data_3p8m_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 3p8m _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 ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.062 0 N-CA-C 111.415 0.154 . . . . 95.38 111.415 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . . . -92.84 86.76 5.59 Favored 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 124.818 1.247 . . . . 81.96 112.393 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -76.06 151.04 37.2 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.312 1.045 . . . . 75.95 112.648 -170.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.69 123.59 33.28 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 114.322 1.23 . . . . 65.59 114.322 -171.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.42 113.35 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 115.841 -0.618 . . . . 65.84 109.657 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.0 mt -83.15 116.47 27.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.359 0 CA-C-N 116.469 -0.332 . . . . 55.64 111.636 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . . . -80.66 -44.42 18.83 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.626 -0.429 . . . . 61.33 110.606 178.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -151.27 146.23 25.9 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 116.658 -0.246 . . . . 53.08 110.848 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.13 141.46 21.5 Favored 'General case' 0 C--O 1.25 1.122 0 O-C-N 124.02 0.825 . . . . 52.19 112.505 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . 0.47 ' OD2' ' N ' ' A' ' 71' ' ' LYS . 15.1 t70 -134.71 87.88 2.39 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 103.429 -2.804 . . . . 54.83 103.429 164.589 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.3 ttt -170.07 160.74 8.31 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.127 -1.064 . . . . 54.89 108.127 -164.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.4 p -74.14 156.7 37.09 Favored 'General case' 0 C--O 1.209 -1.061 0 N-CA-C 108.968 -0.753 . . . . 59.17 108.968 175.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -64.19 -46.24 84.83 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.077 -0.511 . . . . 74.66 111.786 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -51.13 -61.25 2.35 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.234 -1.025 . . . . 71.73 108.234 175.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 13.2 mtt -51.71 -39.02 57.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.752 1.019 . . . . 55.4 113.752 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -61.56 -49.68 75.69 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 113.001 0.741 . . . . 53.83 113.001 178.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -60.13 -40.32 89.36 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.992 0.425 . . . . 67.61 110.068 173.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -65.65 -36.28 83.23 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 112.508 0.558 . . . . 57.35 112.508 -176.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.1 -52.79 64.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.192 0.52 . . . . 47.89 110.633 167.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 97.9 t -57.11 -34.45 45.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.299 -0.409 . . . . 55.55 111.858 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -68.0 -55.46 12.55 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 121.023 0.44 . . . . 61.84 110.009 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' CYS . . . . . 0.493 ' SG ' ' CD ' ' A' ' 45' ' ' GLU . 1.2 m -47.41 -55.98 7.84 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.014 0.435 . . . . 51.45 109.931 178.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.85 -44.59 39.73 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.541 -1.281 . . . . 52.21 107.541 -176.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.5 m -64.6 -46.13 83.97 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.613 -0.721 . . . . 64.16 112.81 -178.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -58.64 -58.19 9.67 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.539 -0.541 . . . . 63.97 109.539 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.04 -45.76 8.13 Favored 'General case' 0 C--O 1.224 -0.265 0 O-C-N 123.756 0.66 . . . . 57.45 112.779 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 47.7 mtp -72.02 -19.48 61.85 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 115.099 1.518 . . . . 65.79 115.099 -178.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -74.6 -33.46 62.64 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 122.543 0.337 . . . . 73.86 111.23 171.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.9 tttt -82.25 -57.2 3.48 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.542 0.737 . . . . 70.78 111.685 -178.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -111.15 137.46 48.81 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 112.99 0.737 . . . . 63.62 112.99 -171.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -83.69 -32.01 25.78 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.809 -0.632 . . . . 80.17 112.497 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 9.8 mt -84.59 129.63 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 122.928 0.491 . . . . 68.89 111.589 -173.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -56.01 -51.6 67.18 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.584 0.957 . . . . 61.19 113.584 -175.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . . . -40.41 -45.9 2.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.823 -0.626 . . . . 55.97 109.844 177.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -75.57 -36.53 60.36 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.685 1.365 . . . . 60.19 114.685 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 mt -61.19 -50.15 81.68 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 N-CA-C 107.232 -1.396 . . . . 54.12 107.232 172.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -47.72 -46.64 29.87 Favored 'General case' 0 C--O 1.215 -0.763 0 N-CA-C 114.421 1.267 . . . . 44.77 114.421 175.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.64 -46.84 65.26 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.923 -0.486 . . . . 45.44 110.402 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -46.77 -45.33 19.76 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 120.892 0.377 . . . . 56.89 111.561 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 20.9 mt -75.25 -54.85 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.114 -0.494 . . . . 43.69 111.927 -174.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -45.91 -44.59 14.76 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 109.624 -0.51 . . . . 42.12 109.624 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -65.72 -46.25 79.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.949 -0.569 . . . . 49.89 111.941 -175.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . 0.493 ' CD ' ' SG ' ' A' ' 24' ' ' CYS . 1.5 tp10 -60.44 -44.12 96.12 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 124.507 1.129 . . . . 52.0 109.822 -177.937 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -71.6 -32.47 68.06 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.373 0.879 . . . . 46.67 113.373 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -59.7 -37.35 78.62 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.209 -0.663 . . . . 50.2 109.209 173.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -72.59 -52.21 16.45 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 112.612 0.597 . . . . 65.43 112.612 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -71.78 -47.04 56.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 57.88 110.45 -173.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -114.63 18.16 16.84 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 114.33 1.233 . . . . 53.76 114.33 -167.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 71.62 145.5 0.11 Allowed Pre-proline 0 N--CA 1.474 0.766 0 N-CA-C 115.171 1.545 . . . . 61.26 115.171 -179.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -65.76 158.2 54.83 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 121.649 1.566 . . . . 52.42 112.841 173.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.8 m -125.11 111.29 15.15 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 124.443 1.097 . . . . 48.28 110.374 11.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -90.07 157.86 17.58 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.137 0.898 . . . . 44.37 112.234 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -134.29 156.52 48.29 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 107.771 -1.196 . . . . 41.61 107.771 174.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 45.9 t -155.52 124.04 5.97 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 113.72 1.007 . . . . 39.74 113.72 -176.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 6.7 mm -116.43 131.87 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 108.499 -0.926 . . . . 43.37 108.499 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.3 t -128.21 128.26 68.41 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 O-C-N 123.892 0.745 . . . . 48.4 109.473 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 176.5 -170.86 43.79 Favored Glycine 0 C--O 1.219 -0.828 0 C-N-CA 120.911 -0.662 . . . . 53.48 114.405 -179.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . . . -124.34 -30.76 3.37 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.997 0.74 . . . . 63.11 112.997 -173.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -129.3 74.19 1.57 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.287 0.565 . . . . 74.72 110.701 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -145.8 164.68 31.12 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.054 0.761 . . . . 57.11 113.054 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.08 160.06 23.98 Favored Glycine 0 C--O 1.218 -0.904 0 N-CA-C 108.19 -1.964 . . . . 54.05 108.19 174.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 84.7 p -150.18 159.26 44.56 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.603 0.964 . . . . 49.82 113.603 -177.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -139.26 124.38 18.93 Favored 'General case' 0 C--O 1.212 -0.909 0 CA-C-N 114.43 -1.259 . . . . 57.71 109.668 163.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 19.2 m -144.89 169.35 8.22 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.975 0 CA-C-O 121.563 0.697 . . . . 47.33 110.55 -168.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.9 m -125.9 128.64 47.88 Favored 'General case' 0 CA--C 1.488 -1.422 0 N-CA-C 106.888 -1.523 . . . . 51.22 106.888 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 31.3 p80 -126.32 166.84 16.4 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 114.121 1.156 . . . . 49.28 114.121 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -78.12 146.53 35.09 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 124.086 0.866 . . . . 56.06 108.683 173.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . 0.449 ' O ' ' ND1' ' A' ' 72' ' ' HIS . 3.6 m -49.24 134.7 17.89 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 114.451 -1.25 . . . . 61.11 109.27 173.75 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . 0.47 ' N ' ' OD2' ' A' ' 12' ' ' ASP . 26.3 mmtm 62.55 27.64 16.33 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.817 1.647 . . . . 64.71 114.833 178.284 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HIS . . . . . 0.449 ' ND1' ' O ' ' A' ' 70' ' ' THR . 77.7 m80 -141.45 56.59 1.52 Allowed 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.729 -0.388 . . . . 52.56 110.295 -177.922 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -151.43 132.55 14.38 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 112.297 0.48 . . . . 44.15 112.297 178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.9 tt -144.37 145.03 21.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.68 0.752 . . . . 45.37 112.695 173.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -139.75 115.13 9.88 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.418 -1.327 . . . . 50.64 107.418 177.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -151.04 158.63 44.35 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.592 0.558 . . . . 48.35 111.794 -172.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -105.62 131.35 53.11 Favored 'General case' 0 C--O 1.24 0.587 0 O-C-N 123.869 0.731 . . . . 58.11 111.579 176.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.38 102.42 11.06 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 103.835 -2.654 . . . . 59.61 103.835 169.077 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.65 -139.76 32.22 Favored Glycine 0 CA--C 1.525 0.712 0 O-C-N 123.802 0.689 . . . . 66.23 111.932 -167.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . . . -87.46 13.47 9.98 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 115.48 -0.36 . . . . 71.88 111.936 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.0 t -110.66 126.39 67.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 121.731 0.777 . . . . 60.48 111.383 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.96 145.54 26.48 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.179 -0.919 . . . . 52.3 111.301 -179.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.4 mt -137.56 114.71 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.512 0.725 . . . . 47.29 111.252 -176.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.6 tp -105.91 129.66 54.02 Favored 'General case' 0 CA--C 1.502 -0.87 0 O-C-N 123.672 0.608 . . . . 40.93 109.362 177.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.0 tp -143.97 131.43 21.01 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 107.697 -1.223 . . . . 39.79 107.697 -176.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 31.9 p90 -167.82 165.91 13.79 Favored 'General case' 0 C--O 1.201 -1.492 0 N-CA-C 113.932 1.086 . . . . 40.13 113.932 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.7 tttt -110.0 131.13 55.34 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-O 121.649 0.738 . . . . 51.16 112.693 -176.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.7 t -158.19 123.98 4.57 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.837 -1.172 . . . . 47.86 107.837 168.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.558 2.778 0 O-C-N 124.118 0.886 . . . . 57.34 114.139 -151.7 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.974 0 N-CA-C 113.924 1.083 . . . . 130.79 113.924 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . . . -152.04 54.5 0.82 Allowed 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 112.956 0.725 . . . . 114.06 112.956 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . . . -74.01 150.41 40.71 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.038 0.447 . . . . 108.89 111.796 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.69 122.56 31.51 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.387 0.884 . . . . 94.16 113.387 -173.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 41.9 t -124.24 114.93 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.329 -0.989 . . . . 90.3 108.329 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ILE . . . . . . . . . . . . . 59.4 mt -82.29 119.98 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 123.28 0.362 . . . . 75.54 110.37 174.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . . . -82.77 -44.72 15.23 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.729 -0.388 . . . . 66.79 111.784 176.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -153.25 143.59 22.43 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.394 0.678 . . . . 60.82 112.483 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.1 139.7 19.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 62.51 112.057 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ASP . . . . . 0.448 ' OD2' ' N ' ' B' ' 71' ' ' LYS . 18.7 t70 -133.96 88.45 2.47 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 104.085 -2.561 . . . . 63.22 104.085 165.229 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 4.0 ttt -168.76 160.72 10.7 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.035 -1.098 . . . . 70.77 108.035 -164.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 23.1 p -73.23 157.98 36.07 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.56 -0.856 . . . . 77.55 108.749 173.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -65.47 -42.11 92.6 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.747 1.017 . . . . 100.97 113.747 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -53.6 -60.95 2.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.965 -0.561 . . . . 96.58 110.323 173.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' MET . . . . . . . . . . . . . 15.7 mtt -49.2 -44.17 42.98 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.766 0.654 . . . . 75.73 112.766 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -58.78 -49.72 76.63 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 112.96 0.726 . . . . 72.49 112.96 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . . . -58.94 -40.17 83.84 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.857 -0.794 . . . . 85.68 108.857 174.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -66.54 -37.0 84.04 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.165 0.507 . . . . 80.8 111.356 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.0 -55.6 33.12 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.949 -0.76 . . . . 68.23 108.949 168.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 89.8 t -55.09 -31.67 26.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.611 0.597 . . . . 81.35 112.611 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -70.54 -52.31 22.66 Favored 'General case' 0 C--O 1.248 1.001 0 CA-C-O 121.187 0.518 . . . . 90.93 110.764 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' CYS . . . . . 0.668 ' SG ' ' O ' ' B' ' 99' ' ' HOH . 1.5 m -50.11 -54.06 23.17 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 115.598 -0.728 . . . . 74.8 110.551 177.175 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.98 -44.01 50.63 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.957 0.785 . . . . 75.62 110.062 -179.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 86.1 m -65.46 -47.43 76.13 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.258 -0.883 . . . . 95.25 110.055 -178.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -58.54 -56.56 20.59 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 121.372 0.606 . . . . 91.76 110.045 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.6 -43.17 11.98 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 114.952 -1.022 . . . . 81.7 112.965 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 60.2 mtp -76.22 -16.8 59.75 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.319 0.859 . . . . 94.83 113.319 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -75.17 -32.41 61.25 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 121.092 -0.243 . . . . 107.61 111.073 170.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . . . -84.05 -57.16 3.3 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.811 -0.631 . . . . 97.38 111.171 -177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -111.77 133.54 53.92 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.148 1.166 . . . . 88.2 114.148 -170.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . . . -79.67 -33.1 41.46 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.677 -0.692 . . . . 97.4 111.341 170.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 14.5 mm -84.49 131.43 34.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.534 0.683 . . . . 89.38 112.036 -172.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -57.12 -51.32 69.75 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 121.932 -0.48 . . . . 75.75 112.091 -174.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -38.7 -50.4 1.64 Allowed 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 108.511 -0.922 . . . . 67.22 108.511 178.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -71.88 -36.6 70.12 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 114.249 1.203 . . . . 77.46 114.249 -177.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 22.2 mt -62.29 -48.85 86.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 106.689 -1.597 . . . . 72.76 106.689 175.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.39 -47.15 37.76 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.656 -1.156 . . . . 58.88 113.506 175.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -44.11 78.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.319 0.58 . . . . 58.52 111.767 -179.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -50.58 -44.03 56.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.449 0.643 . . . . 80.12 111.51 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 21.5 mt -76.2 -55.85 10.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 114.954 -1.021 . . . . 60.39 110.818 -173.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -43.84 -46.96 8.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.542 0.687 . . . . 53.94 110.428 177.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -64.99 -46.09 82.87 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 115.182 -0.917 . . . . 63.5 109.612 -174.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -63.31 -43.52 97.58 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 119.826 -0.75 . . . . 78.94 110.531 -175.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -69.38 -32.14 70.98 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 120.196 -0.602 . . . . 61.65 112.509 178.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -57.79 -40.66 80.39 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.168 -0.678 . . . . 63.41 109.168 174.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 33.1 tttt -69.2 -54.78 13.06 Favored 'General case' 0 C--O 1.243 0.73 0 N-CA-C 113.149 0.796 . . . . 83.91 113.149 -177.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . . . -71.63 -44.56 64.15 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.023 0.827 . . . . 73.64 111.115 -173.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -114.44 16.04 17.81 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 116.347 1.98 . . . . 72.54 116.347 -170.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 72.78 144.9 0.11 Allowed Pre-proline 0 C--N 1.321 -0.67 0 N-CA-C 114.312 1.227 . . . . 74.22 114.312 179.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -68.34 158.85 55.81 Favored 'Trans proline' 0 CA--C 1.514 -0.505 0 C-N-CA 121.485 1.457 . . . . 63.07 111.902 176.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 5.7 m -123.46 112.31 17.36 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 124.478 1.111 . . . . 55.17 112.781 11.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' TRP . . . . . . . . . . . . . 85.2 m95 -89.38 158.13 17.89 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.497 0.665 . . . . 55.63 112.773 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -135.33 154.27 51.57 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 107.504 -1.295 . . . . 45.25 107.504 173.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' CYS . . . . . . . . . . . . . 43.8 t -153.47 127.01 8.68 Favored 'General case' 0 CA--C 1.496 -1.118 0 N-CA-C 113.447 0.906 . . . . 51.19 113.447 -177.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 7.4 mm -118.85 131.08 72.67 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.775 0 N-CA-C 107.801 -1.185 . . . . 50.14 107.801 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 41.8 t -128.4 125.73 64.43 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 O-C-N 123.915 0.759 . . . . 61.36 110.048 -176.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 178.58 -169.1 40.53 Favored Glycine 0 N--CA 1.464 0.525 0 N-CA-C 115.596 0.998 . . . . 63.85 115.596 -177.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.51 -28.83 2.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.12 1.156 . . . . 95.5 114.12 -172.136 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -133.5 73.68 1.52 Allowed 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 120.636 0.255 . . . . 78.35 110.804 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 27.9 p90 -144.56 164.83 29.76 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.665 -0.698 . . . . 58.99 112.039 175.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -136.11 160.92 24.81 Favored Glycine 0 N--CA 1.474 1.181 0 N-CA-C 108.674 -1.77 . . . . 51.58 108.674 174.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 99.8 p -149.47 159.78 44.01 Favored 'General case' 0 C--O 1.244 0.785 0 N-CA-C 112.86 0.689 . . . . 45.82 112.86 -175.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -138.77 124.84 20.06 Favored 'General case' 0 C--O 1.213 -0.834 0 CA-C-N 114.543 -1.208 . . . . 48.97 108.483 161.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -141.74 168.75 14.79 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.016 0 N-CA-C 112.688 0.625 . . . . 44.01 112.688 -171.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 19.5 m -123.51 127.94 49.06 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 109.534 -0.543 . . . . 48.95 109.534 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' HIS . . . . . 0.417 ' ND1' ' O ' ' B' ' 69' ' ' GLU . 33.4 p80 -127.47 165.13 20.42 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.059 -1.056 . . . . 52.2 113.762 -178.861 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLU . . . . . 0.417 ' O ' ' ND1' ' B' ' 68' ' ' HIS . 13.2 mt-10 -72.15 147.63 46.45 Favored 'General case' 0 C--O 1.247 0.937 0 CA-C-N 114.479 -1.237 . . . . 70.49 108.853 173.283 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' THR . . . . . 0.45 ' O ' ' ND1' ' B' ' 72' ' ' HIS . 1.7 m -54.48 132.87 45.48 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 114.887 -1.051 . . . . 69.54 110.944 171.748 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' LYS . . . . . 0.448 ' N ' ' OD2' ' B' ' 12' ' ' ASP . 29.1 mmtm 62.41 32.85 16.64 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.875 1.27 . . . . 76.79 114.372 179.929 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' HIS . . . . . 0.45 ' ND1' ' O ' ' B' ' 70' ' ' THR . 78.3 m80 -144.83 57.55 1.28 Allowed 'General case' 0 C--O 1.225 -0.21 0 O-C-N 123.653 0.595 . . . . 63.56 111.197 179.815 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -153.51 132.88 12.8 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 112.595 0.591 . . . . 54.51 112.595 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.4 tt -145.3 142.96 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 121.764 0.792 . . . . 61.65 112.813 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -138.46 113.55 9.32 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 106.617 -1.623 . . . . 58.47 106.617 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -151.69 155.84 39.13 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 113.065 0.765 . . . . 66.71 113.065 -172.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -102.71 132.88 48.55 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.657 0.598 . . . . 77.18 109.589 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.41 102.85 10.71 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 104.92 -2.252 . . . . 83.21 104.92 167.435 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.67 -142.53 38.67 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 111.276 -0.729 . . . . 91.93 111.276 -167.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . . . -86.94 16.75 4.61 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.25 0.463 . . . . 93.25 112.25 178.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 2.6 t -115.17 124.76 72.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.384 0.674 . . . . 79.42 110.744 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.33 146.5 26.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.256 -0.884 . . . . 66.07 111.031 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 24.1 mt -137.32 114.08 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 123.8 0.84 . . . . 64.73 111.406 -175.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 39.2 tp -105.08 132.95 50.65 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 108.908 -0.775 . . . . 50.3 108.908 175.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 45.5 tp -148.05 133.32 18.45 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 107.528 -1.286 . . . . 53.31 107.528 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 32.7 p90 -169.83 164.96 9.87 Favored 'General case' 0 C--O 1.203 -1.38 0 N-CA-C 113.768 1.025 . . . . 46.19 113.768 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 45.6 tttt -109.85 131.63 54.89 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.351 0.5 . . . . 60.88 112.351 -176.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 30.7 t -161.8 121.63 2.51 Favored 'General case' 0 C--O 1.252 1.223 0 N-CA-C 109.112 -0.699 . . . . 50.94 109.112 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.44 0 N-CA-C 115.589 0.995 . . . . 61.88 115.589 -169.921 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 130' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.963 0 N-CA-C 111.841 -0.504 . . . . 86.63 111.841 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -148.43 113.2 5.4 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 117.117 0.458 . . . . 78.18 111.162 -173.671 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 132' ' ' VAL . . . . . . . . . . . . . 77.5 t -128.94 117.41 44.19 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.456 0 CA-C-N 115.284 -0.871 . . . . 64.47 109.056 -171.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 133' ' ' SER . . . . . . . . . . . . . 9.9 m -97.61 132.27 43.43 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 118.533 -0.746 . . . . 62.91 109.884 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 134' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -162.77 161.58 26.27 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 113.681 0.993 . . . . 53.79 113.681 -179.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 135' ' ' GLY . . . . . . . . . . . . . . . -121.48 166.22 14.36 Favored Glycine 0 N--CA 1.472 1.055 0 N-CA-C 116.294 1.278 . . . . 52.39 116.294 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 136' ' ' THR . . . . . . . . . . . . . 30.5 p -131.53 157.8 42.61 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.489 0.716 . . . . 56.43 110.44 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 137' ' ' GLN . . . . . . . . . . . . . 66.6 tp60 -149.49 135.58 18.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.91 -0.586 . . . . 66.31 110.477 171.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 138' ' ' THR . . . . . . . . . . . . . 68.3 p -77.89 158.56 29.36 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.689 -0.687 . . . . 71.36 111.053 176.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 139' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -130.28 25.69 5.16 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 112.517 0.562 . . . . 89.66 112.517 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 140' ' ' GLY . . . . . . . . . . . . . . . -65.82 161.1 43.98 Favored Glycine 0 N--CA 1.462 0.405 0 N-CA-C 112.228 -0.349 . . . . 136.55 112.228 -177.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 141' ' ' GLY . . . . . . . . . . . . . . . 125.52 -24.28 5.87 Favored Glycine 0 N--CA 1.463 0.457 0 CA-C-O 120.111 -0.272 . . . . 114.83 112.988 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 142' ' ' SER . . . . . . . . . . . . . 7.2 m -74.55 128.2 34.97 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 113.418 0.896 . . . . 115.21 113.418 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 143' ' ' GLY . . . . . . . . . . . . . . . 98.4 15.97 33.5 Favored Glycine 0 N--CA 1.473 1.109 0 N-CA-C 114.328 0.491 . . . . 95.15 114.328 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 144' ' ' MET . . . . . . . . . . . . . 5.2 ttt -80.14 -43.64 21.28 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.385 0.674 . . . . 90.2 111.112 -176.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 145' ' ' LYS . . . . . . . . . . . . . . . -60.47 -42.63 96.62 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.224 -0.658 . . . . 76.87 109.224 175.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 146' ' ' GLN . . . . . . . . . . . . . . . -47.01 -49.85 20.27 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 116.146 -0.479 . . . . 83.5 111.584 173.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 147' ' ' LEU . . . . . . . . . . . . . 39.2 mt -68.95 -53.13 22.48 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.808 -0.633 . . . . 82.96 110.751 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 148' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -49.11 -47.14 45.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.801 0.334 . . . . 75.58 111.644 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 149' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -66.75 -33.05 74.77 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.945 0.72 . . . . 70.3 112.945 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 150' ' ' LYS . . . . . . . . . . . . . . . -72.69 -37.93 67.71 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.621 0.23 . . . . 69.09 111.621 178.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 151' ' ' VAL . . . . . . . . . . . . . 76.9 t -60.69 -55.41 24.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 122.082 0.944 . . . . 63.29 111.805 174.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 152' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -43.2 -48.54 6.54 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.276 -0.875 . . . . 67.08 111.631 170.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 153' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -61.34 -50.68 71.96 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.525 -0.917 . . . . 70.75 108.525 -177.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 154' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.96 -51.87 54.64 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 116.049 -0.523 . . . . 66.28 110.536 -174.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 155' ' ' LEU . . . . . . . . . . . . . 1.2 mt -40.52 -47.95 2.75 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.33 0.586 . . . . 55.53 112.259 172.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 156' ' ' SER . . . . . . . . . . . . . 4.7 t -71.82 -52.58 16.77 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.911 -0.586 . . . . 55.92 110.995 -175.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 157' ' ' LYS . . . . . . . . . . . . . . . -49.81 -39.66 39.3 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 109.592 -0.522 . . . . 63.57 109.592 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 158' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -63.35 -60.1 3.83 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.813 1.245 . . . . 63.33 112.952 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 159' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -48.43 -49.81 33.72 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.898 -0.779 . . . . 64.21 108.898 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 160' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -63.7 -36.34 83.54 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.298 0.851 . . . . 65.45 113.298 -178.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 161' ' ' LEU . . . . . . . . . . . . . 10.1 mt -65.79 -46.13 79.86 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.6 -0.518 . . . . 72.08 109.6 175.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 162' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -53.59 -46.84 70.49 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.38 0.511 . . . . 69.8 112.38 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 163' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -60.05 -39.65 86.68 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.137 0.494 . . . . 73.94 111.721 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 164' ' ' GLU . . . . . 0.49 ' CA ' ' OE1' ' D' ' 164' ' ' GLU . 0.0 OUTLIER -58.8 -44.92 90.91 Favored 'General case' 0 CA--C 1.562 1.441 0 CA-C-O 121.976 0.893 . . . . 90.42 110.885 176.009 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 165' ' ' VAL . . . . . . . . . . . . . 88.7 t -58.08 -60.04 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.548 -0.751 . . . . 87.07 110.636 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 166' ' ' ALA . . . . . . . . . . . . . . . -48.64 -43.58 36.65 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-N 115.909 -0.587 . . . . 87.22 110.691 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 167' ' ' ARG . . . . . 0.47 ' NE ' ' OE1' ' D' ' 164' ' ' GLU . 47.9 ttp85 -63.23 -41.05 99.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.111 -0.949 . . . . 102.25 112.103 -179.765 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 168' ' ' LEU . . . . . . . . . . . . . 67.1 mt -79.36 -38.18 35.66 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 113.425 0.898 . . . . 108.72 113.425 -178.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 169' ' ' LYS . . . . . . . . . . . . . . . -54.06 -42.23 69.04 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 122.67 0.388 . . . . 110.87 111.216 173.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 170' ' ' LYS . . . . . . . . . . . . . . . -56.92 -39.46 74.53 Favored 'General case' 0 C--O 1.239 0.501 0 O-C-N 123.515 0.509 . . . . 115.95 111.327 175.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 171' ' ' LEU . . . . . . . . . . . . . . . -67.76 -53.88 23.69 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 116.148 -0.478 . . . . 131.3 111.775 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 172' ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.478 0.928 0 CA-C-N 116.488 -0.324 . . . . 139.94 110.579 -178.727 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 131' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 110.706 -0.109 . . . . 89.94 110.706 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 132' ' ' VAL . . . . . . . . . . . . . 78.4 t -133.49 113.74 19.42 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.828 0 C-N-CA 123.569 0.748 . . . . 77.1 109.867 -170.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 133' ' ' SER . . . . . . . . . . . . . 9.9 m -93.69 132.75 37.73 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.097 -0.705 . . . . 58.82 109.097 -179.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 134' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -160.72 162.92 32.66 Favored 'General case' 0 C--O 1.209 -1.067 0 N-CA-C 114.355 1.243 . . . . 69.33 114.355 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 135' ' ' GLY . . . . . . . . . . . . . . . -122.69 167.25 15.05 Favored Glycine 0 C--O 1.22 -0.762 0 N-CA-C 116.934 1.533 . . . . 53.24 116.934 177.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 136' ' ' THR . . . . . . . . . . . . . 27.0 p -131.8 158.2 41.88 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.972 0.909 . . . . 55.49 109.962 175.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 137' ' ' GLN . . . . . . . . . . . . . 66.6 tp60 -149.01 134.26 18.34 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.639 -0.71 . . . . 71.25 111.139 169.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 138' ' ' THR . . . . . . . . . . . . . 71.8 p -75.56 153.94 37.09 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.545 -0.752 . . . . 83.25 111.812 177.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 139' ' ' GLU . . . . . . . . . . . . . . . -59.04 104.18 0.22 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.873 -0.603 . . . . 105.1 109.63 -179.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 140' ' ' GLY . . . . . . . . . . . . . . . -61.38 132.58 47.97 Favored Glycine 0 N--CA 1.466 0.698 0 CA-C-O 119.392 -0.671 . . . . 116.27 112.758 -171.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 141' ' ' GLY . . . . . . . . . . . . . . . -162.1 -147.58 5.05 Favored Glycine 0 N--CA 1.471 1.023 0 CA-C-N 118.912 1.356 . . . . 103.93 111.589 2.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 142' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.23 155.05 38.71 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.945 0.402 . . . . 93.89 110.852 -176.788 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 143' ' ' GLY . . . . . . . . . . . . . . . -73.62 -24.14 75.32 Favored Glycine 0 N--CA 1.461 0.311 0 N-CA-C 109.342 -1.503 . . . . 93.8 109.342 172.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 144' ' ' MET . . . . . . . . . . . . . 1.9 ttt -77.6 -36.67 51.63 Favored 'General case' 0 N--CA 1.437 -1.097 0 C-N-CA 120.458 -0.497 . . . . 100.44 111.058 -175.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 145' ' ' LYS . . . . . . . . . . . . . . . -62.66 -45.49 92.58 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.048 -1.093 . . . . 86.62 108.048 172.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 146' ' ' GLN . . . . . . . . . . . . . . . -45.23 -52.23 9.75 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-N 116.195 -0.457 . . . . 90.84 110.432 176.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 147' ' ' LEU . . . . . . . . . . . . . 42.7 mt -65.99 -54.43 26.28 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.737 -0.665 . . . . 91.57 110.72 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 148' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -46.68 -50.71 17.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.239 -0.437 . . . . 92.99 110.341 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 149' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -64.49 -35.63 81.58 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 116.184 -0.462 . . . . 90.42 112.229 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 150' ' ' LYS . . . . . . . . . . . . . . . -69.8 -38.14 76.52 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 120.67 -0.412 . . . . 85.8 111.446 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 151' ' ' VAL . . . . . . . . . . . . . 60.3 t -62.26 -52.57 58.51 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 109.239 -0.652 . . . . 80.63 109.239 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 152' ' ' GLU . . . . . . . . . . . . . . . -45.61 -48.04 14.67 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.241 -0.89 . . . . 85.9 110.866 174.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 153' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -62.16 -48.44 80.09 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.714 -0.675 . . . . 91.48 111.603 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 154' ' ' LEU . . . . . . . . . . . . . 83.5 mt -67.45 -49.55 63.11 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 115.81 -0.632 . . . . 79.02 110.639 -177.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 155' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.1 -44.77 10.72 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.992 0.425 . . . . 87.3 110.057 176.516 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 156' ' ' SER . . . . . . . . . . . . . 2.2 t -72.8 -51.69 17.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.45 -0.795 . . . . 99.0 111.363 -173.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 157' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt -50.98 -37.16 43.06 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 123.484 0.49 . . . . 94.96 112.288 172.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 158' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -65.31 -59.09 4.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 113.573 0.953 . . . . 82.36 113.573 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 159' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -48.51 -51.08 29.06 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.231 -1.025 . . . . 127.26 108.231 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 160' ' ' HIS . . . . . . . . . . . . . . . -62.85 -37.71 87.91 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 112.285 0.476 . . . . 100.14 112.285 -177.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 161' ' ' LEU . . . . . . . . . . . . . 8.7 tp -65.1 -44.75 87.81 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.585 0.553 . . . . 88.95 110.809 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 162' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -57.01 -44.22 82.59 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.004 0.742 . . . . 91.51 113.004 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 163' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -61.11 -38.82 87.69 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.242 0.544 . . . . 115.74 111.376 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 164' ' ' GLU . . . . . 0.584 ' OE1' ' NE ' ' C' ' 167' ' ' ARG . 0.0 OUTLIER -60.16 -45.36 93.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.075 -0.966 . . . . 123.49 110.352 176.715 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 165' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' C' ' 169' ' ' LYS . 76.1 t -58.15 -61.26 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 115.546 -0.752 . . . . 96.94 110.043 176.567 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 166' ' ' ALA . . . . . 0.484 ' O ' ' N ' ' C' ' 170' ' ' LYS . . . -49.27 -42.22 40.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.669 -0.241 . . . . 108.28 111.27 178.159 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 167' ' ' ARG . . . . . 0.584 ' NE ' ' OE1' ' C' ' 164' ' ' GLU . 51.2 ttp85 -60.24 -38.36 83.21 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 116.16 -0.473 . . . . 135.27 111.871 179.723 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 168' ' ' LEU . . . . . . . . . . . . . 22.5 mt -79.54 -34.99 40.59 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.103 -0.332 . . . . 118.68 110.103 172.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 169' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' C' ' 165' ' ' VAL . . . -67.82 -24.38 65.28 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 116.298 -0.41 . . . . 111.23 110.81 177.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 170' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' C' ' 166' ' ' ALA . . . -74.23 -35.64 63.88 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.168 0.587 . . . . 129.64 111.655 174.368 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 171' ' ' LEU . . . . . . . . . . . . . 5.4 mt -69.93 -34.14 73.07 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.291 0.848 . . . . 147.03 113.291 174.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.35 0 CA-C-O 120.681 0.277 . . . . 117.87 111.695 -179.156 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' HOH . . . . . 0.668 ' O ' ' SG ' ' B' ' 24' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' HOH . . . . . 0.409 ' O ' ' CG2' ' B' ' 70' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.062 0 N-CA-C 111.415 0.154 . . . . 95.38 111.415 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . . . -92.84 86.76 5.59 Favored 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 124.818 1.247 . . . . 81.96 112.393 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -76.06 151.04 37.2 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.312 1.045 . . . . 75.95 112.648 -170.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.69 123.59 33.28 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 114.322 1.23 . . . . 65.59 114.322 -171.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.42 113.35 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 115.841 -0.618 . . . . 65.84 109.657 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.0 mt -83.15 116.47 27.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.359 0 CA-C-N 116.469 -0.332 . . . . 55.64 111.636 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . . . -80.66 -44.42 18.83 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.626 -0.429 . . . . 61.33 110.606 178.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -151.27 146.23 25.9 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 116.658 -0.246 . . . . 53.08 110.848 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.13 141.46 21.5 Favored 'General case' 0 C--O 1.25 1.122 0 O-C-N 124.02 0.825 . . . . 52.19 112.505 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -134.71 87.88 2.39 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 103.429 -2.804 . . . . 54.83 103.429 164.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.3 ttt -170.07 160.74 8.31 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.127 -1.064 . . . . 54.89 108.127 -164.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.4 p -74.14 156.7 37.09 Favored 'General case' 0 C--O 1.209 -1.061 0 N-CA-C 108.968 -0.753 . . . . 59.17 108.968 175.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -64.19 -46.24 84.83 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.077 -0.511 . . . . 74.66 111.786 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -51.13 -61.25 2.35 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.234 -1.025 . . . . 71.73 108.234 175.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 13.2 mtt -51.71 -39.02 57.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.752 1.019 . . . . 55.4 113.752 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLN . . . . . 0.461 ' HG2' HD12 ' A' ' 74' ' ' ILE . 63.6 mt-30 -61.56 -49.68 75.69 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 113.001 0.741 . . . . 53.83 113.001 178.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -60.13 -40.32 89.36 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.992 0.425 . . . . 67.61 110.068 173.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -65.65 -36.28 83.23 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 112.508 0.558 . . . . 57.35 112.508 -176.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.1 -52.79 64.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.192 0.52 . . . . 47.89 110.633 167.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 97.9 t -57.11 -34.45 45.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.299 -0.409 . . . . 55.55 111.858 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -68.0 -55.46 12.55 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 121.023 0.44 . . . . 61.84 110.009 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' CYS . . . . . 0.493 ' SG ' ' CD ' ' A' ' 45' ' ' GLU . 1.2 m -47.41 -55.98 7.84 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.014 0.435 . . . . 51.45 109.931 178.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.85 -44.59 39.73 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.541 -1.281 . . . . 52.21 107.541 -176.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.5 m -64.6 -46.13 83.97 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.613 -0.721 . . . . 64.16 112.81 -178.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -58.64 -58.19 9.67 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.539 -0.541 . . . . 63.97 109.539 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.04 -45.76 8.13 Favored 'General case' 0 C--O 1.224 -0.265 0 O-C-N 123.756 0.66 . . . . 57.45 112.779 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 47.7 mtp -72.02 -19.48 61.85 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 115.099 1.518 . . . . 65.79 115.099 -178.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -74.6 -33.46 62.64 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 122.543 0.337 . . . . 73.86 111.23 171.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . 0.513 ' HD3' ' CE2' ' A' ' 32' ' ' TYR . 27.9 tttt -82.25 -57.2 3.48 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.542 0.737 . . . . 70.78 111.685 -178.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TYR . . . . . 0.513 ' CE2' ' HD3' ' A' ' 31' ' ' LYS . 45.1 m-85 -111.15 137.46 48.81 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 112.99 0.737 . . . . 63.62 112.99 -171.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -83.69 -32.01 25.78 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.809 -0.632 . . . . 80.17 112.497 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 9.8 mt -84.59 129.63 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 122.928 0.491 . . . . 69.98 111.589 -173.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . 0.424 ' HA ' HD12 ' A' ' 38' ' ' ILE . 2.3 mp0 -56.01 -51.6 67.18 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.584 0.957 . . . . 61.19 113.584 -175.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . 0.498 ' HB2' ' HB2' ' C' ' 137' ' ' GLN . . . -40.41 -45.9 2.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.823 -0.626 . . . . 55.97 109.844 177.389 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -75.57 -36.53 60.36 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.685 1.365 . . . . 60.19 114.685 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . 0.424 HD12 ' HA ' ' A' ' 35' ' ' GLU . 26.3 mt -61.19 -50.15 81.68 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 N-CA-C 107.232 -1.396 . . . . 54.12 107.232 172.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -47.72 -46.64 29.87 Favored 'General case' 0 C--O 1.215 -0.763 0 N-CA-C 114.421 1.267 . . . . 44.77 114.421 175.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.64 -46.84 65.26 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.923 -0.486 . . . . 45.44 110.402 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -46.77 -45.33 19.76 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 120.892 0.377 . . . . 56.89 111.561 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 20.9 mt -75.25 -54.85 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.114 -0.494 . . . . 43.69 111.927 -174.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -45.91 -44.59 14.76 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 109.624 -0.51 . . . . 42.12 109.624 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -65.72 -46.25 79.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.949 -0.569 . . . . 49.89 111.941 -175.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . 0.493 ' CD ' ' SG ' ' A' ' 24' ' ' CYS . 1.5 tp10 -60.44 -44.12 96.12 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 124.507 1.129 . . . . 52.0 109.822 -177.937 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -71.6 -32.47 68.06 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.373 0.879 . . . . 46.67 113.373 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -59.7 -37.35 78.62 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.209 -0.663 . . . . 50.2 109.209 173.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -72.59 -52.21 16.45 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 112.612 0.597 . . . . 65.43 112.612 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -71.78 -47.04 56.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 57.88 110.45 -173.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' TYR . . . . . 0.473 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 39.9 m-85 -114.63 18.16 16.84 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 114.33 1.233 . . . . 53.76 114.33 -167.485 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 89.9 m-20 71.62 145.5 0.11 Allowed Pre-proline 0 N--CA 1.474 0.766 0 N-CA-C 115.171 1.545 . . . . 61.26 115.171 -179.937 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -65.76 158.2 54.83 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 121.649 1.566 . . . . 52.42 112.841 173.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.8 m -125.11 111.29 15.15 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 124.443 1.097 . . . . 48.28 110.374 11.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -90.07 157.86 17.58 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.137 0.898 . . . . 44.37 112.234 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -134.29 156.52 48.29 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 107.771 -1.196 . . . . 41.61 107.771 174.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' CYS . . . . . 0.467 ' C ' HD13 ' A' ' 57' ' ' ILE . 45.9 t -155.52 124.04 5.97 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 113.72 1.007 . . . . 39.74 113.72 -176.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . 0.467 HD13 ' C ' ' A' ' 56' ' ' CYS . 6.7 mm -116.43 131.87 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 108.499 -0.926 . . . . 43.37 108.499 179.138 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.3 t -128.21 128.26 68.41 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 O-C-N 123.892 0.745 . . . . 48.4 109.473 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 176.5 -170.86 43.79 Favored Glycine 0 C--O 1.219 -0.828 0 C-N-CA 120.911 -0.662 . . . . 53.48 114.405 -179.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . . . -124.34 -30.76 3.37 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.997 0.74 . . . . 63.11 112.997 -173.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . 0.665 ' HB3' ' HE ' ' B' ' 60' ' ' ARG . 5.2 m120 -129.3 74.19 1.57 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.287 0.565 . . . . 74.72 110.701 -179.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -145.8 164.68 31.12 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.054 0.761 . . . . 57.11 113.054 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.08 160.06 23.98 Favored Glycine 0 C--O 1.218 -0.904 0 N-CA-C 108.19 -1.964 . . . . 54.05 108.19 174.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 84.7 p -150.18 159.26 44.56 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.603 0.964 . . . . 49.82 113.603 -177.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -139.26 124.38 18.93 Favored 'General case' 0 C--O 1.212 -0.909 0 CA-C-N 114.43 -1.259 . . . . 57.71 109.668 163.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 19.2 m -144.89 169.35 8.22 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.975 0 CA-C-O 121.563 0.697 . . . . 47.33 110.55 -168.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.9 m -125.9 128.64 47.88 Favored 'General case' 0 CA--C 1.488 -1.422 0 N-CA-C 106.888 -1.523 . . . . 51.22 106.888 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 31.3 p80 -126.32 166.84 16.4 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 114.121 1.156 . . . . 49.28 114.121 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -78.12 146.53 35.09 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 124.086 0.866 . . . . 56.06 108.683 173.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.6 m -49.24 134.7 17.89 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 114.451 -1.25 . . . . 61.11 109.27 173.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mmtm 62.55 27.64 16.33 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.817 1.647 . . . . 64.71 114.833 178.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -141.45 56.59 1.52 Allowed 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.729 -0.388 . . . . 52.56 110.295 -177.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -151.43 132.55 14.38 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 112.297 0.48 . . . . 44.15 112.297 178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . 0.461 HD12 ' HG2' ' A' ' 18' ' ' GLN . 17.9 tt -144.37 145.03 21.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.68 0.752 . . . . 45.37 112.695 173.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -139.75 115.13 9.88 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.418 -1.327 . . . . 50.64 107.418 177.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -151.04 158.63 44.35 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.592 0.558 . . . . 48.35 111.794 -172.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -105.62 131.35 53.11 Favored 'General case' 0 C--O 1.24 0.587 0 O-C-N 123.869 0.731 . . . . 58.11 111.579 176.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.38 102.42 11.06 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 103.835 -2.654 . . . . 59.61 103.835 169.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.65 -139.76 32.22 Favored Glycine 0 CA--C 1.525 0.712 0 O-C-N 123.802 0.689 . . . . 66.23 111.932 -167.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . . . -87.46 13.47 9.98 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 115.48 -0.36 . . . . 71.88 111.936 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.0 t -110.66 126.39 67.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 121.731 0.777 . . . . 60.48 111.383 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.96 145.54 26.48 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.179 -0.919 . . . . 52.3 111.301 -179.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.4 mt -137.56 114.71 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.512 0.725 . . . . 47.29 111.252 -176.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.6 tp -105.91 129.66 54.02 Favored 'General case' 0 CA--C 1.502 -0.87 0 O-C-N 123.672 0.608 . . . . 40.93 109.362 177.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.0 tp -143.97 131.43 21.01 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 107.697 -1.223 . . . . 39.79 107.697 -176.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 31.9 p90 -167.82 165.91 13.79 Favored 'General case' 0 C--O 1.201 -1.492 0 N-CA-C 113.932 1.086 . . . . 40.13 113.932 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.7 tttt -110.0 131.13 55.34 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-O 121.649 0.738 . . . . 51.16 112.693 -176.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.7 t -158.19 123.98 4.57 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.837 -1.172 . . . . 47.86 107.837 168.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . 0.406 ' HA2' ' O ' ' B' ' 89' ' ' GLY . . . . . . . . 0 CA--C 1.558 2.778 0 O-C-N 124.118 0.886 . . . . 57.34 114.139 -151.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.974 0 N-CA-C 113.924 1.083 . . . . 130.79 113.924 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . . . -152.04 54.5 0.82 Allowed 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 112.956 0.725 . . . . 114.06 112.956 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . . . -74.01 150.41 40.71 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.038 0.447 . . . . 108.89 111.796 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.69 122.56 31.51 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.387 0.884 . . . . 94.16 113.387 -173.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 41.9 t -124.24 114.93 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.329 -0.989 . . . . 90.3 108.329 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ILE . . . . . . . . . . . . . 59.4 mt -82.29 119.98 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 123.28 0.362 . . . . 75.54 110.37 174.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . . . -82.77 -44.72 15.23 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.729 -0.388 . . . . 66.79 111.784 176.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -153.25 143.59 22.43 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.394 0.678 . . . . 60.82 112.483 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.1 139.7 19.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 62.51 112.057 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -133.96 88.45 2.47 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 104.085 -2.561 . . . . 63.22 104.085 165.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 4.0 ttt -168.76 160.72 10.7 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.035 -1.098 . . . . 70.77 108.035 -164.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 23.1 p -73.23 157.98 36.07 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.56 -0.856 . . . . 77.55 108.749 173.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -65.47 -42.11 92.6 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.747 1.017 . . . . 100.97 113.747 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -53.6 -60.95 2.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.965 -0.561 . . . . 96.58 110.323 173.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' MET . . . . . . . . . . . . . 15.7 mtt -49.2 -44.17 42.98 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.766 0.654 . . . . 75.73 112.766 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLN . . . . . 0.474 ' HG2' HD12 ' B' ' 74' ' ' ILE . 64.2 mt-30 -58.78 -49.72 76.63 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 112.96 0.726 . . . . 72.49 112.96 -178.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . . . -58.94 -40.17 83.84 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.857 -0.794 . . . . 85.68 108.857 174.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -66.54 -37.0 84.04 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.165 0.507 . . . . 80.8 111.356 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.0 -55.6 33.12 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.949 -0.76 . . . . 68.23 108.949 168.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 89.8 t -55.09 -31.67 26.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.611 0.597 . . . . 81.35 112.611 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -70.54 -52.31 22.66 Favored 'General case' 0 C--O 1.248 1.001 0 CA-C-O 121.187 0.518 . . . . 90.93 110.764 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' CYS . . . . . 0.668 ' SG ' ' O ' ' B' ' 99' ' ' HOH . 1.5 m -50.11 -54.06 23.17 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 115.598 -0.728 . . . . 74.8 110.551 177.175 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.98 -44.01 50.63 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.957 0.785 . . . . 75.62 110.062 -179.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 86.1 m -65.46 -47.43 76.13 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.258 -0.883 . . . . 95.25 110.055 -178.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -58.54 -56.56 20.59 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 121.372 0.606 . . . . 91.76 110.045 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.6 -43.17 11.98 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 114.952 -1.022 . . . . 81.7 112.965 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 60.2 mtp -76.22 -16.8 59.75 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.319 0.859 . . . . 94.83 113.319 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -75.17 -32.41 61.25 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 121.092 -0.243 . . . . 107.61 111.073 170.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LYS . . . . . 0.492 ' HB3' ' CD2' ' B' ' 32' ' ' TYR . . . -84.05 -57.16 3.3 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.811 -0.631 . . . . 97.38 111.171 -177.548 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' TYR . . . . . 0.492 ' CD2' ' HB3' ' B' ' 31' ' ' LYS . 42.9 m-85 -111.77 133.54 53.92 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.148 1.166 . . . . 88.2 114.148 -170.576 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . . . -79.67 -33.1 41.46 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.677 -0.692 . . . . 97.4 111.341 170.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 14.5 mm -84.49 131.43 34.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.534 0.683 . . . . 89.38 112.036 -172.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLU . . . . . 0.603 ' HA ' HD12 ' B' ' 38' ' ' ILE . 2.2 mp0 -57.12 -51.32 69.75 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 121.932 -0.48 . . . . 75.75 112.091 -174.251 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LYS . . . . . 0.43 ' O ' ' HB3' ' B' ' 39' ' ' ALA . 32.9 tttm -38.7 -50.4 1.64 Allowed 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 108.511 -0.922 . . . . 67.22 108.511 178.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -71.88 -36.6 70.12 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 114.249 1.203 . . . . 77.46 114.249 -177.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ILE . . . . . 0.603 HD12 ' HA ' ' B' ' 35' ' ' GLU . 22.2 mt -62.29 -48.85 86.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 106.689 -1.597 . . . . 72.76 106.689 175.011 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' B' ' 36' ' ' LYS . . . -48.39 -47.15 37.76 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.656 -1.156 . . . . 58.88 113.506 175.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -44.11 78.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.319 0.58 . . . . 58.52 111.767 -179.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -50.58 -44.03 56.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.449 0.643 . . . . 80.12 111.51 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 21.5 mt -76.2 -55.85 10.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 114.954 -1.021 . . . . 60.39 110.818 -173.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -43.84 -46.96 8.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.542 0.687 . . . . 53.94 110.428 177.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -64.99 -46.09 82.87 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 115.182 -0.917 . . . . 63.5 109.612 -174.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -63.31 -43.52 97.58 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 119.826 -0.75 . . . . 78.94 110.531 -175.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -69.38 -32.14 70.98 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 120.196 -0.602 . . . . 61.65 112.509 178.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -57.79 -40.66 80.39 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.168 -0.678 . . . . 63.41 109.168 174.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 33.1 tttt -69.2 -54.78 13.06 Favored 'General case' 0 C--O 1.243 0.73 0 N-CA-C 113.149 0.796 . . . . 83.91 113.149 -177.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . . . -71.63 -44.56 64.15 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.023 0.827 . . . . 73.64 111.115 -173.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' TYR . . . . . 0.472 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 41.2 m-85 -114.44 16.04 17.81 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 116.347 1.98 . . . . 72.54 116.347 -170.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 91.0 m-20 72.78 144.9 0.11 Allowed Pre-proline 0 C--N 1.321 -0.67 0 N-CA-C 114.312 1.227 . . . . 74.22 114.312 179.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -68.34 158.85 55.81 Favored 'Trans proline' 0 CA--C 1.514 -0.505 0 C-N-CA 121.485 1.457 . . . . 63.07 111.902 176.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 5.7 m -123.46 112.31 17.36 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 124.478 1.111 . . . . 55.17 112.781 11.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' TRP . . . . . . . . . . . . . 85.2 m95 -89.38 158.13 17.89 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.497 0.665 . . . . 55.63 112.773 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -135.33 154.27 51.57 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 107.504 -1.295 . . . . 45.25 107.504 173.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' CYS . . . . . 0.456 ' C ' HD13 ' B' ' 57' ' ' ILE . 43.8 t -153.47 127.01 8.68 Favored 'General case' 0 CA--C 1.496 -1.118 0 N-CA-C 113.447 0.906 . . . . 51.19 113.447 -177.01 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ILE . . . . . 0.456 HD13 ' C ' ' B' ' 56' ' ' CYS . 7.4 mm -118.85 131.08 72.67 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.775 0 N-CA-C 107.801 -1.185 . . . . 50.14 107.801 179.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 41.8 t -128.4 125.73 64.43 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 O-C-N 123.915 0.759 . . . . 61.36 110.048 -176.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 178.58 -169.1 40.53 Favored Glycine 0 N--CA 1.464 0.525 0 N-CA-C 115.596 0.998 . . . . 63.85 115.596 -177.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ARG . . . . . 0.665 ' HE ' ' HB3' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -127.51 -28.83 2.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.12 1.156 . . . . 95.5 114.12 -172.136 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -133.5 73.68 1.52 Allowed 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 120.636 0.255 . . . . 78.35 110.804 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' PHE . . . . . 0.428 ' O ' HG23 ' C' ' 138' ' ' THR . 27.9 p90 -144.56 164.83 29.76 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.665 -0.698 . . . . 58.99 112.039 175.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -136.11 160.92 24.81 Favored Glycine 0 N--CA 1.474 1.181 0 N-CA-C 108.674 -1.77 . . . . 51.58 108.674 174.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' SER . . . . . 0.4 ' CB ' HD12 ' A' ' 57' ' ' ILE . 99.8 p -149.47 159.78 44.01 Favored 'General case' 0 C--O 1.244 0.785 0 N-CA-C 112.86 0.689 . . . . 45.82 112.86 -175.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -138.77 124.84 20.06 Favored 'General case' 0 C--O 1.213 -0.834 0 CA-C-N 114.543 -1.208 . . . . 48.97 108.483 161.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -141.74 168.75 14.79 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.016 0 N-CA-C 112.688 0.625 . . . . 44.01 112.688 -171.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 19.5 m -123.51 127.94 49.06 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 109.534 -0.543 . . . . 48.95 109.534 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 33.4 p80 -127.47 165.13 20.42 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.059 -1.056 . . . . 52.2 113.762 -178.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -72.15 147.63 46.45 Favored 'General case' 0 C--O 1.247 0.937 0 CA-C-N 114.479 -1.237 . . . . 70.49 108.853 173.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' THR . . . . . 0.453 HG21 ' O ' ' B' ' 100' ' ' HOH . 1.7 m -54.48 132.87 45.48 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 114.887 -1.051 . . . . 69.54 110.944 171.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 29.1 mmtm 62.41 32.85 16.64 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.875 1.27 . . . . 76.79 114.372 179.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -144.83 57.55 1.28 Allowed 'General case' 0 C--O 1.225 -0.21 0 O-C-N 123.653 0.595 . . . . 63.56 111.197 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -153.51 132.88 12.8 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 112.595 0.591 . . . . 54.51 112.595 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ILE . . . . . 0.474 HD12 ' HG2' ' B' ' 18' ' ' GLN . 19.4 tt -145.3 142.96 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 121.764 0.792 . . . . 61.65 112.813 175.734 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -138.46 113.55 9.32 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 106.617 -1.623 . . . . 58.47 106.617 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -151.69 155.84 39.13 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 113.065 0.765 . . . . 66.71 113.065 -172.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -102.71 132.88 48.55 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.657 0.598 . . . . 77.18 109.589 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.41 102.85 10.71 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 104.92 -2.252 . . . . 83.21 104.92 167.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.67 -142.53 38.67 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 111.276 -0.729 . . . . 91.93 111.276 -167.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . . . -86.94 16.75 4.61 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.25 0.463 . . . . 93.25 112.25 178.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 2.6 t -115.17 124.76 72.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.384 0.674 . . . . 79.42 110.744 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.33 146.5 26.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.256 -0.884 . . . . 66.07 111.031 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 24.1 mt -137.32 114.08 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 123.8 0.84 . . . . 64.73 111.406 -175.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 39.2 tp -105.08 132.95 50.65 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 108.908 -0.775 . . . . 50.3 108.908 175.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 45.5 tp -148.05 133.32 18.45 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 107.528 -1.286 . . . . 53.31 107.528 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 32.7 p90 -169.83 164.96 9.87 Favored 'General case' 0 C--O 1.203 -1.38 0 N-CA-C 113.768 1.025 . . . . 46.19 113.768 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 45.6 tttt -109.85 131.63 54.89 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.351 0.5 . . . . 60.88 112.351 -176.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 30.7 t -161.8 121.63 2.51 Favored 'General case' 0 C--O 1.252 1.223 0 N-CA-C 109.112 -0.699 . . . . 50.94 109.112 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLY . . . . . 0.406 ' O ' ' HA2' ' A' ' 89' ' ' GLY . . . . . . . . 0 N--CA 1.493 2.44 0 N-CA-C 115.589 0.995 . . . . 61.88 115.589 -169.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 130' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.963 0 N-CA-C 111.841 -0.504 . . . . 86.63 111.841 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -148.43 113.2 5.4 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 117.117 0.458 . . . . 78.18 111.162 -173.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 132' ' ' VAL . . . . . . . . . . . . . 77.5 t -128.94 117.41 44.19 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.456 0 CA-C-N 115.284 -0.871 . . . . 64.47 109.056 -171.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 133' ' ' SER . . . . . . . . . . . . . 9.9 m -97.61 132.27 43.43 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 118.533 -0.746 . . . . 62.91 109.884 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 134' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -162.77 161.58 26.27 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 113.681 0.993 . . . . 53.79 113.681 -179.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 135' ' ' GLY . . . . . . . . . . . . . . . -121.48 166.22 14.36 Favored Glycine 0 N--CA 1.472 1.055 0 N-CA-C 116.294 1.278 . . . . 52.39 116.294 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 136' ' ' THR . . . . . . . . . . . . . 30.5 p -131.53 157.8 42.61 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.489 0.716 . . . . 56.43 110.44 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 137' ' ' GLN . . . . . . . . . . . . . 66.6 tp60 -149.49 135.58 18.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.91 -0.586 . . . . 66.31 110.477 171.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 138' ' ' THR . . . . . . . . . . . . . 68.3 p -77.89 158.56 29.36 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.689 -0.687 . . . . 71.36 111.053 176.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 139' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -130.28 25.69 5.16 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 112.517 0.562 . . . . 89.66 112.517 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 140' ' ' GLY . . . . . . . . . . . . . . . -65.82 161.1 43.98 Favored Glycine 0 N--CA 1.462 0.405 0 N-CA-C 112.228 -0.349 . . . . 136.55 112.228 -177.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 141' ' ' GLY . . . . . . . . . . . . . . . 125.52 -24.28 5.87 Favored Glycine 0 N--CA 1.463 0.457 0 CA-C-O 120.111 -0.272 . . . . 114.83 112.988 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 142' ' ' SER . . . . . . . . . . . . . 7.2 m -74.55 128.2 34.97 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 113.418 0.896 . . . . 115.21 113.418 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 143' ' ' GLY . . . . . . . . . . . . . . . 98.4 15.97 33.5 Favored Glycine 0 N--CA 1.473 1.109 0 N-CA-C 114.328 0.491 . . . . 95.15 114.328 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 144' ' ' MET . . . . . . . . . . . . . 5.2 ttt -80.14 -43.64 21.28 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.385 0.674 . . . . 90.2 111.112 -176.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 145' ' ' LYS . . . . . . . . . . . . . . . -60.47 -42.63 96.62 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.224 -0.658 . . . . 76.87 109.224 175.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 146' ' ' GLN . . . . . . . . . . . . . . . -47.01 -49.85 20.27 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 116.146 -0.479 . . . . 83.5 111.584 173.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 147' ' ' LEU . . . . . . . . . . . . . 39.2 mt -68.95 -53.13 22.48 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.808 -0.633 . . . . 82.96 110.751 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 148' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -49.11 -47.14 45.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.801 0.334 . . . . 75.58 111.644 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 149' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -66.75 -33.05 74.77 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.945 0.72 . . . . 70.3 112.945 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 150' ' ' LYS . . . . . . . . . . . . . . . -72.69 -37.93 67.71 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.621 0.23 . . . . 69.09 111.621 178.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 151' ' ' VAL . . . . . 0.525 HG12 HD12 ' D' ' 155' ' ' LEU . 76.9 t -60.69 -55.41 24.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 122.082 0.944 . . . . 63.29 111.805 174.402 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 152' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -43.2 -48.54 6.54 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.276 -0.875 . . . . 67.08 111.631 170.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 153' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -61.34 -50.68 71.96 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.525 -0.917 . . . . 70.75 108.525 -177.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 154' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.96 -51.87 54.64 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 116.049 -0.523 . . . . 66.28 110.536 -174.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 155' ' ' LEU . . . . . 0.525 HD12 HG12 ' D' ' 151' ' ' VAL . 1.2 mt -40.52 -47.95 2.75 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.33 0.586 . . . . 55.53 112.259 172.946 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 156' ' ' SER . . . . . . . . . . . . . 4.7 t -71.82 -52.58 16.77 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.911 -0.586 . . . . 55.92 110.995 -175.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 157' ' ' LYS . . . . . . . . . . . . . . . -49.81 -39.66 39.3 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 109.592 -0.522 . . . . 63.57 109.592 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 158' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -63.35 -60.1 3.83 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.813 1.245 . . . . 63.33 112.952 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 159' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -48.43 -49.81 33.72 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.898 -0.779 . . . . 64.21 108.898 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 160' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -63.7 -36.34 83.54 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.298 0.851 . . . . 65.45 113.298 -178.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 161' ' ' LEU . . . . . . . . . . . . . 10.1 mt -65.79 -46.13 79.86 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.6 -0.518 . . . . 72.08 109.6 175.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 162' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -53.59 -46.84 70.49 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.38 0.511 . . . . 69.8 112.38 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 163' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -60.05 -39.65 86.68 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.137 0.494 . . . . 73.94 111.721 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 164' ' ' GLU . . . . . 0.685 ' HA ' ' OE1' ' D' ' 164' ' ' GLU . 0.0 OUTLIER -58.8 -44.92 90.91 Favored 'General case' 0 CA--C 1.562 1.441 0 CA-C-O 121.976 0.893 . . . . 90.42 110.885 176.009 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 165' ' ' VAL . . . . . . . . . . . . . 88.7 t -58.08 -60.04 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.548 -0.751 . . . . 87.07 110.636 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 166' ' ' ALA . . . . . . . . . . . . . . . -48.64 -43.58 36.65 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-N 115.909 -0.587 . . . . 87.22 110.691 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 167' ' ' ARG . . . . . 0.47 ' NE ' ' OE1' ' D' ' 164' ' ' GLU . 47.9 ttp85 -63.23 -41.05 99.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.111 -0.949 . . . . 102.25 112.103 -179.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 168' ' ' LEU . . . . . . . . . . . . . 67.1 mt -79.36 -38.18 35.66 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 113.425 0.898 . . . . 108.72 113.425 -178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 169' ' ' LYS . . . . . . . . . . . . . . . -54.06 -42.23 69.04 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 122.67 0.388 . . . . 110.87 111.216 173.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 170' ' ' LYS . . . . . . . . . . . . . . . -56.92 -39.46 74.53 Favored 'General case' 0 C--O 1.239 0.501 0 O-C-N 123.515 0.509 . . . . 115.95 111.327 175.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 171' ' ' LEU . . . . . . . . . . . . . . . -67.76 -53.88 23.69 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 116.148 -0.478 . . . . 131.3 111.775 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 172' ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.478 0.928 0 CA-C-N 116.488 -0.324 . . . . 139.94 110.579 -178.727 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 131' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 110.706 -0.109 . . . . 89.94 110.706 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 132' ' ' VAL . . . . . . . . . . . . . 78.4 t -133.49 113.74 19.42 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.828 0 C-N-CA 123.569 0.748 . . . . 77.1 109.867 -170.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 133' ' ' SER . . . . . . . . . . . . . 9.9 m -93.69 132.75 37.73 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.097 -0.705 . . . . 58.82 109.097 -179.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 134' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -160.72 162.92 32.66 Favored 'General case' 0 C--O 1.209 -1.067 0 N-CA-C 114.355 1.243 . . . . 69.33 114.355 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 135' ' ' GLY . . . . . . . . . . . . . . . -122.69 167.25 15.05 Favored Glycine 0 C--O 1.22 -0.762 0 N-CA-C 116.934 1.533 . . . . 53.24 116.934 177.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 136' ' ' THR . . . . . . . . . . . . . 27.0 p -131.8 158.2 41.88 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.972 0.909 . . . . 55.49 109.962 175.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 137' ' ' GLN . . . . . 0.498 ' HB2' ' HB2' ' A' ' 36' ' ' LYS . 66.6 tp60 -149.01 134.26 18.34 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.639 -0.71 . . . . 71.25 111.139 169.489 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 138' ' ' THR . . . . . 0.428 HG23 ' O ' ' B' ' 62' ' ' PHE . 71.8 p -75.56 153.94 37.09 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.545 -0.752 . . . . 83.25 111.812 177.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 139' ' ' GLU . . . . . . . . . . . . . . . -59.04 104.18 0.22 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.873 -0.603 . . . . 105.1 109.63 -179.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 140' ' ' GLY . . . . . 0.409 ' HA2' ' HA2' ' C' ' 141' ' ' GLY . . . -61.38 132.58 47.97 Favored Glycine 0 N--CA 1.466 0.698 0 CA-C-O 119.392 -0.671 . . . . 116.27 112.758 -171.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 141' ' ' GLY . . . . . 0.409 ' HA2' ' HA2' ' C' ' 140' ' ' GLY . . . -162.1 -147.58 5.05 Favored Glycine 0 N--CA 1.471 1.023 0 CA-C-N 118.912 1.356 . . . . 103.93 111.589 2.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 142' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.23 155.05 38.71 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.945 0.402 . . . . 93.89 110.852 -176.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 143' ' ' GLY . . . . . . . . . . . . . . . -73.62 -24.14 75.32 Favored Glycine 0 N--CA 1.461 0.311 0 N-CA-C 109.342 -1.503 . . . . 93.8 109.342 172.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 144' ' ' MET . . . . . . . . . . . . . 1.9 ttt -77.6 -36.67 51.63 Favored 'General case' 0 N--CA 1.437 -1.097 0 C-N-CA 120.458 -0.497 . . . . 100.44 111.058 -175.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 145' ' ' LYS . . . . . . . . . . . . . . . -62.66 -45.49 92.58 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.048 -1.093 . . . . 86.62 108.048 172.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 146' ' ' GLN . . . . . . . . . . . . . . . -45.23 -52.23 9.75 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-N 116.195 -0.457 . . . . 90.84 110.432 176.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 147' ' ' LEU . . . . . . . . . . . . . 42.7 mt -65.99 -54.43 26.28 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.737 -0.665 . . . . 91.57 110.72 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 148' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -46.68 -50.71 17.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.239 -0.437 . . . . 92.99 110.341 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 149' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -64.49 -35.63 81.58 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 116.184 -0.462 . . . . 90.42 112.229 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 150' ' ' LYS . . . . . . . . . . . . . . . -69.8 -38.14 76.52 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 120.67 -0.412 . . . . 85.8 111.446 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 151' ' ' VAL . . . . . 0.616 HG12 HD12 ' C' ' 155' ' ' LEU . 60.3 t -62.26 -52.57 58.51 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 109.239 -0.652 . . . . 80.63 109.239 177.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 152' ' ' GLU . . . . . . . . . . . . . . . -45.61 -48.04 14.67 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.241 -0.89 . . . . 85.9 110.866 174.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 153' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -62.16 -48.44 80.09 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.714 -0.675 . . . . 91.48 111.603 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 154' ' ' LEU . . . . . . . . . . . . . 83.5 mt -67.45 -49.55 63.11 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 115.81 -0.632 . . . . 79.02 110.639 -177.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 155' ' ' LEU . . . . . 0.616 HD12 HG12 ' C' ' 151' ' ' VAL . 0.5 OUTLIER -45.1 -44.77 10.72 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.992 0.425 . . . . 87.3 110.057 176.516 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 156' ' ' SER . . . . . . . . . . . . . 2.2 t -72.8 -51.69 17.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.45 -0.795 . . . . 99.0 111.363 -173.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 157' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt -50.98 -37.16 43.06 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 123.484 0.49 . . . . 94.96 112.288 172.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 158' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -65.31 -59.09 4.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 113.573 0.953 . . . . 82.36 113.573 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 159' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -48.51 -51.08 29.06 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.231 -1.025 . . . . 127.26 108.231 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 160' ' ' HIS . . . . . . . . . . . . . . . -62.85 -37.71 87.91 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 112.285 0.476 . . . . 100.14 112.285 -177.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 161' ' ' LEU . . . . . . . . . . . . . 8.7 tp -65.1 -44.75 87.81 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.585 0.553 . . . . 89.74 110.809 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 162' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -57.01 -44.22 82.59 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.004 0.742 . . . . 91.51 113.004 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 163' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -61.11 -38.82 87.69 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.242 0.544 . . . . 115.74 111.376 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 164' ' ' GLU . . . . . 0.811 ' HA ' ' OE1' ' C' ' 164' ' ' GLU . 0.0 OUTLIER -60.16 -45.36 93.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.075 -0.966 . . . . 123.49 110.352 176.715 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 165' ' ' VAL . . . . . . . . . . . . . 76.1 t -58.15 -61.26 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 115.546 -0.752 . . . . 96.94 110.043 176.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 166' ' ' ALA . . . . . 0.484 ' O ' ' N ' ' C' ' 170' ' ' LYS . . . -49.27 -42.22 40.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.669 -0.241 . . . . 108.28 111.27 178.159 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 167' ' ' ARG . . . . . 0.584 ' NE ' ' OE1' ' C' ' 164' ' ' GLU . 51.2 ttp85 -60.24 -38.36 83.21 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 116.16 -0.473 . . . . 135.27 111.871 179.723 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 168' ' ' LEU . . . . . 0.437 ' HA ' HD12 ' C' ' 171' ' ' LEU . 22.5 mt -79.54 -34.99 40.59 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.103 -0.332 . . . . 118.68 110.103 172.702 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 169' ' ' LYS . . . . . . . . . . . . . . . -67.82 -24.38 65.28 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 116.298 -0.41 . . . . 111.23 110.81 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 170' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' C' ' 166' ' ' ALA . . . -74.23 -35.64 63.88 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.168 0.587 . . . . 129.64 111.655 174.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 171' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' C' ' 168' ' ' LEU . 5.4 mt -69.93 -34.14 73.07 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.291 0.848 . . . . 147.03 113.291 174.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.35 0 CA-C-O 120.681 0.277 . . . . 117.87 111.695 -179.156 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 99' ' ' HOH . . . . . 0.668 ' O ' ' SG ' ' B' ' 24' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' HOH . . . . . 0.453 ' O ' HG21 ' B' ' 70' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.062 0 N-CA-C 111.415 0.154 . . . . 95.38 111.415 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . . . -92.84 86.76 5.59 Favored 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 124.818 1.247 . . . . 81.96 112.393 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -76.06 151.04 37.2 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.312 1.045 . . . . 75.95 112.648 -170.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.69 123.59 33.28 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 114.322 1.23 . . . . 65.59 114.322 -171.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.42 113.35 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 115.841 -0.618 . . . . 65.84 109.657 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.0 mt -83.15 116.47 27.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.359 0 CA-C-N 116.469 -0.332 . . . . 55.64 111.636 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . . . -80.66 -44.42 18.83 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.626 -0.429 . . . . 61.33 110.606 178.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -151.27 146.23 25.9 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 116.658 -0.246 . . . . 53.08 110.848 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.13 141.46 21.5 Favored 'General case' 0 C--O 1.25 1.122 0 O-C-N 124.02 0.825 . . . . 52.19 112.505 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -134.71 87.88 2.39 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 103.429 -2.804 . . . . 54.83 103.429 164.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.3 ttt -170.07 160.74 8.31 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.127 -1.064 . . . . 54.89 108.127 -164.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.4 p -74.14 156.7 37.09 Favored 'General case' 0 C--O 1.209 -1.061 0 N-CA-C 108.968 -0.753 . . . . 59.17 108.968 175.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -64.19 -46.24 84.83 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.077 -0.511 . . . . 74.66 111.786 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -51.13 -61.25 2.35 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.234 -1.025 . . . . 71.73 108.234 175.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 13.2 mtt -51.71 -39.02 57.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.752 1.019 . . . . 55.4 113.752 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.461 ' HG2' HD12 ' A' ' 74' ' ' ILE . 63.6 mt-30 -61.56 -49.68 75.69 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 113.001 0.741 . . . . 53.83 113.001 178.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -60.13 -40.32 89.36 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.992 0.425 . . . . 67.61 110.068 173.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -65.65 -36.28 83.23 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 112.508 0.558 . . . . 57.35 112.508 -176.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.1 -52.79 64.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.192 0.52 . . . . 47.89 110.633 167.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 97.9 t -57.11 -34.45 45.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.299 -0.409 . . . . 55.55 111.858 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -68.0 -55.46 12.55 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 121.023 0.44 . . . . 61.84 110.009 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.493 ' SG ' ' CD ' ' A' ' 45' ' ' GLU . 1.2 m -47.41 -55.98 7.84 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.014 0.435 . . . . 51.45 109.931 178.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.85 -44.59 39.73 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.541 -1.281 . . . . 52.21 107.541 -176.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.5 m -64.6 -46.13 83.97 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.613 -0.721 . . . . 64.16 112.81 -178.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -58.64 -58.19 9.67 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.539 -0.541 . . . . 63.97 109.539 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.04 -45.76 8.13 Favored 'General case' 0 C--O 1.224 -0.265 0 O-C-N 123.756 0.66 . . . . 57.45 112.779 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 47.7 mtp -72.02 -19.48 61.85 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 115.099 1.518 . . . . 65.79 115.099 -178.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -74.6 -33.46 62.64 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 122.543 0.337 . . . . 73.86 111.23 171.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.513 ' HD3' ' CE2' ' A' ' 32' ' ' TYR . 27.9 tttt -82.25 -57.2 3.48 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.542 0.737 . . . . 70.78 111.685 -178.594 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.513 ' CE2' ' HD3' ' A' ' 31' ' ' LYS . 45.1 m-85 -111.15 137.46 48.81 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 112.99 0.737 . . . . 63.62 112.99 -171.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -83.69 -32.01 25.78 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.809 -0.632 . . . . 80.17 112.497 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 9.8 mt -84.59 129.63 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 122.928 0.491 . . . . 69.98 111.589 -173.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.424 ' HA ' HD12 ' A' ' 38' ' ' ILE . 2.3 mp0 -56.01 -51.6 67.18 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.584 0.957 . . . . 61.19 113.584 -175.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.498 ' HB2' ' HB2' ' C' ' 137' ' ' GLN . . . -40.41 -45.9 2.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.823 -0.626 . . . . 55.97 109.844 177.389 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -75.57 -36.53 60.36 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.685 1.365 . . . . 60.19 114.685 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.424 HD12 ' HA ' ' A' ' 35' ' ' GLU . 26.3 mt -61.19 -50.15 81.68 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 N-CA-C 107.232 -1.396 . . . . 54.12 107.232 172.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -47.72 -46.64 29.87 Favored 'General case' 0 C--O 1.215 -0.763 0 N-CA-C 114.421 1.267 . . . . 44.77 114.421 175.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.64 -46.84 65.26 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.923 -0.486 . . . . 45.44 110.402 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -46.77 -45.33 19.76 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 120.892 0.377 . . . . 56.89 111.561 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 20.9 mt -75.25 -54.85 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.114 -0.494 . . . . 43.69 111.927 -174.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -45.91 -44.59 14.76 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 109.624 -0.51 . . . . 42.12 109.624 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -65.72 -46.25 79.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.949 -0.569 . . . . 49.89 111.941 -175.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.493 ' CD ' ' SG ' ' A' ' 24' ' ' CYS . 1.5 tp10 -60.44 -44.12 96.12 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 124.507 1.129 . . . . 52.0 109.822 -177.937 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -71.6 -32.47 68.06 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.373 0.879 . . . . 46.67 113.373 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -59.7 -37.35 78.62 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.209 -0.663 . . . . 50.2 109.209 173.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -72.59 -52.21 16.45 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 112.612 0.597 . . . . 65.43 112.612 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -71.78 -47.04 56.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 57.88 110.45 -173.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.473 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 39.9 m-85 -114.63 18.16 16.84 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 114.33 1.233 . . . . 53.76 114.33 -167.485 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 89.9 m-20 71.62 145.5 0.11 Allowed Pre-proline 0 N--CA 1.474 0.766 0 N-CA-C 115.171 1.545 . . . . 61.26 115.171 -179.937 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -65.76 158.2 54.83 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 121.649 1.566 . . . . 52.42 112.841 173.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.8 m -125.11 111.29 15.15 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 124.443 1.097 . . . . 48.28 110.374 11.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 88.3 m95 -90.07 157.86 17.58 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.137 0.898 . . . . 44.37 112.234 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -134.29 156.52 48.29 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 107.771 -1.196 . . . . 41.61 107.771 174.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.467 ' C ' HD13 ' A' ' 57' ' ' ILE . 45.9 t -155.52 124.04 5.97 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 113.72 1.007 . . . . 39.74 113.72 -176.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.467 HD13 ' C ' ' A' ' 56' ' ' CYS . 6.7 mm -116.43 131.87 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 108.499 -0.926 . . . . 43.37 108.499 179.138 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.3 t -128.21 128.26 68.41 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 O-C-N 123.892 0.745 . . . . 48.4 109.473 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 176.5 -170.86 43.79 Favored Glycine 0 C--O 1.219 -0.828 0 C-N-CA 120.911 -0.662 . . . . 53.48 114.405 -179.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . . . -124.34 -30.76 3.37 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.997 0.74 . . . . 63.11 112.997 -173.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.665 ' HB3' ' HE ' ' B' ' 60' ' ' ARG . 2.0 m-80 -129.3 74.19 1.57 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.287 0.565 . . . . 74.72 110.701 -179.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -145.8 164.68 31.12 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.054 0.761 . . . . 57.11 113.054 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.08 160.06 23.98 Favored Glycine 0 C--O 1.218 -0.904 0 N-CA-C 108.19 -1.964 . . . . 54.05 108.19 174.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 84.7 p -150.18 159.26 44.56 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.603 0.964 . . . . 49.82 113.603 -177.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -139.26 124.38 18.93 Favored 'General case' 0 C--O 1.212 -0.909 0 CA-C-N 114.43 -1.259 . . . . 57.71 109.668 163.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 19.2 m -144.89 169.35 8.22 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.975 0 CA-C-O 121.563 0.697 . . . . 47.33 110.55 -168.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.9 m -125.9 128.64 47.88 Favored 'General case' 0 CA--C 1.488 -1.422 0 N-CA-C 106.888 -1.523 . . . . 51.22 106.888 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 31.3 p80 -126.32 166.84 16.4 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 114.121 1.156 . . . . 49.28 114.121 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -78.12 146.53 35.09 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 124.086 0.866 . . . . 56.06 108.683 173.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.6 m -49.24 134.7 17.89 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 114.451 -1.25 . . . . 61.11 109.27 173.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mmtm 62.55 27.64 16.33 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.817 1.647 . . . . 64.71 114.833 178.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -141.45 56.59 1.52 Allowed 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.729 -0.388 . . . . 52.56 110.295 -177.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -151.43 132.55 14.38 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 112.297 0.48 . . . . 44.15 112.297 178.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.461 HD12 ' HG2' ' A' ' 18' ' ' GLN . 17.9 tt -144.37 145.03 21.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.68 0.752 . . . . 45.37 112.695 173.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -139.75 115.13 9.88 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.418 -1.327 . . . . 50.64 107.418 177.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -151.04 158.63 44.35 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.592 0.558 . . . . 48.35 111.794 -172.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -105.62 131.35 53.11 Favored 'General case' 0 C--O 1.24 0.587 0 O-C-N 123.869 0.731 . . . . 58.11 111.579 176.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.38 102.42 11.06 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 103.835 -2.654 . . . . 59.61 103.835 169.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.65 -139.76 32.22 Favored Glycine 0 CA--C 1.525 0.712 0 O-C-N 123.802 0.689 . . . . 66.23 111.932 -167.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . . . -87.46 13.47 9.98 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 115.48 -0.36 . . . . 71.88 111.936 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.0 t -110.66 126.39 67.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 121.731 0.777 . . . . 60.48 111.383 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.96 145.54 26.48 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.179 -0.919 . . . . 52.3 111.301 -179.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.4 mt -137.56 114.71 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.512 0.725 . . . . 47.29 111.252 -176.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.6 tp -105.91 129.66 54.02 Favored 'General case' 0 CA--C 1.502 -0.87 0 O-C-N 123.672 0.608 . . . . 40.93 109.362 177.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.0 tp -143.97 131.43 21.01 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 107.697 -1.223 . . . . 39.79 107.697 -176.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 31.9 p90 -167.82 165.91 13.79 Favored 'General case' 0 C--O 1.201 -1.492 0 N-CA-C 113.932 1.086 . . . . 40.13 113.932 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 52.7 tttt -110.0 131.13 55.34 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-O 121.649 0.738 . . . . 51.16 112.693 -176.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.7 t -158.19 123.98 4.57 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.837 -1.172 . . . . 47.86 107.837 168.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.406 ' HA2' ' O ' ' B' ' 89' ' ' GLY . . . . . . . . 0 CA--C 1.558 2.778 0 O-C-N 124.118 0.886 . . . . 57.34 114.139 -151.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.974 0 N-CA-C 113.924 1.083 . . . . 130.79 113.924 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . . . -152.04 54.5 0.82 Allowed 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 112.956 0.725 . . . . 114.06 112.956 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . . . -74.01 150.41 40.71 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.038 0.447 . . . . 108.89 111.796 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.69 122.56 31.51 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.387 0.884 . . . . 94.16 113.387 -173.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 41.9 t -124.24 114.93 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.329 -0.989 . . . . 90.3 108.329 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ILE . . . . . . . . . . . . . 59.4 mt -82.29 119.98 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 123.28 0.362 . . . . 75.54 110.37 174.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . . . -82.77 -44.72 15.23 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.729 -0.388 . . . . 66.79 111.784 176.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -153.25 143.59 22.43 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.394 0.678 . . . . 60.82 112.483 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.1 139.7 19.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 62.51 112.057 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -133.96 88.45 2.47 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 104.085 -2.561 . . . . 63.22 104.085 165.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 4.0 ttt -168.76 160.72 10.7 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.035 -1.098 . . . . 70.77 108.035 -164.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 23.1 p -73.23 157.98 36.07 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.56 -0.856 . . . . 77.55 108.749 173.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -65.47 -42.11 92.6 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.747 1.017 . . . . 100.97 113.747 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -53.6 -60.95 2.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.965 -0.561 . . . . 96.58 110.323 173.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' MET . . . . . . . . . . . . . 15.7 mtt -49.2 -44.17 42.98 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.766 0.654 . . . . 75.73 112.766 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.474 ' HG2' HD12 ' B' ' 74' ' ' ILE . 64.2 mt-30 -58.78 -49.72 76.63 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 112.96 0.726 . . . . 72.49 112.96 -178.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . . . -58.94 -40.17 83.84 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.857 -0.794 . . . . 85.68 108.857 174.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -66.54 -37.0 84.04 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.165 0.507 . . . . 80.8 111.356 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.0 -55.6 33.12 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.949 -0.76 . . . . 68.23 108.949 168.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 89.8 t -55.09 -31.67 26.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.611 0.597 . . . . 81.35 112.611 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -70.54 -52.31 22.66 Favored 'General case' 0 C--O 1.248 1.001 0 CA-C-O 121.187 0.518 . . . . 90.93 110.764 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.668 ' SG ' ' O ' ' B' ' 99' ' ' HOH . 1.5 m -50.11 -54.06 23.17 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 115.598 -0.728 . . . . 74.8 110.551 177.175 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.98 -44.01 50.63 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.957 0.785 . . . . 75.62 110.062 -179.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 86.1 m -65.46 -47.43 76.13 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.258 -0.883 . . . . 95.25 110.055 -178.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -58.54 -56.56 20.59 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 121.372 0.606 . . . . 91.76 110.045 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.6 -43.17 11.98 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 114.952 -1.022 . . . . 81.7 112.965 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 60.2 mtp -76.22 -16.8 59.75 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.319 0.859 . . . . 94.83 113.319 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -75.17 -32.41 61.25 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 121.092 -0.243 . . . . 107.61 111.073 170.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.492 ' HB3' ' CD2' ' B' ' 32' ' ' TYR . . . -84.05 -57.16 3.3 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.811 -0.631 . . . . 97.38 111.171 -177.548 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.492 ' CD2' ' HB3' ' B' ' 31' ' ' LYS . 42.9 m-85 -111.77 133.54 53.92 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.148 1.166 . . . . 88.2 114.148 -170.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . . . -79.67 -33.1 41.46 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.677 -0.692 . . . . 97.4 111.341 170.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 14.5 mm -84.49 131.43 34.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.534 0.683 . . . . 89.38 112.036 -172.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.603 ' HA ' HD12 ' B' ' 38' ' ' ILE . 2.2 mp0 -57.12 -51.32 69.75 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 121.932 -0.48 . . . . 75.75 112.091 -174.251 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.43 ' O ' ' HB3' ' B' ' 39' ' ' ALA . 32.9 tttm -38.7 -50.4 1.64 Allowed 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 108.511 -0.922 . . . . 67.22 108.511 178.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -71.88 -36.6 70.12 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 114.249 1.203 . . . . 77.46 114.249 -177.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.603 HD12 ' HA ' ' B' ' 35' ' ' GLU . 22.2 mt -62.29 -48.85 86.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 106.689 -1.597 . . . . 72.76 106.689 175.011 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' B' ' 36' ' ' LYS . . . -48.39 -47.15 37.76 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.656 -1.156 . . . . 58.88 113.506 175.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -44.11 78.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.319 0.58 . . . . 58.52 111.767 -179.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -50.58 -44.03 56.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.449 0.643 . . . . 80.12 111.51 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 21.5 mt -76.2 -55.85 10.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 114.954 -1.021 . . . . 60.39 110.818 -173.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -43.84 -46.96 8.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.542 0.687 . . . . 53.94 110.428 177.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -64.99 -46.09 82.87 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 115.182 -0.917 . . . . 63.5 109.612 -174.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -63.31 -43.52 97.58 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 119.826 -0.75 . . . . 78.94 110.531 -175.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -69.38 -32.14 70.98 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 120.196 -0.602 . . . . 61.65 112.509 178.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -57.79 -40.66 80.39 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.168 -0.678 . . . . 63.41 109.168 174.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 33.1 tttt -69.2 -54.78 13.06 Favored 'General case' 0 C--O 1.243 0.73 0 N-CA-C 113.149 0.796 . . . . 83.91 113.149 -177.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . . . -71.63 -44.56 64.15 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.023 0.827 . . . . 73.64 111.115 -173.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.472 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 41.2 m-85 -114.44 16.04 17.81 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 116.347 1.98 . . . . 72.54 116.347 -170.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 91.0 m-20 72.78 144.9 0.11 Allowed Pre-proline 0 C--N 1.321 -0.67 0 N-CA-C 114.312 1.227 . . . . 74.22 114.312 179.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -68.34 158.85 55.81 Favored 'Trans proline' 0 CA--C 1.514 -0.505 0 C-N-CA 121.485 1.457 . . . . 63.07 111.902 176.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 5.7 m -123.46 112.31 17.36 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 124.478 1.111 . . . . 55.17 112.781 11.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' TRP . . . . . . . . . . . . . 85.2 m95 -89.38 158.13 17.89 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.497 0.665 . . . . 55.63 112.773 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -135.33 154.27 51.57 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 107.504 -1.295 . . . . 45.25 107.504 173.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.456 ' C ' HD13 ' B' ' 57' ' ' ILE . 43.8 t -153.47 127.01 8.68 Favored 'General case' 0 CA--C 1.496 -1.118 0 N-CA-C 113.447 0.906 . . . . 51.19 113.447 -177.01 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.456 HD13 ' C ' ' B' ' 56' ' ' CYS . 7.4 mm -118.85 131.08 72.67 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.775 0 N-CA-C 107.801 -1.185 . . . . 50.14 107.801 179.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 41.8 t -128.4 125.73 64.43 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 O-C-N 123.915 0.759 . . . . 61.36 110.048 -176.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 178.58 -169.1 40.53 Favored Glycine 0 N--CA 1.464 0.525 0 N-CA-C 115.596 0.998 . . . . 63.85 115.596 -177.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.665 ' HE ' ' HB3' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -127.51 -28.83 2.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.12 1.156 . . . . 95.5 114.12 -172.136 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -133.5 73.68 1.52 Allowed 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 120.636 0.255 . . . . 78.35 110.804 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.428 ' O ' HG23 ' C' ' 138' ' ' THR . 27.9 p90 -144.56 164.83 29.76 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.665 -0.698 . . . . 58.99 112.039 175.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -136.11 160.92 24.81 Favored Glycine 0 N--CA 1.474 1.181 0 N-CA-C 108.674 -1.77 . . . . 51.58 108.674 174.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' SER . . . . . 0.4 ' CB ' HD12 ' A' ' 57' ' ' ILE . 99.8 p -149.47 159.78 44.01 Favored 'General case' 0 C--O 1.244 0.785 0 N-CA-C 112.86 0.689 . . . . 45.82 112.86 -175.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -138.77 124.84 20.06 Favored 'General case' 0 C--O 1.213 -0.834 0 CA-C-N 114.543 -1.208 . . . . 48.97 108.483 161.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -141.74 168.75 14.79 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.016 0 N-CA-C 112.688 0.625 . . . . 44.01 112.688 -171.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 19.5 m -123.51 127.94 49.06 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 109.534 -0.543 . . . . 48.95 109.534 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 33.4 p80 -127.47 165.13 20.42 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.059 -1.056 . . . . 52.2 113.762 -178.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -72.15 147.63 46.45 Favored 'General case' 0 C--O 1.247 0.937 0 CA-C-N 114.479 -1.237 . . . . 70.49 108.853 173.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' THR . . . . . 0.453 HG21 ' O ' ' B' ' 100' ' ' HOH . 1.7 m -54.48 132.87 45.48 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 114.887 -1.051 . . . . 69.54 110.944 171.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 29.1 mmtm 62.41 32.85 16.64 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.875 1.27 . . . . 76.79 114.372 179.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -144.83 57.55 1.28 Allowed 'General case' 0 C--O 1.225 -0.21 0 O-C-N 123.653 0.595 . . . . 63.56 111.197 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -153.51 132.88 12.8 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 112.595 0.591 . . . . 54.51 112.595 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.474 HD12 ' HG2' ' B' ' 18' ' ' GLN . 19.4 tt -145.3 142.96 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 121.764 0.792 . . . . 61.65 112.813 175.734 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -138.46 113.55 9.32 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 106.617 -1.623 . . . . 58.47 106.617 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -151.69 155.84 39.13 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 113.065 0.765 . . . . 66.71 113.065 -172.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -102.71 132.88 48.55 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.657 0.598 . . . . 77.18 109.589 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.41 102.85 10.71 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 104.92 -2.252 . . . . 83.21 104.92 167.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.67 -142.53 38.67 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 111.276 -0.729 . . . . 91.93 111.276 -167.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . . . -86.94 16.75 4.61 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.25 0.463 . . . . 93.25 112.25 178.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 2.6 t -115.17 124.76 72.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.384 0.674 . . . . 79.42 110.744 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.33 146.5 26.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.256 -0.884 . . . . 66.07 111.031 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 24.1 mt -137.32 114.08 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 123.8 0.84 . . . . 64.73 111.406 -175.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 39.2 tp -105.08 132.95 50.65 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 108.908 -0.775 . . . . 50.3 108.908 175.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 45.5 tp -148.05 133.32 18.45 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 107.528 -1.286 . . . . 53.31 107.528 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 32.7 p90 -169.83 164.96 9.87 Favored 'General case' 0 C--O 1.203 -1.38 0 N-CA-C 113.768 1.025 . . . . 46.19 113.768 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 45.6 tttt -109.85 131.63 54.89 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.351 0.5 . . . . 60.88 112.351 -176.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 30.7 t -161.8 121.63 2.51 Favored 'General case' 0 C--O 1.252 1.223 0 N-CA-C 109.112 -0.699 . . . . 50.94 109.112 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLY . . . . . 0.406 ' O ' ' HA2' ' A' ' 89' ' ' GLY . . . . . . . . 0 N--CA 1.493 2.44 0 N-CA-C 115.589 0.995 . . . . 61.88 115.589 -169.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 130' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.963 0 N-CA-C 111.841 -0.504 . . . . 86.63 111.841 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -148.43 113.2 5.4 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 117.117 0.458 . . . . 78.18 111.162 -173.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 132' ' ' VAL . . . . . . . . . . . . . 77.5 t -128.94 117.41 44.19 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.456 0 CA-C-N 115.284 -0.871 . . . . 64.47 109.056 -171.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 133' ' ' SER . . . . . . . . . . . . . 9.9 m -97.61 132.27 43.43 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 118.533 -0.746 . . . . 62.91 109.884 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 134' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -162.77 161.58 26.27 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 113.681 0.993 . . . . 53.79 113.681 -179.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 135' ' ' GLY . . . . . . . . . . . . . . . -121.48 166.22 14.36 Favored Glycine 0 N--CA 1.472 1.055 0 N-CA-C 116.294 1.278 . . . . 52.39 116.294 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 136' ' ' THR . . . . . . . . . . . . . 30.5 p -131.53 157.8 42.61 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.489 0.716 . . . . 56.43 110.44 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 137' ' ' GLN . . . . . . . . . . . . . 66.6 tp60 -149.49 135.58 18.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.91 -0.586 . . . . 66.31 110.477 171.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 138' ' ' THR . . . . . . . . . . . . . 68.3 p -77.89 158.56 29.36 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.689 -0.687 . . . . 71.36 111.053 176.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 139' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -130.28 25.69 5.16 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 112.517 0.562 . . . . 89.66 112.517 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 140' ' ' GLY . . . . . . . . . . . . . . . -65.82 161.1 43.98 Favored Glycine 0 N--CA 1.462 0.405 0 N-CA-C 112.228 -0.349 . . . . 136.55 112.228 -177.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 141' ' ' GLY . . . . . . . . . . . . . . . 125.52 -24.28 5.87 Favored Glycine 0 N--CA 1.463 0.457 0 CA-C-O 120.111 -0.272 . . . . 114.83 112.988 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 142' ' ' SER . . . . . . . . . . . . . 7.2 m -74.55 128.2 34.97 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 113.418 0.896 . . . . 115.21 113.418 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 143' ' ' GLY . . . . . . . . . . . . . . . 98.4 15.97 33.5 Favored Glycine 0 N--CA 1.473 1.109 0 N-CA-C 114.328 0.491 . . . . 95.15 114.328 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 144' ' ' MET . . . . . . . . . . . . . 5.2 ttt -80.14 -43.64 21.28 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.385 0.674 . . . . 90.2 111.112 -176.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 145' ' ' LYS . . . . . . . . . . . . . . . -60.47 -42.63 96.62 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.224 -0.658 . . . . 76.87 109.224 175.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 146' ' ' GLN . . . . . . . . . . . . . . . -47.01 -49.85 20.27 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 116.146 -0.479 . . . . 83.5 111.584 173.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 147' ' ' LEU . . . . . . . . . . . . . 39.2 mt -68.95 -53.13 22.48 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.808 -0.633 . . . . 82.96 110.751 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 148' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -49.11 -47.14 45.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.801 0.334 . . . . 75.58 111.644 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 149' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -66.75 -33.05 74.77 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.945 0.72 . . . . 70.3 112.945 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 150' ' ' LYS . . . . . . . . . . . . . . . -72.69 -37.93 67.71 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.621 0.23 . . . . 69.09 111.621 178.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 151' ' ' VAL . . . . . 0.525 HG12 HD12 ' D' ' 155' ' ' LEU . 76.9 t -60.69 -55.41 24.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 122.082 0.944 . . . . 63.29 111.805 174.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 152' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -43.2 -48.54 6.54 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.276 -0.875 . . . . 67.08 111.631 170.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 153' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -61.34 -50.68 71.96 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.525 -0.917 . . . . 70.75 108.525 -177.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 154' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.96 -51.87 54.64 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 116.049 -0.523 . . . . 66.28 110.536 -174.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 155' ' ' LEU . . . . . 0.525 HD12 HG12 ' D' ' 151' ' ' VAL . 1.2 mt -40.52 -47.95 2.75 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.33 0.586 . . . . 55.53 112.259 172.946 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 156' ' ' SER . . . . . . . . . . . . . 4.7 t -71.82 -52.58 16.77 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.911 -0.586 . . . . 55.92 110.995 -175.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 157' ' ' LYS . . . . . . . . . . . . . . . -49.81 -39.66 39.3 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 109.592 -0.522 . . . . 63.57 109.592 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 158' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -63.35 -60.1 3.83 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.813 1.245 . . . . 63.33 112.952 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 159' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -48.43 -49.81 33.72 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.898 -0.779 . . . . 64.21 108.898 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 160' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -63.7 -36.34 83.54 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.298 0.851 . . . . 65.45 113.298 -178.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 161' ' ' LEU . . . . . . . . . . . . . 10.1 mt -65.79 -46.13 79.86 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.6 -0.518 . . . . 72.08 109.6 175.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 162' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -53.59 -46.84 70.49 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.38 0.511 . . . . 69.8 112.38 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 163' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -60.05 -39.65 86.68 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.137 0.494 . . . . 73.94 111.721 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 164' ' ' GLU . . . . . 0.685 ' HA ' ' OE1' ' D' ' 164' ' ' GLU . 0.0 OUTLIER -58.8 -44.92 90.91 Favored 'General case' 0 CA--C 1.562 1.441 0 CA-C-O 121.976 0.893 . . . . 90.42 110.885 176.009 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 165' ' ' VAL . . . . . . . . . . . . . 88.7 t -58.08 -60.04 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.548 -0.751 . . . . 87.07 110.636 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 166' ' ' ALA . . . . . . . . . . . . . . . -48.64 -43.58 36.65 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-N 115.909 -0.587 . . . . 87.22 110.691 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 167' ' ' ARG . . . . . 0.47 ' NE ' ' OE1' ' D' ' 164' ' ' GLU . 47.9 ttp85 -63.23 -41.05 99.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.111 -0.949 . . . . 102.25 112.103 -179.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 168' ' ' LEU . . . . . . . . . . . . . 67.1 mt -79.36 -38.18 35.66 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 113.425 0.898 . . . . 108.72 113.425 -178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 169' ' ' LYS . . . . . . . . . . . . . . . -54.06 -42.23 69.04 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 122.67 0.388 . . . . 110.87 111.216 173.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 170' ' ' LYS . . . . . . . . . . . . . . . -56.92 -39.46 74.53 Favored 'General case' 0 C--O 1.239 0.501 0 O-C-N 123.515 0.509 . . . . 115.95 111.327 175.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 171' ' ' LEU . . . . . . . . . . . . . . . -67.76 -53.88 23.69 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 116.148 -0.478 . . . . 131.3 111.775 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 172' ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.478 0.928 0 CA-C-N 116.488 -0.324 . . . . 139.94 110.579 -178.727 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 131' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 110.706 -0.109 . . . . 89.94 110.706 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 132' ' ' VAL . . . . . . . . . . . . . 78.4 t -133.49 113.74 19.42 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.828 0 C-N-CA 123.569 0.748 . . . . 77.1 109.867 -170.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 133' ' ' SER . . . . . . . . . . . . . 9.9 m -93.69 132.75 37.73 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.097 -0.705 . . . . 58.82 109.097 -179.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 134' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -160.72 162.92 32.66 Favored 'General case' 0 C--O 1.209 -1.067 0 N-CA-C 114.355 1.243 . . . . 69.33 114.355 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 135' ' ' GLY . . . . . . . . . . . . . . . -122.69 167.25 15.05 Favored Glycine 0 C--O 1.22 -0.762 0 N-CA-C 116.934 1.533 . . . . 53.24 116.934 177.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 136' ' ' THR . . . . . . . . . . . . . 27.0 p -131.8 158.2 41.88 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.972 0.909 . . . . 55.49 109.962 175.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 137' ' ' GLN . . . . . 0.498 ' HB2' ' HB2' ' A' ' 36' ' ' LYS . 66.6 tp60 -149.01 134.26 18.34 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.639 -0.71 . . . . 71.25 111.139 169.489 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 138' ' ' THR . . . . . 0.428 HG23 ' O ' ' B' ' 62' ' ' PHE . 71.8 p -75.56 153.94 37.09 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.545 -0.752 . . . . 83.25 111.812 177.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 139' ' ' GLU . . . . . . . . . . . . . . . -59.04 104.18 0.22 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.873 -0.603 . . . . 105.1 109.63 -179.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 140' ' ' GLY . . . . . 0.409 ' HA2' ' HA2' ' C' ' 141' ' ' GLY . . . -61.38 132.58 47.97 Favored Glycine 0 N--CA 1.466 0.698 0 CA-C-O 119.392 -0.671 . . . . 116.27 112.758 -171.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 141' ' ' GLY . . . . . 0.409 ' HA2' ' HA2' ' C' ' 140' ' ' GLY . . . -162.1 -147.58 5.05 Favored Glycine 0 N--CA 1.471 1.023 0 CA-C-N 118.912 1.356 . . . . 103.93 111.589 2.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 142' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.23 155.05 38.71 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.945 0.402 . . . . 93.89 110.852 -176.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 143' ' ' GLY . . . . . . . . . . . . . . . -73.62 -24.14 75.32 Favored Glycine 0 N--CA 1.461 0.311 0 N-CA-C 109.342 -1.503 . . . . 93.8 109.342 172.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 144' ' ' MET . . . . . . . . . . . . . 1.9 ttt -77.6 -36.67 51.63 Favored 'General case' 0 N--CA 1.437 -1.097 0 C-N-CA 120.458 -0.497 . . . . 100.44 111.058 -175.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 145' ' ' LYS . . . . . . . . . . . . . . . -62.66 -45.49 92.58 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.048 -1.093 . . . . 86.62 108.048 172.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 146' ' ' GLN . . . . . . . . . . . . . . . -45.23 -52.23 9.75 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-N 116.195 -0.457 . . . . 90.84 110.432 176.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 147' ' ' LEU . . . . . . . . . . . . . 42.7 mt -65.99 -54.43 26.28 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.737 -0.665 . . . . 91.57 110.72 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 148' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -46.68 -50.71 17.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.239 -0.437 . . . . 92.99 110.341 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 149' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -64.49 -35.63 81.58 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 116.184 -0.462 . . . . 90.42 112.229 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 150' ' ' LYS . . . . . . . . . . . . . . . -69.8 -38.14 76.52 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 120.67 -0.412 . . . . 85.8 111.446 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 151' ' ' VAL . . . . . 0.616 HG12 HD12 ' C' ' 155' ' ' LEU . 60.3 t -62.26 -52.57 58.51 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 109.239 -0.652 . . . . 80.63 109.239 177.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 152' ' ' GLU . . . . . . . . . . . . . . . -45.61 -48.04 14.67 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.241 -0.89 . . . . 85.9 110.866 174.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 153' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -62.16 -48.44 80.09 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.714 -0.675 . . . . 91.48 111.603 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 154' ' ' LEU . . . . . . . . . . . . . 83.5 mt -67.45 -49.55 63.11 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 115.81 -0.632 . . . . 79.02 110.639 -177.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 155' ' ' LEU . . . . . 0.616 HD12 HG12 ' C' ' 151' ' ' VAL . 0.5 OUTLIER -45.1 -44.77 10.72 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.992 0.425 . . . . 87.3 110.057 176.516 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 156' ' ' SER . . . . . . . . . . . . . 2.2 t -72.8 -51.69 17.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.45 -0.795 . . . . 99.0 111.363 -173.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 157' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt -50.98 -37.16 43.06 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 123.484 0.49 . . . . 94.96 112.288 172.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 158' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -65.31 -59.09 4.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 113.573 0.953 . . . . 82.36 113.573 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 159' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -48.51 -51.08 29.06 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.231 -1.025 . . . . 127.26 108.231 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 160' ' ' HIS . . . . . . . . . . . . . . . -62.85 -37.71 87.91 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 112.285 0.476 . . . . 100.14 112.285 -177.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 161' ' ' LEU . . . . . . . . . . . . . 8.7 tp -65.1 -44.75 87.81 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.585 0.553 . . . . 89.74 110.809 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 162' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -57.01 -44.22 82.59 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.004 0.742 . . . . 91.51 113.004 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 163' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -61.11 -38.82 87.69 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.242 0.544 . . . . 115.74 111.376 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 164' ' ' GLU . . . . . 0.811 ' HA ' ' OE1' ' C' ' 164' ' ' GLU . 0.0 OUTLIER -60.16 -45.36 93.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.075 -0.966 . . . . 123.49 110.352 176.715 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 165' ' ' VAL . . . . . . . . . . . . . 76.1 t -58.15 -61.26 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 115.546 -0.752 . . . . 96.94 110.043 176.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 166' ' ' ALA . . . . . 0.484 ' O ' ' N ' ' C' ' 170' ' ' LYS . . . -49.27 -42.22 40.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.669 -0.241 . . . . 108.28 111.27 178.159 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 167' ' ' ARG . . . . . 0.584 ' NE ' ' OE1' ' C' ' 164' ' ' GLU . 51.2 ttp85 -60.24 -38.36 83.21 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 116.16 -0.473 . . . . 135.27 111.871 179.723 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 168' ' ' LEU . . . . . 0.437 ' HA ' HD12 ' C' ' 171' ' ' LEU . 22.5 mt -79.54 -34.99 40.59 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.103 -0.332 . . . . 118.68 110.103 172.702 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 169' ' ' LYS . . . . . . . . . . . . . . . -67.82 -24.38 65.28 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 116.298 -0.41 . . . . 111.23 110.81 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 170' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' C' ' 166' ' ' ALA . . . -74.23 -35.64 63.88 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.168 0.587 . . . . 129.64 111.655 174.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 171' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' C' ' 168' ' ' LEU . 5.4 mt -69.93 -34.14 73.07 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.291 0.848 . . . . 147.03 113.291 174.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 172' ' ' VAL . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.35 0 CA-C-O 120.681 0.277 . . . . 117.87 111.695 -179.156 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' HOH . . . . . 0.668 ' O ' ' SG ' ' B' ' 24' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' HOH . . . . . 0.453 ' O ' HG21 ' B' ' 70' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_