62 107.11 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -118.45 127.03 75.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 105.596 -2.001 . . . . 8.71 105.596 174.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.6 t -109.57 122.6 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 104.963 -2.236 . . . . 10.28 104.963 177.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.0 t -111.98 126.84 69.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 O-C-N 119.621 -1.924 . . . . 9.14 106.843 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -99.25 113.86 26.36 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 107.074 -1.454 . . . . 16.59 107.074 172.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -90.41 115.41 27.56 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 117.495 -1.241 . . . . 10.7 107.992 173.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.1 p -132.96 173.85 10.97 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 121.064 1.756 . . . . 20.83 111.452 -175.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -139.94 142.38 36.4 Favored 'General case' 0 C--O 1.247 0.948 0 N-CA-C 103.265 -2.865 . . . . 17.82 103.265 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 29.6 p -66.15 -30.16 70.59 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 122.292 1.044 . . . . 30.11 113.598 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 63.3 p-90 -78.62 -14.03 59.52 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 116.208 1.929 . . . . 26.33 116.208 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.452 ' SG ' ' HB2' ' A' ' 74' ' ' MET . 20.1 t -91.91 117.29 29.66 Favored 'General case' 0 N--CA 1.424 -1.765 0 O-C-N 121.337 -0.852 . . . . 21.52 109.325 -170.274 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.32 -55.97 25.73 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.565 -1.13 . . . . 18.01 115.9 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -46.76 -32.67 12.54 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 124.617 3.545 . . . . 21.18 116.132 170.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.403 ' SG ' ' HB3' ' A' ' 74' ' ' MET . 96.3 m -65.33 -40.52 93.78 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 120.002 1.273 . . . . 15.26 111.211 176.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -71.38 -37.38 71.6 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.697 0.76 . . . . 34.46 110.617 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 3.8 tpp -59.98 -45.11 93.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.295 1.438 . . . . 44.55 111.767 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 6.9 tt -89.71 -5.91 10.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 N-CA-C 115.412 1.634 . . . . 17.29 115.412 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -59.37 -47.22 98.5 Favored Pre-proline 0 CA--C 1.549 0.919 0 O-C-N 117.569 -3.207 . . . . 45.49 116.465 -178.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -57.24 -45.03 37.94 Favored 'Trans proline' 0 CA--C 1.514 -0.5 0 C-N-CA 124.03 3.153 . . . . 18.09 112.174 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -64.57 -39.07 93.08 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 121.212 1.824 . . . . 15.4 108.398 -179.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -63.45 -40.78 98.04 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 121.199 1.818 . . . . 10.2 109.316 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -72.68 -32.59 65.92 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-O 115.813 -2.041 . . . . 21.52 106.886 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 11.0 p -64.61 -35.16 80.1 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 125.091 3.587 . . . . 15.05 111.514 175.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.17 -34.74 79.11 Favored 'General case' 0 CA--C 1.5 -0.976 0 CA-C-N 119.486 1.039 . . . . 16.47 109.104 -178.504 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' SER . . . . . 0.407 ' HA ' ' CE1' ' A' ' 54' ' ' PHE . 59.7 p -67.48 -27.35 66.94 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.421 1.637 . . . . 15.24 115.421 177.284 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -83.78 -29.1 27.68 Favored 'General case' 0 C--O 1.213 -0.831 0 O-C-N 121.182 -0.949 . . . . 34.41 111.326 174.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -75.14 -42.72 55.57 Favored 'General case' 0 N--CA 1.437 -1.093 0 O-C-N 120.417 -1.427 . . . . 14.86 112.734 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -107.42 94.28 5.0 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 124.361 2.029 . . . . 19.37 108.975 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.9 p -79.35 -12.11 59.92 Favored 'General case' 0 C--O 1.215 -0.755 0 O-C-N 119.728 -1.858 . . . . 32.13 112.618 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.567 HD22 ' H ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -94.34 14.84 19.15 Favored 'General case' 0 CA--C 1.555 1.153 0 O-C-N 120.254 -1.528 . . . . 29.49 112.867 179.923 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.7 t -133.51 143.23 39.51 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 N-CA-C 103.248 -2.871 . . . . 15.08 103.248 -176.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 47.9 mm -100.73 135.95 34.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 104.938 -2.245 . . . . 21.17 104.938 -178.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.407 ' CE1' ' HA ' ' A' ' 46' ' ' SER . 81.5 m-85 -120.57 120.03 34.62 Favored 'General case' 0 C--N 1.312 -1.039 0 C-N-CA 124.64 1.176 . . . . 11.33 108.546 -177.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 mp -115.53 143.81 44.78 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 126.714 2.005 . . . . 15.13 109.302 -176.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -122.12 131.79 54.15 Favored 'General case' 0 C--N 1.347 0.469 0 O-C-N 124.63 1.206 . . . . 32.02 109.072 170.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 69.5 t -125.24 115.83 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 103.857 -2.646 . . . . 11.16 103.857 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -83.3 121.39 27.06 Favored 'General case' 0 C--O 1.25 1.108 0 N-CA-C 104.43 -2.433 . . . . 27.55 104.43 175.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.7 m -65.59 -21.54 29.32 Favored 'Isoleucine or valine' 0 C--N 1.346 0.446 0 CA-C-N 119.236 0.925 . . . . 15.88 113.406 -174.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -73.81 -40.87 63.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 117.705 -1.14 . . . . 33.35 109.969 175.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -75.98 -38.16 57.74 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 123.656 2.934 . . . . 22.27 113.737 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 94.5 m -111.9 62.35 0.62 Allowed 'General case' 0 N--CA 1.429 -1.525 0 O-C-N 121.307 -0.871 . . . . 20.23 112.202 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -55.51 -38.38 69.12 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.312 0.856 . . . . 26.0 113.312 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 p-10 -64.49 -38.86 92.47 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 117.018 -1.467 . . . . 28.57 113.04 176.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.5 t -70.05 -42.88 79.48 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 CA-C-N 120.894 1.679 . . . . 14.61 107.369 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -55.61 -51.84 65.81 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 117.758 -1.115 . . . . 14.12 112.278 175.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.3 m -61.4 -47.19 86.93 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-N 121.414 1.915 . . . . 24.04 111.6 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -67.91 -30.67 70.06 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 113.522 0.934 . . . . 41.07 113.522 -177.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 92.1 m -84.79 4.87 30.95 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.25 1.204 . . . . 14.13 114.25 174.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 52.62 45.03 29.42 Favored 'General case' 0 C--N 1.345 0.41 0 C-N-CA 125.802 1.641 . . . . 32.26 114.193 177.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 53.8 t -77.79 137.43 22.24 Favored 'Isoleucine or valine' 0 C--O 1.243 0.721 0 N-CA-C 105.149 -2.167 . . . . 12.1 105.149 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.58 -18.96 1.89 Allowed 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 115.351 1.611 . . . . 37.91 115.351 178.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 89.3 m -124.38 159.15 31.02 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 120.706 1.594 . . . . 21.44 107.272 179.461 -68.129 0.0 0.0 0.0 0.0 0.0 0.0 -68.129 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' MET . . . . . 0.452 ' HB2' ' SG ' ' A' ' 32' ' ' CYS 0.272 16.8 mmt -126.33 137.14 29.67 Favored Pre-proline 0 C--O 1.239 0.548 0 N-CA-C 104.907 -2.257 . . . . 34.34 104.907 -178.925 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -73.69 151.95 97.65 Favored 'Cis proline' 0 C--O 1.245 0.866 0 CA-C-N 120.703 1.287 . . . . 11.27 110.026 -16.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 m -118.47 138.69 52.32 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 104.449 -2.426 . . . . 10.6 104.449 169.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -113.63 124.03 51.34 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 105.096 -2.187 . . . . 11.51 105.096 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -113.2 144.79 42.09 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.436 -1.69 . . . . 11.09 106.436 174.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -118.12 132.53 56.34 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.521 -1.288 . . . . 13.68 107.521 -174.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -131.03 146.44 52.38 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 120.432 -1.418 . . . . 13.8 108.51 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.7 tttp -141.26 125.19 17.11 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 102.944 -2.984 . . . . 38.35 102.944 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 97.6 mttt 50.97 47.96 23.91 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 124.18 1.943 . . . . 48.31 112.553 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.43 -4.62 18.99 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-O 117.084 -1.953 . . . . 23.48 115.311 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -101.16 137.92 38.89 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 120.718 2.259 . . . . 50.95 109.709 -178.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 32.4 ttpt -76.13 119.88 20.66 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 121.11 1.777 . . . . 27.82 107.981 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.7 m -113.31 1.6 8.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 O-C-N 121.13 -0.981 . . . . 14.99 113.255 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -172.84 161.23 32.46 Favored Glycine 0 N--CA 1.476 1.334 0 CA-C-N 120.655 1.57 . . . . 13.02 110.118 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -170.59 137.28 1.34 Allowed 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 107.341 -1.355 . . . . 23.57 107.341 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -152.46 165.28 35.56 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 125.532 1.77 . . . . 11.78 108.073 165.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 28.9 m -117.71 158.04 25.41 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 119.9 1.227 . . . . 13.98 109.483 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 108.11 147.82 13.3 Favored Glycine 0 C--O 1.238 0.398 0 CA-C-O 123.383 1.546 . . . . 12.64 113.235 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.88 68.61 10.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.116 -1.042 . . . . 19.6 110.369 -179.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -108.43 108.28 19.17 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.032 -1.668 . . . . 15.47 107.051 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -62.66 -42.66 99.73 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 123.923 1.821 . . . . 19.6 115.67 -177.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -69.37 -46.14 67.67 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 114.027 -1.442 . . . . 47.61 108.843 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -70.66 -31.11 67.91 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-O 116.729 -1.605 . . . . 24.41 109.713 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -56.86 16.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 122.862 2.574 . . . . 14.96 110.452 176.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.63 -40.16 96.13 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 114.912 -1.04 . . . . 17.86 111.51 -179.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.82 -36.19 83.54 Favored 'General case' 0 C--O 1.251 1.154 0 N-CA-C 114.065 1.135 . . . . 13.65 114.065 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 59.0 m -72.03 -39.2 69.32 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 108.861 -0.792 . . . . 11.48 108.861 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 46.9 mt -60.39 -47.33 92.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 106.417 -1.697 . . . . 13.57 106.417 177.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -67.81 -19.52 65.09 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 118.682 -2.511 . . . . 23.1 114.744 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -80.3 -35.75 35.34 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 117.1 -3.5 . . . . 16.75 110.213 175.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -96.23 -16.72 21.26 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 116.725 2.12 . . . . 18.7 116.725 -171.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 C--N 1.313 -1.006 0 N-CA-C 113.438 0.903 . . . . 22.32 113.438 -176.057 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_