data_5zr6_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5zr6 _Structure_validation_residue.Date_analyzed 2019-03-15 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.988 0.423 . . . . 68.11 110.371 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.32 -37.8 86.99 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.711 -0.677 . . . . 67.09 111.836 -170.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -65.39 -29.62 70.35 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.445 -0.502 . . . . 61.29 111.848 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.63 -34.0 74.91 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.625 -0.43 . . . . 44.69 111.572 179.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -66.64 -48.51 69.22 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.673 -0.411 . . . . 64.75 111.627 -176.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.14 -42.34 99.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.257 -0.977 . . . . 47.46 110.939 -177.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -63.29 -39.65 95.17 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.157 -0.617 . . . . 33.77 110.916 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 t -69.69 -42.49 80.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.517 -0.473 . . . . 37.41 110.663 -178.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 35.0 mm -58.97 -43.23 88.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 C-N-CA 120.087 -0.645 . . . . 49.14 109.755 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 68.7 t90 -69.34 -40.79 77.33 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.602 -0.439 . . . . 37.58 111.501 -176.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.8 p -66.86 -32.28 73.44 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.985 -0.686 . . . . 39.02 111.574 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.05 -39.01 89.79 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.323 -0.551 . . . . 53.06 111.11 176.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLN . . . . . 0.465 ' NE2' ' O ' ' A' ' 403' ' ' HOH . 8.4 mt-30 -80.83 2.58 25.79 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.154 0.798 . . . . 69.36 113.154 177.684 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -77.4 -38.64 49.37 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 118.592 0.633 . . . . 43.52 111.888 -173.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -122.38 15.67 10.49 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.248 0.462 . . . . 53.04 112.248 -178.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.2 m -157.24 160.31 38.53 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.891 -0.781 . . . . 66.33 108.891 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -131.81 67.19 1.53 Allowed 'General case' 0 C--O 1.233 0.211 0 N-CA-C 108.355 -0.98 . . . . 82.33 108.355 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 0.4 OUTLIER -112.51 -121.5 0.29 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.978 -0.556 . . . . 77.61 109.553 179.545 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.7 mttp -141.48 146.29 36.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.655 -1.239 . . . . 76.47 107.655 176.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.3 p -111.44 87.62 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.368 0 C-N-CA 118.273 -1.371 . . . . 105.87 108.397 175.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 p -66.47 160.02 25.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.858 0.837 . . . . 117.79 110.217 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -62.94 -25.82 68.53 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.357 -0.838 . . . . 122.06 111.421 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -73.63 -31.82 63.73 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.306 -0.558 . . . . 116.29 111.93 173.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 40.5 mtt -65.73 -42.26 91.26 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.478 -0.889 . . . . 117.65 110.889 173.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.8 mt -58.75 -49.29 78.16 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.744 0.307 . . . . 99.71 111.65 175.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.91 -47.32 86.26 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 120.781 0.324 . . . . 102.04 111.576 -170.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -73.12 -23.01 60.44 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.889 0.7 . . . . 115.14 112.889 -173.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -94.92 -37.09 11.34 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 118.801 0.728 . . . . 104.94 112.769 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.9 mt -67.33 -30.54 49.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 C-N-CA 120.281 -0.567 . . . . 100.05 110.148 173.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 106.18 14.12 21.33 Favored Glycine 0 N--CA 1.446 -0.633 0 N-CA-C 116.169 1.228 . . . . 100.49 116.169 172.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 16.4 m -125.7 164.71 24.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 118.823 1.312 . . . . 104.03 108.978 -179.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.8 p -64.05 150.4 45.47 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.143 -0.935 . . . . 96.85 110.938 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.82 -16.42 64.27 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.599 -0.728 . . . . 102.66 112.281 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.8 m -62.62 -44.92 95.07 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.7 -0.4 . . . . 83.41 110.913 176.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.8 p -87.1 -24.75 24.45 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.091 0.775 . . . . 79.26 113.091 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.47 -40.7 96.18 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.318 -0.553 . . . . 75.55 111.071 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.2 t -63.39 -43.96 96.1 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.452 -0.499 . . . . 84.07 110.991 174.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -64.89 -29.26 70.19 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.599 -0.44 . . . . 84.59 111.166 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.3 t -74.07 -59.44 2.72 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.752 -0.379 . . . . 74.6 111.058 177.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.7 tp -56.56 -25.96 22.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-O 120.671 0.272 . . . . 80.79 110.983 -176.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -63.17 -36.18 82.77 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 121.999 -0.438 . . . . 104.78 111.472 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -68.63 -46.52 69.0 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.88 -0.328 . . . . 78.85 111.451 -176.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.7 mp -66.56 -27.63 67.89 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.563 -0.455 . . . . 68.22 111.936 -174.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.86 -31.37 70.27 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.046 -0.662 . . . . 84.07 111.385 174.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -69.98 -30.38 67.71 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.662 -0.415 . . . . 104.02 111.578 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -79.96 1.92 25.55 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.954 0.724 . . . . 87.43 112.954 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . 0.507 ' O ' ' OG ' ' A' ' 74' ' ' SER . . . 75.0 31.64 57.61 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.873 -0.68 . . . . 79.52 114.236 -178.449 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 51.0 mt -109.94 -32.88 6.88 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 113.879 1.066 . . . . 70.58 113.879 -177.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 35.2 m -136.59 -176.59 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 108.715 -0.846 . . . . 86.23 108.715 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -157.77 141.89 15.99 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.618 -0.882 . . . . 97.25 108.618 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 O-C-N 123.484 0.49 . . . . 106.23 112.074 176.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 404' ' ' HOH . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 113.726 0.251 . . . . 102.74 113.726 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -91.31 151.48 20.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.201 0.524 . . . . 100.33 110.846 -178.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 10.1 t -113.91 141.73 28.99 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 109.052 -0.721 . . . . 88.34 109.052 -177.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 t -139.43 162.69 34.43 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.321 -0.622 . . . . 75.22 109.321 179.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.6 mp -91.34 138.76 31.33 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.667 -0.697 . . . . 68.34 110.069 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.7 p -84.0 -171.12 3.43 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.275 -1.009 . . . . 69.35 108.275 167.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -78.09 -31.31 50.03 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.654 -0.818 . . . . 81.55 111.734 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . 0.507 ' OG ' ' O ' ' A' ' 59' ' ' GLY . 3.3 p -74.44 -25.79 59.65 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.094 -0.642 . . . . 65.98 111.195 173.887 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.31 -30.86 48.66 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.435 -0.888 . . . . 58.05 113.149 175.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.4 ttm-85 -66.25 -51.06 61.22 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 117.445 0.623 . . . . 53.47 111.053 178.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.8 mtm-85 -66.05 -24.84 66.81 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.276 -0.57 . . . . 73.99 111.817 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.67 -41.04 27.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.224 -0.59 . . . . 48.07 111.353 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.91 -39.43 83.57 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.319 -0.553 . . . . 44.82 111.18 177.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 87.8 mt -61.01 -31.54 71.16 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.221 -0.592 . . . . 44.7 111.316 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.91 -47.11 72.76 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.492 -0.483 . . . . 36.0 110.815 174.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 28.1 mmt -61.9 -42.59 99.26 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.752 -0.379 . . . . 41.93 111.313 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.12 -39.21 83.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 120.963 0.411 . . . . 25.79 110.36 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 62.6 ttt-85 -64.59 -43.6 93.31 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.385 -0.526 . . . . 40.38 111.421 -178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 3.2 mtm-85 -65.58 -47.16 76.7 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.357 -0.537 . . . . 62.03 111.091 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -55.56 -45.18 77.32 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.824 0.345 . . . . 43.29 111.502 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -82.75 -31.74 28.21 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.268 -0.573 . . . . 32.06 112.446 -170.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 22.6 mt -69.26 -30.2 68.27 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.788 -0.765 . . . . 25.58 111.327 171.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 29.2 mt -70.82 -43.91 67.64 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.38 -0.528 . . . . 20.09 111.277 177.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -53.74 -45.78 70.67 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.02 0.438 . . . . 25.02 110.804 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.4 m -64.91 -39.13 93.04 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.956 -0.298 . . . . 20.83 111.479 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -69.93 -34.02 72.91 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.022 -0.671 . . . . 21.38 111.638 -178.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.56 -29.62 69.73 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.408 -0.517 . . . . 17.74 111.983 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 43.2 t -85.05 -46.71 17.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.665 -0.414 . . . . 26.52 110.868 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -84.36 -11.88 55.51 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 113.686 0.995 . . . . 27.36 113.686 -168.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -129.46 -30.9 2.08 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.893 0.77 . . . . 46.32 112.395 -177.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 63.1 mt -107.23 -7.41 16.78 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 114.023 1.12 . . . . 32.93 114.023 -175.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.52 20.83 53.45 Favored Glycine 0 N--CA 1.449 -0.47 0 N-CA-C 116.127 1.211 . . . . 29.59 116.127 172.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -69.86 158.44 35.52 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.645 1.223 . . . . 27.87 110.685 172.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 24.5 mtt85 -94.17 168.25 11.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.335 -0.848 . . . . 58.36 108.98 164.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -75.38 -9.05 58.22 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.265 -0.974 . . . . 34.93 113.39 -172.431 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -93.54 -13.03 28.26 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 119.004 0.82 . . . . 17.29 113.044 174.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -96.08 -6.83 37.69 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 113.23 0.826 . . . . 26.21 113.23 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 28.1 m -86.51 -28.14 5.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 113.458 0.91 . . . . 20.74 113.458 -169.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -72.32 -42.34 65.53 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.933 -1.107 . . . . 21.51 111.612 -169.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -66.5 -29.44 69.55 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.69 -0.804 . . . . 33.18 111.652 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -73.36 -54.81 7.43 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.558 -0.457 . . . . 36.17 111.166 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.36 -17.43 64.76 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.556 0.576 . . . . 26.33 112.556 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 26.5 tp10 -68.91 -26.17 64.95 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.313 -0.555 . . . . 36.47 111.374 175.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.35 -38.3 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 122.442 0.297 . . . . 24.78 111.615 177.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.4 mt -69.16 -12.44 61.68 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.28 0.845 . . . . 28.19 113.28 -179.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -71.73 -23.76 61.67 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.024 0.75 . . . . 34.24 113.024 -173.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -98.11 5.9 48.13 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 113.647 0.98 . . . . 32.68 113.647 -176.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -122.6 5.3 9.53 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.766 0.712 . . . . 40.55 112.717 -177.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 66.6 t -102.08 136.67 33.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 118.427 0.558 . . . . 45.64 109.889 -174.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.7 p -87.74 160.61 18.01 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.649 0.738 . . . . 36.53 110.642 174.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -61.79 -28.98 69.84 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.363 -0.835 . . . . 44.15 111.784 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 31.7 ttm-85 -62.16 -40.29 95.49 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.856 -0.338 . . . . 54.7 111.164 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 41.6 tp -69.72 -41.15 75.7 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.396 -0.521 . . . . 27.22 111.344 -176.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 32.3 mmm -64.46 -29.07 70.12 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.086 -0.646 . . . . 36.38 111.731 175.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.27 -48.4 73.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.239 -0.585 . . . . 31.04 110.871 178.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ARG . . . . . 0.687 ' NH2' ' O ' ' A' ' 402' ' ' HOH . 0.9 OUTLIER -71.58 -32.47 68.11 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.051 -0.66 . . . . 47.25 111.635 177.694 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 22.1 mt -62.7 -48.67 87.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 121.187 0.518 . . . . 27.32 110.022 172.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 30.3 t0 -61.42 -42.21 98.39 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 122.042 -0.411 . . . . 39.09 111.161 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.33 80.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.508 -0.477 . . . . 29.14 111.473 -177.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -70.07 -34.56 73.35 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.086 -0.646 . . . . 29.69 111.587 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 82.2 mt -74.28 -2.55 25.49 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 113.039 0.755 . . . . 33.82 113.039 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 76.25 24.81 67.59 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.914 -0.66 . . . . 43.99 114.604 -176.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 56.01 71.38 1.23 Allowed Pre-proline 0 C--O 1.238 0.477 0 C-N-CA 124.372 1.069 . . . . 53.36 110.293 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -76.78 151.5 31.8 Favored 'Trans proline' 0 C--N 1.329 -0.449 0 CA-C-O 121.912 0.713 . . . . 48.67 111.216 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -107.12 -10.55 15.85 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 114.976 -1.011 . . . . 59.71 113.537 -179.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 20.8 ptt180 -142.69 157.45 44.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.767 0.794 . . . . 53.73 110.281 -176.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.34 175.93 2.19 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 126.171 1.789 . . . . 55.56 112.17 -176.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.5 -19.37 67.44 Favored 'Trans proline' 0 C--O 1.237 0.43 0 CA-C-N 118.302 0.429 . . . . 50.65 112.344 157.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 8.2 m170 -97.97 0.18 45.92 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.735 0.814 . . . . 47.67 112.801 175.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 83.62 1.04 90.12 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-O 119.045 -0.864 . . . . 45.84 114.711 -174.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -59.91 128.13 86.49 Favored Pre-proline 0 C--O 1.239 0.504 0 CA-C-N 118.216 1.008 . . . . 46.62 109.502 176.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.76 135.72 36.48 Favored 'Trans proline' 0 C--N 1.332 -0.34 0 CA-C-N 118.969 0.668 . . . . 42.71 111.698 -176.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 51.2 mt -93.13 112.68 57.29 Favored Pre-proline 0 C--O 1.245 0.824 0 N-CA-C 107.734 -1.21 . . . . 46.05 107.734 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -62.34 137.63 66.56 Favored 'Trans proline' 0 C--N 1.331 -0.344 0 CA-C-N 119.43 0.832 . . . . 51.53 111.152 178.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -66.19 163.38 42.06 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.306 -0.95 . . . . 68.7 112.149 175.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.11 -39.93 87.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.331 -0.548 . . . . 78.42 110.976 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -34.36 74.06 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 111.77 0.285 . . . . 97.97 111.77 172.485 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 105.04 40.63 2.08 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 114.563 0.585 . . . . 93.4 114.563 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -84.78 -47.46 10.38 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.05 0.425 . . . . 92.25 112.006 -177.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 86.4 t 71.27 116.74 0.03 OUTLIER Pre-proline 0 C--O 1.239 0.533 0 C-N-CA 125.628 1.571 . . . . 55.33 109.512 -171.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -96.85 78.37 0.09 OUTLIER 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 120.386 0.724 . . . . 44.01 112.651 175.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' THR . . . . . 0.53 ' OG1' ' O ' ' A' ' 401' ' ' HOH . 26.1 m -77.35 128.48 80.29 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 110.039 -0.356 . . . . 47.98 110.039 -178.506 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -79.88 152.72 22.21 Favored 'Trans proline' 0 C--O 1.241 0.648 0 C-N-CA 120.484 0.789 . . . . 61.07 110.813 175.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -82.56 94.35 0.87 Allowed 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 120.145 0.563 . . . . 69.39 112.349 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -140.1 161.93 36.45 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.666 0.746 . . . . 53.04 110.532 -170.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' ARG . . . . . 0.408 ' NH1' ' OG ' ' A' ' 228' ' ' SER . 0.1 OUTLIER -139.92 164.85 28.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.927 -1.033 . . . . 64.99 108.601 171.491 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -65.37 149.56 49.79 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.534 -0.757 . . . . 34.51 111.066 -177.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 21.3 tp -61.32 -40.72 95.24 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.505 -0.77 . . . . 34.67 111.201 176.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -59.87 -31.33 69.68 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.872 -0.331 . . . . 40.16 111.66 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -76.3 -7.98 56.1 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 113.085 0.772 . . . . 42.62 113.085 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' CYS . . . . . . . . . . . . . 71.2 m -99.27 157.32 16.47 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.811 0.815 . . . . 50.88 110.111 177.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -110.39 174.54 5.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.783 0.801 . . . . 78.8 110.917 177.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -61.86 138.93 58.4 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 114.802 -1.09 . . . . 81.2 111.101 -172.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.31 -23.03 31.78 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 114.963 0.745 . . . . 71.1 114.963 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -66.59 151.93 46.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 118.141 0.971 . . . . 57.73 110.833 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 42.9 p -123.76 173.84 7.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.382 -0.826 . . . . 52.19 109.139 175.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . 170.23 165.17 27.16 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 119.87 -1.157 . . . . 44.5 114.948 177.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.5 m -105.46 128.75 53.71 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.456 0.702 . . . . 40.57 109.247 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 98.1 t -61.86 125.25 17.83 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 109.064 -0.717 . . . . 31.37 109.064 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -117.6 -25.88 6.77 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 114.29 1.218 . . . . 30.54 114.29 -175.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -158.81 134.37 8.69 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.512 -0.921 . . . . 35.18 108.512 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 17.8 mt -124.71 129.64 73.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.402 -0.962 . . . . 27.94 108.402 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 38.2 t -62.66 148.21 47.1 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.496 0.665 . . . . 40.91 110.624 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 38.6 p-10 -114.66 19.72 15.82 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.654 -0.703 . . . . 31.69 112.202 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.12 -28.12 69.21 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.215 -0.594 . . . . 29.47 111.728 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -123.68 107.62 31.39 Favored Pre-proline 0 C--O 1.246 0.875 0 N-CA-C 108.818 -0.808 . . . . 49.62 108.818 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -66.63 -27.47 45.39 Favored 'Trans proline' 0 C--O 1.238 0.495 0 CA-C-N 119.35 0.803 . . . . 24.66 112.816 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -59.18 -40.25 85.07 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.559 -0.456 . . . . 31.56 111.098 175.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' MET . . . . . . . . . . . . . 2.0 ttm -68.14 -34.31 76.12 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.645 -0.422 . . . . 48.76 111.75 -177.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 16.6 mt -65.19 -38.34 90.2 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.104 -0.638 . . . . 45.75 110.781 173.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -62.04 -45.82 91.89 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.0 0.429 . . . . 46.6 110.643 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -60.73 -42.38 97.22 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.65 -0.25 . . . . 37.39 111.183 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -63.01 -43.1 99.7 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.475 -0.49 . . . . 25.18 111.367 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -65.4 -32.66 74.4 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.756 -0.377 . . . . 28.29 111.813 -179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 92.5 p -72.78 -31.02 64.56 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.302 -0.559 . . . . 34.38 112.031 -176.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 10.9 pt -92.4 -26.68 4.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 120.312 -0.555 . . . . 41.13 112.109 -179.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 120.84 20.32 3.47 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 115.384 0.914 . . . . 32.41 115.384 173.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' ILE . . . . . . . . . . . . . 11.7 mt -97.25 94.33 3.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 106.327 -1.731 . . . . 46.94 106.327 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' SER . . . . . 0.513 ' O ' ' OG ' ' A' ' 188' ' ' SER . 1.5 m -109.9 177.61 4.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.595 0.712 . . . . 55.04 109.151 175.103 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' LEU . . . . . . . . . . . . . 78.0 mt -66.86 142.11 57.43 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 119.9 -0.72 . . . . 51.29 109.444 170.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 77.63 3.64 3.03 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 127.376 2.271 . . . . 55.84 112.593 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' SER . . . . . 0.513 ' OG ' ' O ' ' A' ' 185' ' ' SER . 2.1 p -79.79 137.38 36.97 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.543 1.065 . . . . 46.68 110.064 174.826 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' ARG . . . . . 0.758 ' NH1' ' OD2' ' A' ' 207' ' ' ASP . 3.8 mtp-105 -93.85 134.76 35.87 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.047 -0.524 . . . . 74.64 110.581 -176.693 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 6.8 mt -121.32 157.48 30.31 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.371 0.669 . . . . 44.33 110.255 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -132.79 136.12 46.11 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.684 -0.858 . . . . 81.5 108.684 161.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 98.0 t -79.24 128.36 38.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 109.204 -0.665 . . . . 37.0 109.204 175.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 44.2 mt -99.11 -51.92 3.69 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.47 0.544 . . . . 48.89 112.47 -179.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -145.21 105.36 4.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.611 -0.885 . . . . 45.73 108.611 -177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' ARG . . . . . . . . . . . . . 68.9 ttt-85 -96.61 107.16 19.55 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.246 -1.02 . . . . 50.11 108.246 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' ARG . . . . . . . . . . . . . 57.3 mtm-85 -103.52 92.76 4.6 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.41 -1.329 . . . . 54.14 107.41 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -56.3 -33.69 65.78 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.82 -0.627 . . . . 84.1 111.441 -177.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -110.94 118.52 36.3 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 105.905 -1.887 . . . . 68.26 105.905 164.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' ALA . . . . . . . . . . . . . . . -121.53 78.24 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.703 0.631 . . . . 76.65 112.703 7.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . 67.29 51.04 40.53 Favored Glycine 0 C--N 1.332 0.338 0 N-CA-C 115.023 0.769 . . . . 76.93 115.023 174.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' MET . . . . . . . . . . . . . 4.6 mmt -140.13 140.68 36.05 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.332 -0.618 . . . . 68.97 109.332 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ILE . . . . . . . . . . . . . 12.7 tt -142.1 131.13 22.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 108.408 -0.96 . . . . 50.09 108.408 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 9.6 t -103.63 124.34 48.65 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.061 -0.718 . . . . 46.54 109.061 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 4.3 m -124.6 160.03 29.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.89 0.852 . . . . 41.12 109.169 -179.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -117.08 114.19 23.38 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.131 -1.063 . . . . 49.2 108.131 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' ILE . . . . . . . . . . . . . 8.9 mm -78.18 124.67 36.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 108.497 -0.927 . . . . 55.57 108.497 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ASP . . . . . 0.758 ' OD2' ' NH1' ' A' ' 189' ' ' ARG . 52.5 t0 -78.66 95.2 5.2 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.941 -1.133 . . . . 75.75 107.941 176.44 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 85.3 p -130.69 -178.91 5.0 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.025 -0.732 . . . . 106.08 109.025 -178.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' ALA . . . . . . . . . . . . . . . -56.21 -64.75 0.76 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.615 -0.721 . . . . 125.58 110.78 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -78.24 -6.99 56.59 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.834 0.679 . . . . 144.97 112.834 174.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' GLY . . . . . . . . . . . . . . . 56.17 79.37 0.09 OUTLIER Glycine 0 C--N 1.334 0.429 0 N-CA-C 114.646 0.618 . . . . 123.21 114.646 175.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -92.11 174.38 7.34 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.973 0.892 . . . . 83.21 110.719 -176.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 5.1 m -132.37 130.7 41.05 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.65 -0.87 . . . . 50.24 108.65 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 11.4 m -127.97 158.76 39.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.815 0.817 . . . . 48.72 109.845 -177.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -118.49 103.49 9.79 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.145 -1.057 . . . . 67.86 108.145 -179.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' LEU . . . . . . . . . . . . . 19.9 mt -90.85 132.81 35.67 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.65 0.262 . . . . 51.51 110.571 -178.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -72.15 171.47 48.53 Favored Glycine 0 N--CA 1.444 -0.773 0 CA-C-O 122.49 1.05 . . . . 46.0 111.578 171.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 30.4 t -57.83 -43.31 98.55 Favored Pre-proline 0 C--O 1.244 0.805 0 N-CA-C 114.144 1.164 . . . . 38.86 114.144 -177.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -66.03 -36.31 30.52 Favored 'Trans proline' 0 C--O 1.238 0.481 0 CA-C-N 121.633 1.619 . . . . 35.35 113.295 -179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' ALA . . . . . . . . . . . . . . . -66.24 -38.47 87.98 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.284 -0.566 . . . . 35.88 111.338 -179.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -71.11 -26.99 63.27 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.322 -0.551 . . . . 39.32 111.832 -179.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.17 -0.37 24.79 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.63 0.604 . . . . 41.89 112.63 176.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' ALA . . . . . . . . . . . . . . . -108.03 -7.91 16.01 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.383 0.883 . . . . 33.57 113.383 177.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 39.2 mt -106.0 109.49 28.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 108.212 -1.033 . . . . 33.37 108.212 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' TRP . . . . . . . . . . . . . 7.0 m-90 -91.62 136.36 33.19 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 109.454 -0.573 . . . . 33.09 109.454 171.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' VAL . . . . . . . . . . . . . 1.4 p -130.5 151.01 35.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.335 0.588 . . . . 34.32 109.882 -167.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 38.9 t -115.71 117.11 54.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 N-CA-C 108.298 -1.001 . . . . 60.39 108.298 179.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' SER . . . . . 0.408 ' OG ' ' NH1' ' A' ' 152' ' ' ARG . 58.5 m -78.36 95.89 5.18 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 124.177 0.923 . . . . 81.33 110.924 -177.463 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 O-C-N 124.673 1.233 . . . . 86.03 109.344 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.533 0.305 0 N-CA-C 111.976 0.362 . . . . 63.58 111.976 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -98.45 -4.51 34.38 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.575 0.75 . . . . 58.93 109.571 -2.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -74.81 -28.63 60.79 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.312 -0.858 . . . . 52.98 111.705 -179.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -62.73 -36.91 84.52 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.476 -0.489 . . . . 50.68 111.476 172.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' TYR . . . . . 0.493 ' O ' ' N ' ' B' ' 20' ' ' VAL . 22.4 m-85 -56.55 -75.62 0.04 OUTLIER 'General case' 0 C--O 1.235 0.319 0 C-N-CA 119.933 -0.707 . . . . 67.26 110.002 175.385 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 70.5 mt -40.58 -41.2 1.42 Allowed 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.846 0.684 . . . . 58.68 112.846 -177.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -61.22 -37.42 82.94 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.5 -0.48 . . . . 46.51 111.275 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . 0.493 ' N ' ' O ' ' B' ' 17' ' ' TYR . 17.0 t -74.23 -42.47 51.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 120.292 -0.563 . . . . 44.05 110.988 -176.221 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 5.0 mp -55.52 -41.89 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 119.331 -0.948 . . . . 41.86 111.294 177.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' TRP . . . . . . . . . . . . . 87.7 t90 -70.69 -43.43 69.06 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 118.429 -1.308 . . . . 38.14 111.722 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 39.5 p -66.52 -24.02 66.32 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.477 -0.489 . . . . 41.4 112.224 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.03 -40.78 68.16 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.215 -0.594 . . . . 44.73 111.291 178.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -90.14 20.11 4.56 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.596 0.591 . . . . 60.24 112.596 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -83.83 -32.31 25.35 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.431 -0.508 . . . . 40.53 111.973 -178.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -122.46 -1.05 9.14 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 113.529 0.936 . . . . 54.32 113.529 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 4.5 p -145.6 170.29 16.74 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.789 -0.819 . . . . 69.71 108.789 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -110.65 0.25 17.44 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.529 -0.76 . . . . 81.9 112.88 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -60.82 133.38 56.04 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.09 -0.707 . . . . 85.5 109.09 168.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 1.2 tptm -100.51 172.92 6.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 122.252 1.025 . . . . 95.77 111.831 -168.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' B' ' 68' ' ' ALA . 28.9 t -99.75 134.61 38.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 114.598 -1.183 . . . . 112.31 109.496 -165.694 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 43.4 m -117.45 152.03 35.85 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.24 -0.652 . . . . 117.19 109.24 172.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 61.2 m -48.66 -33.83 10.69 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.353 -0.839 . . . . 125.41 112.255 -177.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -72.74 -39.79 66.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.603 -0.439 . . . . 129.12 111.622 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' MET . . . . . . . . . . . . . 3.3 mtp -64.65 -29.55 70.55 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.21 -0.596 . . . . 120.99 111.813 -178.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 51.1 mt -65.93 -31.69 72.76 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.995 -0.682 . . . . 95.36 111.256 170.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.42 -25.57 54.63 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.489 -0.485 . . . . 91.76 111.766 -178.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -85.63 -19.61 30.71 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.844 0.683 . . . . 101.26 112.844 177.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ARG . . . . . 0.474 ' NH1' ' O ' ' B' ' 401' ' ' HOH . 0.0 OUTLIER -90.83 -47.96 7.3 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 118.148 0.431 . . . . 112.97 111.125 176.108 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 6.8 mm -78.25 -53.01 14.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 120.931 0.396 . . . . 101.77 110.609 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 115.0 80.22 0.88 Allowed Glycine 0 N--CA 1.45 -0.406 0 O-C-N 121.872 -0.518 . . . . 102.14 113.518 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 2.3 p -162.68 175.31 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.558 -0.904 . . . . 97.26 108.558 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 24.1 p -83.21 157.49 22.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.703 0.763 . . . . 96.61 110.622 178.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.7 -25.88 68.39 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.419 -0.809 . . . . 97.44 111.441 176.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.9 t -64.82 -62.42 1.58 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.01 0.433 . . . . 100.49 111.029 175.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.5 m -64.28 -28.61 69.84 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.215 -0.303 . . . . 102.74 111.693 -177.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.73 81.32 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.851 -0.34 . . . . 101.47 111.716 -176.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 26.5 t -72.09 -33.98 68.3 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.908 -0.717 . . . . 102.73 111.705 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.08 -32.13 72.25 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.449 -0.5 . . . . 116.56 111.485 178.917 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -74.35 -28.93 61.35 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.097 -0.641 . . . . 99.41 111.446 174.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 3.2 mt -73.09 -36.56 50.88 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 120.731 -0.388 . . . . 83.35 110.577 176.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -35.52 78.73 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.974 -0.454 . . . . 96.55 112.011 -173.933 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -27.2 49.83 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.235 -0.986 . . . . 89.31 111.643 -176.579 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 9.3 mp -71.52 -28.43 63.88 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.327 -0.549 . . . . 82.96 111.237 169.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.72 -27.4 31.19 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.853 -0.339 . . . . 85.99 111.753 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -74.34 -14.19 60.85 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.296 0.48 . . . . 84.94 112.296 175.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -94.0 -9.77 35.79 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.449 0.907 . . . . 79.87 113.449 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.02 16.79 64.36 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.777 -0.725 . . . . 70.96 114.335 -173.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 68.4 mt -93.71 -12.28 29.6 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 117.887 0.843 . . . . 66.92 112.849 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' VAL . . . . . . . . . . . . . 7.1 p -166.31 145.96 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 108.72 -0.844 . . . . 77.06 108.72 -177.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.729 0.3 . . . . 79.56 110.785 177.262 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ALA . . . . . 0.61 ' N ' ' O ' ' B' ' 32' ' ' VAL . . . . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.667 0.27 . . . . 96.94 111.08 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 98.2 t -82.06 -73.48 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 109.386 -0.598 . . . . 105.56 109.386 -177.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' THR . . . . . . . . . . . . . 5.7 m 63.28 111.95 0.02 OUTLIER 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.591 1.157 . . . . 91.08 112.26 176.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 pp -89.35 161.87 16.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.752 0.787 . . . . 79.19 111.43 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 2.7 p -97.06 -172.88 2.54 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.235 -0.893 . . . . 72.04 110.015 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -64.76 -49.35 71.12 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.171 -0.468 . . . . 65.15 111.227 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 67.8 p -66.98 -23.72 65.97 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.524 -0.47 . . . . 63.12 112.107 177.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.04 -42.0 11.48 Favored Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 118.032 0.378 . . . . 54.7 112.7 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ARG . . . . . . . . . . . . . 7.8 ttm-85 -57.6 -35.39 70.37 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.428 -0.509 . . . . 50.29 110.93 173.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -67.81 -44.68 76.73 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.446 -0.502 . . . . 57.42 111.307 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.62 -41.01 89.04 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.264 -0.575 . . . . 41.22 111.24 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.55 95.54 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.441 -0.503 . . . . 33.25 111.111 178.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.9 mt -63.16 -31.38 72.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.556 -0.458 . . . . 25.95 111.565 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.15 -40.82 71.12 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.205 -0.598 . . . . 21.83 111.1 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' MET . . . . . 0.509 ' SD ' ' NH1' ' B' ' 85' ' ' ARG . 77.4 mmm -65.34 -43.04 92.14 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.494 -0.483 . . . . 29.82 111.148 176.685 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' VAL . . . . . . . . . . . . . 73.8 t -60.86 -40.74 86.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-O 121.014 0.435 . . . . 21.79 110.297 176.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 27.0 ttt85 -64.68 -41.75 95.83 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.406 -0.517 . . . . 29.86 111.16 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ARG . . . . . 0.509 ' NH1' ' SD ' ' B' ' 82' ' ' MET . 62.8 mtt180 -63.48 -44.07 95.46 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.475 -0.49 . . . . 43.12 111.238 178.499 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -61.36 -47.25 86.71 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.798 -0.361 . . . . 26.63 111.304 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -77.82 -28.29 50.25 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.316 0.488 . . . . 28.78 112.316 -173.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.1 mt -65.74 -38.75 89.99 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.727 -0.789 . . . . 19.85 110.826 170.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 16.9 mt -64.38 -46.4 83.49 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.679 -0.408 . . . . 24.26 110.898 177.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -56.64 -38.15 71.74 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.942 -0.303 . . . . 41.24 111.168 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 6.3 m -73.22 -40.7 64.5 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.267 -0.573 . . . . 29.65 111.282 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -63.49 -40.19 96.42 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.209 -0.597 . . . . 31.45 111.188 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.65 -47.73 84.05 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.716 -0.394 . . . . 34.09 111.263 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.7 t -69.0 -47.33 76.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 120.454 -0.499 . . . . 36.96 110.534 -178.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -76.55 -30.07 56.93 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 112.942 0.719 . . . . 35.15 112.942 -169.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -110.78 -33.22 6.6 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 114.387 1.255 . . . . 42.72 114.387 -172.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 9.2 mt -115.38 18.97 15.8 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.893 0.701 . . . . 37.95 112.893 -172.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . 69.73 19.99 75.45 Favored Glycine 0 N--CA 1.449 -0.433 0 N-CA-C 115.94 1.136 . . . . 39.64 115.94 171.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -74.33 149.67 40.51 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.357 1.079 . . . . 33.55 110.785 175.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ARG . . . . . 0.473 ' N ' ' OE2' ' B' ' 103' ' ' GLU . 62.4 mtm-85 -85.94 161.2 19.14 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.577 -0.738 . . . . 60.6 109.494 167.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -69.73 -18.01 63.49 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 119.206 -0.997 . . . . 40.14 112.695 -173.221 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -90.68 -2.28 57.84 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.969 0.729 . . . . 32.44 112.969 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' GLU . . . . . 0.473 ' OE2' ' N ' ' B' ' 100' ' ' ARG . 24.9 mt-10 -101.98 -12.97 17.78 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.242 0.83 . . . . 42.15 113.242 178.776 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 30.0 m -83.98 -30.19 7.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 113.287 0.847 . . . . 29.0 113.287 -166.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -62.89 -56.32 18.31 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.091 -0.643 . . . . 31.95 111.674 -169.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -61.71 -34.83 76.48 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.417 -0.513 . . . . 57.69 111.82 -175.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.7 -46.77 29.35 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.274 -0.57 . . . . 45.93 111.177 178.069 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.77 -19.93 66.08 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 120.478 -0.489 . . . . 32.61 112.216 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -65.41 -19.15 65.82 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 117.989 0.359 . . . . 46.7 111.657 172.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' VAL . . . . . . . . . . . . . 59.4 t -100.97 -42.98 10.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 122.591 0.356 . . . . 29.73 111.874 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.37 -27.4 69.04 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.492 -0.483 . . . . 30.31 112.203 -179.478 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -62.0 -15.22 42.38 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 113.106 0.78 . . . . 37.89 113.106 -170.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -96.94 -14.29 21.83 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 113.452 0.908 . . . . 42.63 113.452 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -123.17 39.76 3.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 118.522 0.601 . . . . 29.99 111.305 -176.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 54.5 t -125.5 138.55 54.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.9 -0.778 . . . . 31.95 108.9 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 24.8 p -89.06 156.96 18.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.693 0.759 . . . . 20.39 110.716 179.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.9 -24.73 65.25 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.359 -0.837 . . . . 27.7 111.645 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -69.52 -40.31 77.0 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 119.577 -0.849 . . . . 20.49 110.716 173.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 26.6 tp -67.59 -39.41 84.83 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.402 -0.519 . . . . 20.38 111.119 179.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 2.1 mmt -60.81 -41.26 95.32 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.323 -0.551 . . . . 38.19 111.461 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.42 83.78 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.464 -0.494 . . . . 22.7 111.495 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.49 -36.87 57.58 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.259 -0.577 . . . . 26.97 111.402 178.34 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 68.6 mt -58.56 -47.61 87.99 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.278 0.561 . . . . 26.8 109.881 168.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -58.86 -43.71 90.89 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.474 -0.33 . . . . 33.76 110.9 -179.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.87 -33.93 68.8 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.353 -0.539 . . . . 20.2 111.931 -178.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -71.19 -30.85 66.91 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.924 -0.71 . . . . 34.61 111.443 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.3 mt -79.25 -3.49 46.16 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.963 0.727 . . . . 25.14 112.963 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 89.07 15.21 59.47 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-O 119.029 -0.873 . . . . 19.78 115.192 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 63.95 61.97 1.56 Allowed Pre-proline 0 C--O 1.238 0.458 0 C-N-CA 125.359 1.464 . . . . 36.95 110.071 -176.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.79 148.52 36.43 Favored 'Trans proline' 0 C--N 1.33 -0.4 0 CA-C-O 121.896 0.707 . . . . 39.39 112.774 -172.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -92.11 -31.7 15.42 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.009 -0.996 . . . . 51.21 112.907 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -122.02 149.55 43.34 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.28 0.562 . . . . 47.72 110.33 -179.666 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -90.35 179.94 1.36 Allowed Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 123.892 0.877 . . . . 43.05 109.15 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -57.96 -19.33 39.52 Favored 'Trans proline' 0 C--O 1.237 0.439 0 CA-C-N 120.35 1.161 . . . . 41.31 114.509 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -99.1 7.48 45.83 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.669 0.668 . . . . 43.66 112.727 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 75.36 3.86 72.25 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.168 -1.015 . . . . 41.53 114.376 -172.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -68.05 134.02 91.77 Favored Pre-proline 0 C--O 1.238 0.454 0 CA-C-N 117.92 0.86 . . . . 45.37 109.364 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -68.78 133.78 28.32 Favored 'Trans proline' 0 C--N 1.332 -0.312 0 C-N-CA 120.243 0.629 . . . . 47.02 111.329 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 75.2 mt -93.06 114.81 63.76 Favored Pre-proline 0 C--O 1.242 0.692 0 N-CA-C 107.629 -1.248 . . . . 38.26 107.629 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.79 152.57 80.01 Favored 'Trans proline' 0 C--N 1.332 -0.292 0 CA-C-N 119.286 0.781 . . . . 29.38 111.612 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' GLY . . . . . . . . . . . . . . . -77.6 168.84 54.55 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.412 -0.813 . . . . 38.94 111.886 173.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -61.85 -26.73 68.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.175 -0.512 . . . . 40.46 111.888 -177.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -98.21 5.25 48.64 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.492 0.553 . . . . 53.62 112.492 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' GLY . . . . . . . . . . . . . . . 87.36 37.08 8.37 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 118.001 0.364 . . . . 41.61 113.754 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -99.13 93.78 6.15 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.438 -1.319 . . . . 38.37 107.438 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 22.9 t -79.17 118.81 74.55 Favored Pre-proline 0 C--O 1.24 0.581 0 CA-C-N 115.94 -0.573 . . . . 30.68 110.037 -175.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -87.58 71.7 3.05 Favored 'Trans proline' 0 N--CA 1.481 0.793 0 C-N-CA 121.459 1.439 . . . . 24.22 112.448 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 53.5 m -67.78 126.24 92.35 Favored Pre-proline 0 C--O 1.238 0.46 0 CA-C-N 115.798 -0.637 . . . . 28.41 110.29 -177.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -83.16 147.42 12.95 Favored 'Trans proline' 0 C--O 1.24 0.612 0 C-N-CA 120.586 0.857 . . . . 36.99 110.815 176.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -80.76 88.14 1.43 Allowed 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 120.062 0.508 . . . . 46.45 112.235 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' ALA . . . . . . . . . . . . . . . -130.12 153.43 48.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.383 0.611 . . . . 58.24 110.886 -171.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -132.47 160.25 36.99 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.054 -0.976 . . . . 87.43 108.854 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -62.17 143.73 56.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.812 -0.631 . . . . 51.05 110.643 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' LEU . . . . . . . . . . . . . 23.9 tp -66.3 -34.43 77.97 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.879 -0.601 . . . . 54.09 111.39 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -63.15 -11.54 21.18 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.585 0.587 . . . . 83.98 112.585 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -92.47 -3.7 54.77 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 113.05 0.759 . . . . 70.57 113.05 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' CYS . . . . . . . . . . . . . 69.0 m -80.48 173.39 12.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 122.012 0.911 . . . . 75.67 110.752 -178.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -134.76 146.38 49.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.231 -0.895 . . . . 90.67 109.394 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' ASP . . . . . 0.49 ' OD1' ' N ' ' B' ' 159' ' ' ASP . 4.3 p-10 -70.78 117.06 11.82 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.021 -0.536 . . . . 120.01 110.018 179.467 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' GLY . . . . . . . . . . . . . . . -137.78 95.24 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 115.639 1.016 . . . . 100.54 115.639 2.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -78.45 167.71 20.89 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.873 0.844 . . . . 74.42 110.133 173.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' THR . . . . . . . . . . . . . 1.7 p -110.32 -177.43 3.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.398 -0.819 . . . . 52.32 109.248 174.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 152.26 133.51 1.96 Allowed Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 116.518 1.367 . . . . 44.66 116.518 176.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' THR . . . . . . . . . . . . . 1.7 p -76.43 145.68 39.14 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.435 0.636 . . . . 38.33 110.531 174.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 1.6 m -76.98 125.46 36.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 108.906 -0.775 . . . . 36.67 108.906 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -99.22 -59.17 1.78 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.25 -0.432 . . . . 28.41 111.696 -179.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -128.21 143.16 51.02 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 109.428 -0.582 . . . . 31.39 109.428 -176.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 96.7 mt -125.85 130.8 72.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 107.909 -1.145 . . . . 33.04 107.909 175.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 7.4 t -63.0 151.03 40.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.577 0.703 . . . . 42.26 110.932 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -121.77 12.95 10.68 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.609 -0.723 . . . . 42.24 112.941 -178.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -62.48 -16.72 57.04 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.478 0.548 . . . . 42.82 112.478 -178.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -140.92 115.79 7.29 Favored Pre-proline 0 C--O 1.238 0.471 0 CA-C-N 118.183 0.447 . . . . 55.21 110.174 179.47 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -65.15 -16.56 55.59 Favored 'Trans proline' 0 C--O 1.237 0.452 0 CA-C-N 118.553 0.519 . . . . 36.15 113.113 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -65.79 -34.08 77.34 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 118.084 0.402 . . . . 46.87 111.53 174.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' MET . . . . . . . . . . . . . 30.4 tpp -75.16 -40.97 59.1 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 121.024 -0.27 . . . . 37.93 111.638 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' LEU . . . . . . . . . . . . . 67.9 mt -65.38 -44.67 86.85 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.386 -0.525 . . . . 33.3 111.044 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 -57.04 -39.12 74.22 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.6 -0.44 . . . . 48.58 110.959 174.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 178' ' ' TYR . . . . . 0.434 ' O ' ' OG ' ' B' ' 181' ' ' SER . 8.3 t80 -68.41 -46.98 68.49 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.864 -0.335 . . . . 51.14 111.038 178.676 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 5.5 m-30 -59.66 -39.61 85.01 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.499 -0.48 . . . . 37.76 111.294 -176.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -68.53 -25.81 65.12 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.347 -0.541 . . . . 39.34 111.818 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 181' ' ' SER . . . . . 0.434 ' OG ' ' O ' ' B' ' 178' ' ' TYR . 83.4 p -70.18 -40.88 74.41 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.434 -0.506 . . . . 45.64 111.54 -176.842 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 182' ' ' ILE . . . . . . . . . . . . . 5.0 pt -81.66 -31.6 11.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 120.189 -0.605 . . . . 49.7 111.513 -177.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 125.97 20.66 2.03 Favored Glycine 0 N--CA 1.449 -0.467 0 O-C-N 121.722 -0.611 . . . . 46.44 113.654 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 184' ' ' ILE . . . . . . . . . . . . . 11.6 mm -96.11 122.09 47.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 108.396 -0.965 . . . . 42.98 108.396 179.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 185' ' ' SER . . . . . 0.56 ' O ' ' OG ' ' B' ' 188' ' ' SER . 2.1 p -159.81 158.19 30.61 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.911 -1.144 . . . . 41.85 107.911 178.639 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 8.4 mt -47.6 141.01 5.56 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.655 -0.702 . . . . 38.45 110.999 -178.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 187' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 86.18 -12.24 0.62 Allowed 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 128.768 2.827 . . . . 38.74 112.772 178.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' SER . . . . . 0.56 ' OG ' ' O ' ' B' ' 185' ' ' SER . 2.1 p -72.16 134.54 45.78 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 119.274 0.943 . . . . 39.38 110.099 179.728 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 189' ' ' ARG . . . . . . . . . . . . . 22.8 mtp85 -86.32 136.09 33.28 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.655 -0.498 . . . . 71.74 109.655 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 190' ' ' LEU . . . . . . . . . . . . . 45.1 mt -123.3 149.23 45.09 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.167 0.508 . . . . 45.94 110.509 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 191' ' ' ARG . . . . . 0.584 ' NH2' ' OD2' ' B' ' 207' ' ' ASP . 20.5 ttp-105 -133.13 128.99 37.3 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.637 -0.875 . . . . 61.54 108.637 175.908 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 47.5 t -88.17 133.68 30.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 109.275 -0.639 . . . . 55.41 109.275 -173.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 5.5 mt -135.86 76.58 1.62 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 106.952 -1.499 . . . . 68.06 106.952 178.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 194' ' ' ALA . . . . . 0.693 ' CA ' ' CB ' ' B' ' 195' ' ' ARG . . . 64.42 129.38 0.02 OUTLIER 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.236 1.014 . . . . 82.86 109.374 -166.243 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 195' ' ' ARG . . . . . 0.693 ' CB ' ' CA ' ' B' ' 194' ' ' ALA . 0.0 OUTLIER 78.75 56.77 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 118.209 -0.901 . . . . 83.8 109.678 6.529 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 196' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -131.81 79.35 1.87 Allowed 'General case' 0 N--CA 1.487 1.397 0 CA-C-O 117.886 -1.054 . . . . 75.15 108.542 178.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 197' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -60.1 -45.05 94.24 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 117.488 -1.244 . . . . 74.64 110.514 -178.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 198' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -51.61 -31.88 26.69 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 123.984 0.802 . . . . 72.29 109.563 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 199' ' ' ALA . . . . . . . . . . . . . . . -92.92 -5.46 50.76 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.09 0.869 . . . . 76.91 112.948 179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 200' ' ' GLY . . . . . . . . . . . . . . . 64.17 32.43 84.18 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 121.206 -0.521 . . . . 77.02 114.251 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -156.62 165.0 37.53 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.83 -0.804 . . . . 82.68 108.83 -178.894 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 2.0 pt -131.74 141.35 45.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 108.676 -0.861 . . . . 66.77 108.676 172.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' SER . . . . . 0.526 ' N ' ' O ' ' B' ' 194' ' ' ALA . 1.1 t -98.21 138.0 36.13 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.285 -0.635 . . . . 59.86 109.285 177.468 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' VAL . . . . . . . . . . . . . 20.1 m -129.69 146.71 33.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.585 0.707 . . . . 57.9 109.406 179.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -97.39 141.72 30.13 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.134 -1.061 . . . . 66.28 108.134 164.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' ILE . . . . . . . . . . . . . 5.8 tt -117.79 120.38 64.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 108.142 -1.059 . . . . 94.64 108.142 -177.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' ASP . . . . . 0.584 ' OD2' ' NH2' ' B' ' 191' ' ' ARG . 1.4 p30 -141.49 89.61 2.23 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 106.095 -1.817 . . . . 125.5 106.095 179.738 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' SER . . . . . . . . . . . . . 18.8 p . . . . . 0 N--CA 1.473 0.715 0 N-CA-C 118.307 2.706 . . . . 103.61 118.307 14.652 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 N-CA-C 113.302 0.081 . . . . 78.67 113.302 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' ALA . . . . . . . . . . . . . . . -63.37 161.67 13.7 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 122.078 0.942 . . . . 95.31 111.215 -173.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' THR . . . . . . . . . . . . . 1.3 m -112.88 127.62 56.24 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.043 -0.98 . . . . 103.83 108.947 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' VAL . . . . . . . . . . . . . 71.7 t -132.09 137.87 53.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 108.493 -0.929 . . . . 79.87 108.493 -176.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -106.57 132.4 52.61 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.423 -0.584 . . . . 76.11 109.423 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 2.5 mp -122.89 129.85 52.13 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.27 -0.641 . . . . 50.22 109.27 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . -68.46 163.62 48.95 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.276 -0.964 . . . . 45.76 112.054 173.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 218' ' ' SER . . . . . . . . . . . . . 47.0 t -52.79 -42.75 91.09 Favored Pre-proline 0 C--O 1.243 0.73 0 N-CA-C 114.006 1.113 . . . . 44.44 114.006 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -66.4 -31.52 42.61 Favored 'Trans proline' 0 C--O 1.237 0.474 0 CA-C-N 121.596 1.606 . . . . 50.53 113.29 176.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -71.45 -49.41 41.85 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.434 0.561 . . . . 48.52 111.207 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 221' ' ' ALA . . . . . . . . . . . . . . . -66.28 -19.77 65.91 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.432 0.53 . . . . 56.18 112.432 179.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 222' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -75.87 -9.82 58.92 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.907 0.706 . . . . 72.22 112.907 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 223' ' ' ALA . . . . . . . . . . . . . . . -109.45 29.09 7.88 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 118.39 0.541 . . . . 49.17 111.855 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' ILE . . . . . . . . . . . . . 19.4 mt -135.97 101.85 2.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 107.6 -1.259 . . . . 38.19 107.6 -177.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 225' ' ' TRP . . . . . . . . . . . . . 4.2 m-90 -89.03 141.95 28.05 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.713 -0.477 . . . . 39.11 109.713 172.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 226' ' ' VAL . . . . . . . . . . . . . 3.0 m -136.81 157.61 36.29 Favored 'Isoleucine or valine' 0 C--O 1.231 0.102 0 CA-C-O 121.683 0.754 . . . . 32.6 110.45 -170.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 76.7 t -115.94 116.01 51.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.127 -1.064 . . . . 44.98 108.127 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 31.4 m -50.3 133.0 24.51 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.12 0.968 . . . . 52.56 112.872 -174.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 116.986 -1.483 . . . . 60.22 109.721 179.232 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' HOH . . . . . 0.53 ' O ' ' OG1' ' A' ' 148' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . 0.687 ' O ' ' NH2' ' A' ' 122' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' HOH . . . . . 0.465 ' O ' ' NE2' ' A' ' 25' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' HOH . . . . . 0.416 ' O ' ' N ' ' A' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 401' ' ' HOH . . . . . 0.474 ' O ' ' NH1' ' B' ' 40' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . 0.503 HG23 ' HB2' ' A' ' 16' ' ' ASP . 1.2 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.988 0.423 . . . . 68.11 110.371 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.32 -37.8 86.99 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.711 -0.677 . . . . 67.09 111.836 -170.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -65.39 -29.62 70.35 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.445 -0.502 . . . . 61.29 111.848 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . 0.503 ' HB2' HG23 ' A' ' 13' ' ' VAL . 5.4 m-20 -61.63 -34.0 74.91 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.625 -0.43 . . . . 44.69 111.572 179.209 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' TYR . . . . . 0.462 ' O ' HG12 ' A' ' 21' ' ' ILE . 56.7 m-85 -66.64 -48.51 69.22 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.673 -0.411 . . . . 64.75 111.627 -176.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . 0.454 HD21 HD13 ' A' ' 60' ' ' LEU . 5.1 mp -62.14 -42.34 99.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.257 -0.977 . . . . 47.46 110.939 -177.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -63.29 -39.65 95.17 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.157 -0.617 . . . . 33.77 110.916 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 t -69.69 -42.49 80.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.517 -0.473 . . . . 37.41 110.663 -178.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ILE . . . . . 0.633 HD11 HD11 ' A' ' 37' ' ' LEU . 35.0 mm -58.97 -43.23 88.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 C-N-CA 120.087 -0.645 . . . . 49.14 109.755 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 68.7 t90 -69.34 -40.79 77.33 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.602 -0.439 . . . . 37.58 111.501 -176.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.8 p -66.86 -32.28 73.44 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.985 -0.686 . . . . 39.02 111.574 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.05 -39.01 89.79 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.323 -0.551 . . . . 53.06 111.11 176.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 21' ' ' ILE . 35.3 mt-30 -80.83 2.58 25.79 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.154 0.798 . . . . 69.36 113.154 177.684 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -77.4 -38.64 49.37 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 118.592 0.633 . . . . 43.52 111.888 -173.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -122.38 15.67 10.49 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.248 0.462 . . . . 53.04 112.248 -178.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.2 m -157.24 160.31 38.53 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.891 -0.781 . . . . 66.33 108.891 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -131.81 67.19 1.53 Allowed 'General case' 0 C--O 1.233 0.211 0 N-CA-C 108.355 -0.98 . . . . 82.33 108.355 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 0.4 OUTLIER -112.51 -121.5 0.29 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.978 -0.556 . . . . 77.61 109.553 179.545 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . 0.479 ' HG2' ' HB2' ' A' ' 68' ' ' ALA . 4.7 mttp -141.48 146.29 36.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.655 -1.239 . . . . 76.47 107.655 176.864 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . 0.529 HG11 HG23 ' A' ' 21' ' ' ILE . 2.3 p -111.44 87.62 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.368 0 C-N-CA 118.273 -1.371 . . . . 105.87 108.397 175.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 p -66.47 160.02 25.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.858 0.837 . . . . 117.79 110.217 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -62.94 -25.82 68.53 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.357 -0.838 . . . . 122.06 111.421 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 35' ' ' LYS . 1.3 tptt -73.63 -31.82 63.73 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.306 -0.558 . . . . 116.29 111.93 173.649 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 40.5 mtt -65.73 -42.26 91.26 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.478 -0.889 . . . . 117.65 110.889 173.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . 0.633 HD11 HD11 ' A' ' 21' ' ' ILE . 27.8 mt -58.75 -49.29 78.16 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.744 0.307 . . . . 99.71 111.65 175.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.91 -47.32 86.26 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 120.781 0.324 . . . . 102.04 111.576 -170.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -73.12 -23.01 60.44 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.889 0.7 . . . . 115.14 112.889 -173.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -94.92 -37.09 11.34 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 118.801 0.728 . . . . 104.94 112.769 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.9 mt -67.33 -30.54 49.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 C-N-CA 120.281 -0.567 . . . . 100.05 110.148 173.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 106.18 14.12 21.33 Favored Glycine 0 N--CA 1.446 -0.633 0 N-CA-C 116.169 1.228 . . . . 100.49 116.169 172.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 16.4 m -125.7 164.71 24.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 118.823 1.312 . . . . 104.03 108.978 -179.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.8 p -64.05 150.4 45.47 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.143 -0.935 . . . . 96.85 110.938 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.82 -16.42 64.27 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.599 -0.728 . . . . 102.66 112.281 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.8 m -62.62 -44.92 95.07 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.7 -0.4 . . . . 83.41 110.913 176.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.8 p -87.1 -24.75 24.45 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.091 0.775 . . . . 79.26 113.091 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.47 -40.7 96.18 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.318 -0.553 . . . . 75.55 111.071 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.2 t -63.39 -43.96 96.1 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.452 -0.499 . . . . 84.07 110.991 174.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -64.89 -29.26 70.19 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.599 -0.44 . . . . 84.59 111.166 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . 0.421 ' O ' HD12 ' A' ' 55' ' ' LEU . 32.3 t -74.07 -59.44 2.72 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.752 -0.379 . . . . 74.6 111.058 177.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.7 tp -56.56 -25.96 22.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-O 120.671 0.272 . . . . 80.79 110.983 -176.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -63.17 -36.18 82.77 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 121.999 -0.438 . . . . 104.78 111.472 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -68.63 -46.52 69.0 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.88 -0.328 . . . . 78.85 111.451 -176.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . 0.421 HD12 ' O ' ' A' ' 51' ' ' SER . 4.7 mp -66.56 -27.63 67.89 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.563 -0.455 . . . . 68.22 111.936 -174.9 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.86 -31.37 70.27 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.046 -0.662 . . . . 84.07 111.385 174.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -69.98 -30.38 67.71 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.662 -0.415 . . . . 104.02 111.578 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -79.96 1.92 25.55 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.954 0.724 . . . . 87.43 112.954 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . 0.5 ' O ' ' OG ' ' A' ' 74' ' ' SER . . . 75.0 31.64 57.61 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.873 -0.68 . . . . 79.52 114.236 -178.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . 0.454 HD13 HD21 ' A' ' 18' ' ' LEU . 51.0 mt -109.94 -32.88 6.88 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 113.879 1.066 . . . . 70.58 113.879 -177.822 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 35.2 m -136.59 -176.59 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 108.715 -0.846 . . . . 86.23 108.715 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -157.77 141.89 15.99 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.618 -0.882 . . . . 97.25 108.618 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 O-C-N 123.484 0.49 . . . . 106.23 112.074 176.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 404' ' ' HOH . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 113.726 0.251 . . . . 102.74 113.726 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . 0.479 ' HB2' ' HG2' ' A' ' 31' ' ' LYS . . . -91.31 151.48 20.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.201 0.524 . . . . 100.33 110.846 -178.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 10.1 t -113.91 141.73 28.99 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 109.052 -0.721 . . . . 88.34 109.052 -177.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 t -139.43 162.69 34.43 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.321 -0.622 . . . . 75.22 109.321 179.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . 0.574 HD23 ' HA ' ' A' ' 76' ' ' ARG . 3.6 mp -91.34 138.76 31.33 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.667 -0.697 . . . . 68.34 110.069 177.408 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.7 p -84.0 -171.12 3.43 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.275 -1.009 . . . . 69.35 108.275 167.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -78.09 -31.31 50.03 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.654 -0.818 . . . . 81.55 111.734 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . 0.5 ' OG ' ' O ' ' A' ' 59' ' ' GLY . 3.3 p -74.44 -25.79 59.65 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.094 -0.642 . . . . 65.98 111.195 173.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.31 -30.86 48.66 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.435 -0.888 . . . . 58.05 113.149 175.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ARG . . . . . 0.574 ' HA ' HD23 ' A' ' 71' ' ' LEU . 25.4 ttm-85 -66.25 -51.06 61.22 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 117.445 0.623 . . . . 53.47 111.053 178.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.8 mtm-85 -66.05 -24.84 66.81 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.276 -0.57 . . . . 73.99 111.817 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.67 -41.04 27.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.224 -0.59 . . . . 48.07 111.353 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.91 -39.43 83.57 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.319 -0.553 . . . . 44.82 111.18 177.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 87.8 mt -61.01 -31.54 71.16 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.221 -0.592 . . . . 44.7 111.316 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.91 -47.11 72.76 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.492 -0.483 . . . . 36.0 110.815 174.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 28.1 mmt -61.9 -42.59 99.26 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.752 -0.379 . . . . 41.93 111.313 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.12 -39.21 83.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 120.963 0.411 . . . . 25.79 110.36 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . 0.41 ' HB2' ' HG2' ' A' ' 140' ' ' PRO . 62.6 ttt-85 -64.59 -43.6 93.31 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.385 -0.526 . . . . 40.38 111.421 -178.77 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 3.2 mtm-85 -65.58 -47.16 76.7 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.357 -0.537 . . . . 62.03 111.091 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -55.56 -45.18 77.32 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.824 0.345 . . . . 43.29 111.502 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -82.75 -31.74 28.21 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.268 -0.573 . . . . 32.06 112.446 -170.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . 0.461 HD23 HD13 ' A' ' 139' ' ' ILE . 22.6 mt -69.26 -30.2 68.27 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.788 -0.765 . . . . 25.58 111.327 171.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . 0.525 HD13 ' HB3' ' A' ' 111' ' ' LEU . 29.2 mt -70.82 -43.91 67.64 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.38 -0.528 . . . . 20.09 111.277 177.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -53.74 -45.78 70.67 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.02 0.438 . . . . 25.02 110.804 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.4 m -64.91 -39.13 93.04 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.956 -0.298 . . . . 20.83 111.479 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -69.93 -34.02 72.91 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.022 -0.671 . . . . 21.38 111.638 -178.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . 0.551 HD23 HD12 ' A' ' 97' ' ' LEU . 85.9 mt -66.56 -29.62 69.73 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.408 -0.517 . . . . 17.74 111.983 178.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . 0.561 HG23 HG11 ' A' ' 104' ' ' VAL . 43.2 t -85.05 -46.71 17.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.665 -0.414 . . . . 26.52 110.868 -178.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -84.36 -11.88 55.51 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 113.686 0.995 . . . . 27.36 113.686 -168.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -129.46 -30.9 2.08 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.893 0.77 . . . . 46.32 112.395 -177.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . 0.551 HD12 HD23 ' A' ' 93' ' ' LEU . 63.1 mt -107.23 -7.41 16.78 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 114.023 1.12 . . . . 32.93 114.023 -175.325 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.52 20.83 53.45 Favored Glycine 0 N--CA 1.449 -0.47 0 N-CA-C 116.127 1.211 . . . . 29.59 116.127 172.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -69.86 158.44 35.52 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.645 1.223 . . . . 27.87 110.685 172.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 24.5 mtt85 -94.17 168.25 11.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.335 -0.848 . . . . 58.36 108.98 164.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -75.38 -9.05 58.22 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.265 -0.974 . . . . 34.93 113.39 -172.431 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -93.54 -13.03 28.26 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 119.004 0.82 . . . . 17.29 113.044 174.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -96.08 -6.83 37.69 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 113.23 0.826 . . . . 26.21 113.23 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' VAL . . . . . 0.561 HG11 HG23 ' A' ' 94' ' ' VAL . 28.1 m -86.51 -28.14 5.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 113.458 0.91 . . . . 20.74 113.458 -169.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -72.32 -42.34 65.53 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.933 -1.107 . . . . 21.51 111.612 -169.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -66.5 -29.44 69.55 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.69 -0.804 . . . . 33.18 111.652 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -73.36 -54.81 7.43 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.558 -0.457 . . . . 36.17 111.166 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.36 -17.43 64.76 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.556 0.576 . . . . 26.33 112.556 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 26.5 tp10 -68.91 -26.17 64.95 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.313 -0.555 . . . . 36.47 111.374 175.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.35 -38.3 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 122.442 0.297 . . . . 24.78 111.615 177.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . 0.525 ' HB3' HD13 ' A' ' 89' ' ' LEU . 2.4 mt -69.16 -12.44 61.68 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.28 0.845 . . . . 28.19 113.28 -179.325 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -71.73 -23.76 61.67 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.024 0.75 . . . . 34.24 113.024 -173.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -98.11 5.9 48.13 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 113.647 0.98 . . . . 32.68 113.647 -176.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -122.6 5.3 9.53 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.766 0.712 . . . . 40.55 112.717 -177.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' VAL . . . . . 0.63 HG11 ' SD ' ' A' ' 120' ' ' MET . 66.6 t -102.08 136.67 33.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 118.427 0.558 . . . . 45.64 109.889 -174.235 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.7 p -87.74 160.61 18.01 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.649 0.738 . . . . 36.53 110.642 174.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -61.79 -28.98 69.84 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.363 -0.835 . . . . 44.15 111.784 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 31.7 ttm-85 -62.16 -40.29 95.49 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.856 -0.338 . . . . 54.7 111.164 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . 0.58 HD23 HG13 ' A' ' 115' ' ' VAL . 41.6 tp -69.72 -41.15 75.7 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.396 -0.521 . . . . 27.22 111.344 -176.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' MET . . . . . 0.63 ' SD ' HG11 ' A' ' 115' ' ' VAL . 32.3 mmm -64.46 -29.07 70.12 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.086 -0.646 . . . . 36.38 111.731 175.811 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.27 -48.4 73.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.239 -0.585 . . . . 31.04 110.871 178.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ARG . . . . . 0.687 ' NH2' ' O ' ' A' ' 402' ' ' HOH . 0.9 OUTLIER -71.58 -32.47 68.11 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.051 -0.66 . . . . 47.25 111.635 177.694 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 22.1 mt -62.7 -48.67 87.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 121.187 0.518 . . . . 27.32 110.022 172.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASP . . . . . 0.401 ' OD1' ' HA ' ' A' ' 129' ' ' PHE . 30.3 t0 -61.42 -42.21 98.39 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 122.042 -0.411 . . . . 39.09 111.161 178.523 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.33 80.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.508 -0.477 . . . . 29.14 111.473 -177.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -70.07 -34.56 73.35 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.086 -0.646 . . . . 29.69 111.587 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 82.2 mt -74.28 -2.55 25.49 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 113.039 0.755 . . . . 33.82 113.039 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 76.25 24.81 67.59 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.914 -0.66 . . . . 43.99 114.604 -176.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' PHE . . . . . 0.401 ' HA ' ' OD1' ' A' ' 124' ' ' ASP . 16.6 m-85 56.01 71.38 1.23 Allowed Pre-proline 0 C--O 1.238 0.477 0 C-N-CA 124.372 1.069 . . . . 53.36 110.293 -177.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -76.78 151.5 31.8 Favored 'Trans proline' 0 C--N 1.329 -0.449 0 CA-C-O 121.912 0.713 . . . . 48.67 111.216 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -107.12 -10.55 15.85 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 114.976 -1.011 . . . . 59.71 113.537 -179.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ARG . . . . . 0.509 ' HD2' ' HA2' ' A' ' 136' ' ' GLY . 20.8 ptt180 -142.69 157.45 44.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.767 0.794 . . . . 53.73 110.281 -176.754 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ASP . . . . . 0.567 ' HB3' ' H ' ' A' ' 135' ' ' HIS . 2.8 m-20 -70.34 175.93 2.19 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 126.171 1.789 . . . . 55.56 112.17 -176.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.5 -19.37 67.44 Favored 'Trans proline' 0 C--O 1.237 0.43 0 CA-C-N 118.302 0.429 . . . . 50.65 112.344 157.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HIS . . . . . 0.567 ' H ' ' HB3' ' A' ' 133' ' ' ASP . 8.2 m170 -97.97 0.18 45.92 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.735 0.814 . . . . 47.67 112.801 175.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLY . . . . . 0.509 ' HA2' ' HD2' ' A' ' 132' ' ' ARG . . . 83.62 1.04 90.12 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-O 119.045 -0.864 . . . . 45.84 114.711 -174.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ASP . . . . . 0.436 ' H ' ' HB2' ' A' ' 133' ' ' ASP . 89.2 m-20 -59.91 128.13 86.49 Favored Pre-proline 0 C--O 1.239 0.504 0 CA-C-N 118.216 1.008 . . . . 46.62 109.502 176.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.76 135.72 36.48 Favored 'Trans proline' 0 C--N 1.332 -0.34 0 CA-C-N 118.969 0.668 . . . . 42.71 111.698 -176.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ILE . . . . . 0.461 HD13 HD23 ' A' ' 88' ' ' LEU . 51.2 mt -93.13 112.68 57.29 Favored Pre-proline 0 C--O 1.245 0.824 0 N-CA-C 107.734 -1.21 . . . . 46.05 107.734 179.335 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PRO . . . . . 0.62 ' HB3' HG22 ' A' ' 146' ' ' VAL . 15.3 Cg_endo -62.34 137.63 66.56 Favored 'Trans proline' 0 C--N 1.331 -0.344 0 CA-C-N 119.43 0.832 . . . . 51.53 111.152 178.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -66.19 163.38 42.06 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.306 -0.95 . . . . 68.7 112.149 175.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.11 -39.93 87.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.331 -0.548 . . . . 78.42 110.976 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -34.36 74.06 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 111.77 0.285 . . . . 97.97 111.77 172.485 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 105.04 40.63 2.08 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 114.563 0.585 . . . . 93.4 114.563 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -84.78 -47.46 10.38 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.05 0.425 . . . . 92.25 112.006 -177.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' VAL . . . . . 0.62 HG22 ' HB3' ' A' ' 140' ' ' PRO . 86.4 t 71.27 116.74 0.03 OUTLIER Pre-proline 0 C--O 1.239 0.533 0 C-N-CA 125.628 1.571 . . . . 55.33 109.512 -171.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -96.85 78.37 0.09 OUTLIER 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 120.386 0.724 . . . . 44.01 112.651 175.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' THR . . . . . 0.53 ' OG1' ' O ' ' A' ' 401' ' ' HOH . 26.1 m -77.35 128.48 80.29 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 110.039 -0.356 . . . . 47.98 110.039 -178.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -79.88 152.72 22.21 Favored 'Trans proline' 0 C--O 1.241 0.648 0 C-N-CA 120.484 0.789 . . . . 61.07 110.813 175.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -82.56 94.35 0.87 Allowed 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 120.145 0.563 . . . . 69.39 112.349 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -140.1 161.93 36.45 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.666 0.746 . . . . 53.04 110.532 -170.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' ARG . . . . . 0.406 ' NH1' ' OG ' ' A' ' 228' ' ' SER . 0.1 OUTLIER -139.92 164.85 28.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.927 -1.033 . . . . 64.99 108.601 171.491 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -65.37 149.56 49.79 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.534 -0.757 . . . . 34.51 111.066 -177.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' LEU . . . . . 0.611 HD21 HG11 ' A' ' 204' ' ' VAL . 21.3 tp -61.32 -40.72 95.24 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.505 -0.77 . . . . 34.67 111.201 176.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -59.87 -31.33 69.68 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.872 -0.331 . . . . 40.16 111.66 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -76.3 -7.98 56.1 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 113.085 0.772 . . . . 42.62 113.085 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' CYS . . . . . . . . . . . . . 71.2 m -99.27 157.32 16.47 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.811 0.815 . . . . 50.88 110.111 177.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -110.39 174.54 5.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.783 0.801 . . . . 78.8 110.917 177.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -61.86 138.93 58.4 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 114.802 -1.09 . . . . 81.2 111.101 -172.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.31 -23.03 31.78 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 114.963 0.745 . . . . 71.1 114.963 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -66.59 151.93 46.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 118.141 0.971 . . . . 57.73 110.833 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 42.9 p -123.76 173.84 7.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.382 -0.826 . . . . 52.19 109.139 175.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . 170.23 165.17 27.16 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 119.87 -1.157 . . . . 44.5 114.948 177.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.5 m -105.46 128.75 53.71 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.456 0.702 . . . . 40.57 109.247 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 98.1 t -61.86 125.25 17.83 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 109.064 -0.717 . . . . 31.37 109.064 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -117.6 -25.88 6.77 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 114.29 1.218 . . . . 30.54 114.29 -175.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -158.81 134.37 8.69 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.512 -0.921 . . . . 35.18 108.512 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 17.8 mt -124.71 129.64 73.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.402 -0.962 . . . . 27.94 108.402 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 38.2 t -62.66 148.21 47.1 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.496 0.665 . . . . 40.91 110.624 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 38.6 p-10 -114.66 19.72 15.82 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.654 -0.703 . . . . 31.69 112.202 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.12 -28.12 69.21 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.215 -0.594 . . . . 29.47 111.728 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -123.68 107.62 31.39 Favored Pre-proline 0 C--O 1.246 0.875 0 N-CA-C 108.818 -0.808 . . . . 49.62 108.818 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -66.63 -27.47 45.39 Favored 'Trans proline' 0 C--O 1.238 0.495 0 CA-C-N 119.35 0.803 . . . . 24.66 112.816 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -59.18 -40.25 85.07 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.559 -0.456 . . . . 31.56 111.098 175.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' MET . . . . . . . . . . . . . 2.0 ttm -68.14 -34.31 76.12 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.645 -0.422 . . . . 48.76 111.75 -177.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 16.6 mt -65.19 -38.34 90.2 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.104 -0.638 . . . . 45.75 110.781 173.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -62.04 -45.82 91.89 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.0 0.429 . . . . 46.6 110.643 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -60.73 -42.38 97.22 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.65 -0.25 . . . . 37.39 111.183 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -63.01 -43.1 99.7 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.475 -0.49 . . . . 25.18 111.367 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -65.4 -32.66 74.4 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.756 -0.377 . . . . 28.29 111.813 -179.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 92.5 p -72.78 -31.02 64.56 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.302 -0.559 . . . . 34.38 112.031 -176.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 10.9 pt -92.4 -26.68 4.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 120.312 -0.555 . . . . 41.13 112.109 -179.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 120.84 20.32 3.47 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 115.384 0.914 . . . . 32.41 115.384 173.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' ILE . . . . . . . . . . . . . 11.7 mt -97.25 94.33 3.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 106.327 -1.731 . . . . 46.94 106.327 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' SER . . . . . 0.488 ' O ' ' OG ' ' A' ' 188' ' ' SER . 1.5 m -109.9 177.61 4.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.595 0.712 . . . . 55.04 109.151 175.103 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 186' ' ' LEU . . . . . . . . . . . . . 78.0 mt -66.86 142.11 57.43 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 119.9 -0.72 . . . . 51.29 109.444 170.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 77.63 3.64 3.03 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 127.376 2.271 . . . . 55.84 112.593 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' SER . . . . . 0.488 ' OG ' ' O ' ' A' ' 185' ' ' SER . 2.1 p -79.79 137.38 36.97 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.543 1.065 . . . . 46.68 110.064 174.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 189' ' ' ARG . . . . . 0.758 ' NH1' ' OD2' ' A' ' 207' ' ' ASP . 3.8 mtp-105 -93.85 134.76 35.87 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.047 -0.524 . . . . 74.64 110.581 -176.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 6.8 mt -121.32 157.48 30.31 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.371 0.669 . . . . 44.33 110.255 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -132.79 136.12 46.11 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.684 -0.858 . . . . 81.5 108.684 161.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 98.0 t -79.24 128.36 38.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 109.204 -0.665 . . . . 37.0 109.204 175.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 44.2 mt -99.11 -51.92 3.69 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.47 0.544 . . . . 48.89 112.47 -179.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -145.21 105.36 4.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.611 -0.885 . . . . 45.73 108.611 -177.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 195' ' ' ARG . . . . . . . . . . . . . 68.9 ttt-85 -96.61 107.16 19.55 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.246 -1.02 . . . . 50.11 108.246 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' ARG . . . . . . . . . . . . . 57.3 mtm-85 -103.52 92.76 4.6 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.41 -1.329 . . . . 54.14 107.41 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -56.3 -33.69 65.78 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.82 -0.627 . . . . 84.1 111.441 -177.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' PHE . . . . . 0.408 ' HA ' ' HA ' ' A' ' 199' ' ' ALA . 5.5 t80 -110.94 118.52 36.3 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 105.905 -1.887 . . . . 68.26 105.905 164.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 199' ' ' ALA . . . . . 0.408 ' HA ' ' HA ' ' A' ' 198' ' ' PHE . . . -121.53 78.24 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.703 0.631 . . . . 76.65 112.703 7.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . 67.29 51.04 40.53 Favored Glycine 0 C--N 1.332 0.338 0 N-CA-C 115.023 0.769 . . . . 76.93 115.023 174.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' MET . . . . . . . . . . . . . 4.6 mmt -140.13 140.68 36.05 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.332 -0.618 . . . . 68.97 109.332 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ILE . . . . . . . . . . . . . 12.7 tt -142.1 131.13 22.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 108.408 -0.96 . . . . 50.09 108.408 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 9.6 t -103.63 124.34 48.65 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.061 -0.718 . . . . 46.54 109.061 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' VAL . . . . . 0.611 HG11 HD21 ' A' ' 154' ' ' LEU . 4.3 m -124.6 160.03 29.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.89 0.852 . . . . 41.12 109.169 -179.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -117.08 114.19 23.38 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.131 -1.063 . . . . 49.2 108.131 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 206' ' ' ILE . . . . . . . . . . . . . 8.9 mm -78.18 124.67 36.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 108.497 -0.927 . . . . 55.57 108.497 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ASP . . . . . 0.758 ' OD2' ' NH1' ' A' ' 189' ' ' ARG . 52.5 t0 -78.66 95.2 5.2 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.941 -1.133 . . . . 75.75 107.941 176.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 85.3 p -130.69 -178.91 5.0 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.025 -0.732 . . . . 106.08 109.025 -178.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 209' ' ' ALA . . . . . . . . . . . . . . . -56.21 -64.75 0.76 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.615 -0.721 . . . . 125.58 110.78 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 210' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -78.24 -6.99 56.59 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.834 0.679 . . . . 144.97 112.834 174.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 211' ' ' GLY . . . . . . . . . . . . . . . 56.17 79.37 0.09 OUTLIER Glycine 0 C--N 1.334 0.429 0 N-CA-C 114.646 0.618 . . . . 123.21 114.646 175.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -92.11 174.38 7.34 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.973 0.892 . . . . 83.21 110.719 -176.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 5.1 m -132.37 130.7 41.05 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.65 -0.87 . . . . 50.24 108.65 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 11.4 m -127.97 158.76 39.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.815 0.817 . . . . 48.72 109.845 -177.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 215' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -118.49 103.49 9.79 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.145 -1.057 . . . . 67.86 108.145 -179.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 216' ' ' LEU . . . . . . . . . . . . . 19.9 mt -90.85 132.81 35.67 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.65 0.262 . . . . 51.51 110.571 -178.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -72.15 171.47 48.53 Favored Glycine 0 N--CA 1.444 -0.773 0 CA-C-O 122.49 1.05 . . . . 46.0 111.578 171.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 30.4 t -57.83 -43.31 98.55 Favored Pre-proline 0 C--O 1.244 0.805 0 N-CA-C 114.144 1.164 . . . . 38.86 114.144 -177.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 219' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -66.03 -36.31 30.52 Favored 'Trans proline' 0 C--O 1.238 0.481 0 CA-C-N 121.633 1.619 . . . . 35.35 113.295 -179.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 220' ' ' ALA . . . . . . . . . . . . . . . -66.24 -38.47 87.98 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.284 -0.566 . . . . 35.88 111.338 -179.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -71.11 -26.99 63.27 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.322 -0.551 . . . . 39.32 111.832 -179.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.17 -0.37 24.79 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.63 0.604 . . . . 41.89 112.63 176.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 223' ' ' ALA . . . . . . . . . . . . . . . -108.03 -7.91 16.01 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.383 0.883 . . . . 33.57 113.383 177.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 39.2 mt -106.0 109.49 28.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 108.212 -1.033 . . . . 33.37 108.212 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 225' ' ' TRP . . . . . . . . . . . . . 7.0 m-90 -91.62 136.36 33.19 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 109.454 -0.573 . . . . 33.09 109.454 171.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 226' ' ' VAL . . . . . . . . . . . . . 1.4 p -130.5 151.01 35.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.335 0.588 . . . . 34.32 109.882 -167.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 38.9 t -115.71 117.11 54.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 N-CA-C 108.298 -1.001 . . . . 60.39 108.298 179.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 228' ' ' SER . . . . . 0.406 ' OG ' ' NH1' ' A' ' 152' ' ' ARG . 58.5 m -78.36 95.89 5.18 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 124.177 0.923 . . . . 81.33 110.924 -177.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 229' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 229' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 O-C-N 124.673 1.233 . . . . 86.03 109.344 179.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' VAL . . . . . 0.547 ' N ' ' HB2' ' B' ' 16' ' ' ASP . 1.3 m . . . . . 0 CA--C 1.533 0.305 0 N-CA-C 111.976 0.362 . . . . 63.58 111.976 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ALA . . . . . 0.767 ' HB1' HD11 ' B' ' 55' ' ' LEU . . . -98.45 -4.51 34.38 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.575 0.75 . . . . 58.93 109.571 -2.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -74.81 -28.63 60.79 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.312 -0.858 . . . . 52.98 111.705 -179.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ASP . . . . . 0.547 ' HB2' ' N ' ' B' ' 13' ' ' VAL . 13.6 m-20 -62.73 -36.91 84.52 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.476 -0.489 . . . . 50.68 111.476 172.802 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' TYR . . . . . 0.485 ' O ' ' N ' ' B' ' 20' ' ' VAL . 22.4 m-85 -56.55 -75.62 0.04 OUTLIER 'General case' 0 C--O 1.235 0.319 0 C-N-CA 119.933 -0.707 . . . . 67.26 110.002 175.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 70.5 mt -40.58 -41.2 1.42 Allowed 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.846 0.684 . . . . 58.68 112.846 -177.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -61.22 -37.42 82.94 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.5 -0.48 . . . . 46.51 111.275 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . 0.485 ' N ' ' O ' ' B' ' 17' ' ' TYR . 17.0 t -74.23 -42.47 51.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 120.292 -0.563 . . . . 44.05 110.988 -176.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ILE . . . . . 0.44 ' O ' ' HG2' ' B' ' 25' ' ' GLN . 5.0 mp -55.52 -41.89 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 119.331 -0.948 . . . . 41.86 111.294 177.315 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' TRP . . . . . . . . . . . . . 87.7 t90 -70.69 -43.43 69.06 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 118.429 -1.308 . . . . 38.14 111.722 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 39.5 p -66.52 -24.02 66.32 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.477 -0.489 . . . . 41.4 112.224 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.03 -40.78 68.16 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.215 -0.594 . . . . 44.73 111.291 178.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' B' ' 21' ' ' ILE . 3.9 pt20 -90.14 20.11 4.56 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.596 0.591 . . . . 60.24 112.596 179.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -83.83 -32.31 25.35 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.431 -0.508 . . . . 40.53 111.973 -178.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -122.46 -1.05 9.14 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 113.529 0.936 . . . . 54.32 113.529 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 4.5 p -145.6 170.29 16.74 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.789 -0.819 . . . . 69.71 108.789 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -110.65 0.25 17.44 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.529 -0.76 . . . . 81.9 112.88 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -60.82 133.38 56.04 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.09 -0.707 . . . . 85.5 109.09 168.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' B' ' 31' ' ' LYS . 1.2 tptm -100.51 172.92 6.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 122.252 1.025 . . . . 95.77 111.831 -168.15 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' B' ' 68' ' ' ALA . 28.9 t -99.75 134.61 38.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 114.598 -1.183 . . . . 112.31 109.496 -165.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 43.4 m -117.45 152.03 35.85 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.24 -0.652 . . . . 117.19 109.24 172.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 61.2 m -48.66 -33.83 10.69 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.353 -0.839 . . . . 125.41 112.255 -177.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -72.74 -39.79 66.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.603 -0.439 . . . . 129.12 111.622 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' MET . . . . . . . . . . . . . 3.3 mtp -64.65 -29.55 70.55 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.21 -0.596 . . . . 120.99 111.813 -178.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LEU . . . . . 0.541 HD12 HD11 ' B' ' 52' ' ' ILE . 51.1 mt -65.93 -31.69 72.76 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.995 -0.682 . . . . 95.36 111.256 170.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ALA . . . . . 0.443 ' HB1' ' O ' ' B' ' 43' ' ' VAL . . . -76.42 -25.57 54.63 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.489 -0.485 . . . . 91.76 111.766 -178.427 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -85.63 -19.61 30.71 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.844 0.683 . . . . 101.26 112.844 177.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ARG . . . . . 0.474 ' NH1' ' O ' ' B' ' 401' ' ' HOH . 0.0 OUTLIER -90.83 -47.96 7.3 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 118.148 0.431 . . . . 112.97 111.125 176.108 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 6.8 mm -78.25 -53.01 14.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 120.931 0.396 . . . . 101.77 110.609 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 115.0 80.22 0.88 Allowed Glycine 0 N--CA 1.45 -0.406 0 O-C-N 121.872 -0.518 . . . . 102.14 113.518 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' VAL . . . . . 0.443 ' O ' ' HB1' ' B' ' 38' ' ' ALA . 2.3 p -162.68 175.31 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.558 -0.904 . . . . 97.26 108.558 -179.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 24.1 p -83.21 157.49 22.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.703 0.763 . . . . 96.61 110.622 178.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.7 -25.88 68.39 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.419 -0.809 . . . . 97.44 111.441 176.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.9 t -64.82 -62.42 1.58 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.01 0.433 . . . . 100.49 111.029 175.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.5 m -64.28 -28.61 69.84 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.215 -0.303 . . . . 102.74 111.693 -177.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.73 81.32 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.851 -0.34 . . . . 101.47 111.716 -176.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 26.5 t -72.09 -33.98 68.3 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.908 -0.717 . . . . 102.73 111.705 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.08 -32.13 72.25 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.449 -0.5 . . . . 116.56 111.485 178.917 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' SER . . . . . 0.463 ' O ' HD13 ' B' ' 55' ' ' LEU . 50.0 m -74.35 -28.93 61.35 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.097 -0.641 . . . . 99.41 111.446 174.212 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ILE . . . . . 0.541 HD11 HD12 ' B' ' 37' ' ' LEU . 3.2 mt -73.09 -36.56 50.88 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 120.731 -0.388 . . . . 83.35 110.577 176.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -35.52 78.73 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.974 -0.454 . . . . 96.55 112.011 -173.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -27.2 49.83 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.235 -0.986 . . . . 89.31 111.643 -176.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' LEU . . . . . 0.767 HD11 ' HB1' ' B' ' 14' ' ' ALA . 9.3 mp -71.52 -28.43 63.88 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.327 -0.549 . . . . 82.96 111.237 169.251 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.72 -27.4 31.19 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.853 -0.339 . . . . 85.99 111.753 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -74.34 -14.19 60.85 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.296 0.48 . . . . 84.94 112.296 175.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -94.0 -9.77 35.79 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.449 0.907 . . . . 79.87 113.449 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.02 16.79 64.36 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.777 -0.725 . . . . 70.96 114.335 -173.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 68.4 mt -93.71 -12.28 29.6 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 117.887 0.843 . . . . 66.92 112.849 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' VAL . . . . . . . . . . . . . 7.1 p -166.31 145.96 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 108.72 -0.844 . . . . 77.06 108.72 -177.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.729 0.3 . . . . 79.56 110.785 177.262 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ALA . . . . . 0.61 ' N ' ' O ' ' B' ' 32' ' ' VAL . . . . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.667 0.27 . . . . 96.94 111.08 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 98.2 t -82.06 -73.48 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 109.386 -0.598 . . . . 105.56 109.386 -177.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' THR . . . . . . . . . . . . . 5.7 m 63.28 111.95 0.02 OUTLIER 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.591 1.157 . . . . 91.08 112.26 176.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' LEU . . . . . 0.531 HD13 ' HB2' ' B' ' 76' ' ' ARG . 1.1 pp -89.35 161.87 16.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.752 0.787 . . . . 79.19 111.43 -177.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 2.7 p -97.06 -172.88 2.54 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.235 -0.893 . . . . 72.04 110.015 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -64.76 -49.35 71.12 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.171 -0.468 . . . . 65.15 111.227 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 67.8 p -66.98 -23.72 65.97 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.524 -0.47 . . . . 63.12 112.107 177.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.04 -42.0 11.48 Favored Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 118.032 0.378 . . . . 54.7 112.7 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ARG . . . . . 0.531 ' HB2' HD13 ' B' ' 71' ' ' LEU . 7.8 ttm-85 -57.6 -35.39 70.37 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.428 -0.509 . . . . 50.29 110.93 173.459 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -67.81 -44.68 76.73 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.446 -0.502 . . . . 57.42 111.307 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.62 -41.01 89.04 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.264 -0.575 . . . . 41.22 111.24 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.55 95.54 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.441 -0.503 . . . . 33.25 111.111 178.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.9 mt -63.16 -31.38 72.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.556 -0.458 . . . . 25.95 111.565 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.15 -40.82 71.12 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.205 -0.598 . . . . 21.83 111.1 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' MET . . . . . 0.504 ' SD ' ' NH1' ' B' ' 85' ' ' ARG . 77.4 mmm -65.34 -43.04 92.14 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.494 -0.483 . . . . 29.82 111.148 176.685 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' VAL . . . . . . . . . . . . . 73.8 t -60.86 -40.74 86.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-O 121.014 0.435 . . . . 21.79 110.297 176.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 27.0 ttt85 -64.68 -41.75 95.83 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.406 -0.517 . . . . 29.86 111.16 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ARG . . . . . 0.504 ' NH1' ' SD ' ' B' ' 82' ' ' MET . 62.8 mtt180 -63.48 -44.07 95.46 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.475 -0.49 . . . . 43.12 111.238 178.499 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -61.36 -47.25 86.71 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.798 -0.361 . . . . 26.63 111.304 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -77.82 -28.29 50.25 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.316 0.488 . . . . 28.78 112.316 -173.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.1 mt -65.74 -38.75 89.99 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.727 -0.789 . . . . 19.85 110.826 170.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 16.9 mt -64.38 -46.4 83.49 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.679 -0.408 . . . . 24.26 110.898 177.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -56.64 -38.15 71.74 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.942 -0.303 . . . . 41.24 111.168 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 6.3 m -73.22 -40.7 64.5 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.267 -0.573 . . . . 29.65 111.282 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -63.49 -40.19 96.42 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.209 -0.597 . . . . 31.45 111.188 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' LEU . . . . . 0.412 HD23 HD12 ' B' ' 97' ' ' LEU . 95.0 mt -61.65 -47.73 84.05 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.716 -0.394 . . . . 34.09 111.263 -178.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' VAL . . . . . 0.558 HG23 HG11 ' B' ' 104' ' ' VAL . 3.7 t -69.0 -47.33 76.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 120.454 -0.499 . . . . 36.96 110.534 -178.127 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -76.55 -30.07 56.93 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 112.942 0.719 . . . . 35.15 112.942 -169.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -110.78 -33.22 6.6 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 114.387 1.255 . . . . 42.72 114.387 -172.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LEU . . . . . 0.412 HD12 HD23 ' B' ' 93' ' ' LEU . 9.2 mt -115.38 18.97 15.8 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.893 0.701 . . . . 37.95 112.893 -172.829 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . 69.73 19.99 75.45 Favored Glycine 0 N--CA 1.449 -0.433 0 N-CA-C 115.94 1.136 . . . . 39.64 115.94 171.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -74.33 149.67 40.51 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.357 1.079 . . . . 33.55 110.785 175.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 62.4 mtm-85 -85.94 161.2 19.14 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.577 -0.738 . . . . 60.6 109.494 167.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -69.73 -18.01 63.49 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 119.206 -0.997 . . . . 40.14 112.695 -173.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -90.68 -2.28 57.84 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.969 0.729 . . . . 32.44 112.969 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -101.98 -12.97 17.78 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.242 0.83 . . . . 42.15 113.242 178.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' VAL . . . . . 0.558 HG11 HG23 ' B' ' 94' ' ' VAL . 30.0 m -83.98 -30.19 7.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 113.287 0.847 . . . . 29.0 113.287 -166.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -62.89 -56.32 18.31 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.091 -0.643 . . . . 31.95 111.674 -169.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -61.71 -34.83 76.48 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.417 -0.513 . . . . 57.69 111.82 -175.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.7 -46.77 29.35 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.274 -0.57 . . . . 45.93 111.177 178.069 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.77 -19.93 66.08 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 120.478 -0.489 . . . . 32.61 112.216 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -65.41 -19.15 65.82 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 117.989 0.359 . . . . 46.7 111.657 172.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' VAL . . . . . . . . . . . . . 59.4 t -100.97 -42.98 10.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 122.591 0.356 . . . . 29.73 111.874 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.37 -27.4 69.04 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.492 -0.483 . . . . 30.31 112.203 -179.478 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -62.0 -15.22 42.38 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 113.106 0.78 . . . . 37.89 113.106 -170.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -96.94 -14.29 21.83 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 113.452 0.908 . . . . 42.63 113.452 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -123.17 39.76 3.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 118.522 0.601 . . . . 29.99 111.305 -176.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' VAL . . . . . 0.728 HG13 HD23 ' B' ' 119' ' ' LEU . 54.5 t -125.5 138.55 54.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.9 -0.778 . . . . 31.95 108.9 178.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 24.8 p -89.06 156.96 18.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.693 0.759 . . . . 20.39 110.716 179.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.9 -24.73 65.25 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.359 -0.837 . . . . 27.7 111.645 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -69.52 -40.31 77.0 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 119.577 -0.849 . . . . 20.49 110.716 173.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' LEU . . . . . 0.728 HD23 HG13 ' B' ' 115' ' ' VAL . 26.6 tp -67.59 -39.41 84.83 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.402 -0.519 . . . . 20.38 111.119 179.085 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 2.1 mmt -60.81 -41.26 95.32 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.323 -0.551 . . . . 38.19 111.461 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.42 83.78 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.464 -0.494 . . . . 22.7 111.495 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.49 -36.87 57.58 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.259 -0.577 . . . . 26.97 111.402 178.34 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 68.6 mt -58.56 -47.61 87.99 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.278 0.561 . . . . 26.8 109.881 168.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' ASP . . . . . 0.464 ' OD1' ' HA ' ' B' ' 129' ' ' PHE . 66.4 t0 -58.86 -43.71 90.89 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.474 -0.33 . . . . 33.76 110.9 -179.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.87 -33.93 68.8 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.353 -0.539 . . . . 20.2 111.931 -178.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -71.19 -30.85 66.91 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.924 -0.71 . . . . 34.61 111.443 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.3 mt -79.25 -3.49 46.16 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.963 0.727 . . . . 25.14 112.963 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 89.07 15.21 59.47 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-O 119.029 -0.873 . . . . 19.78 115.192 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' PHE . . . . . 0.464 ' HA ' ' OD1' ' B' ' 124' ' ' ASP . 50.1 m-85 63.95 61.97 1.56 Allowed Pre-proline 0 C--O 1.238 0.458 0 C-N-CA 125.359 1.464 . . . . 36.95 110.071 -176.347 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.79 148.52 36.43 Favored 'Trans proline' 0 C--N 1.33 -0.4 0 CA-C-O 121.896 0.707 . . . . 39.39 112.774 -172.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -92.11 -31.7 15.42 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.009 -0.996 . . . . 51.21 112.907 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ARG . . . . . 0.64 ' HD3' ' HA2' ' B' ' 136' ' ' GLY . 0.5 OUTLIER -122.02 149.55 43.34 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.28 0.562 . . . . 47.72 110.33 -179.666 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -90.35 179.94 1.36 Allowed Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 123.892 0.877 . . . . 43.05 109.15 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -57.96 -19.33 39.52 Favored 'Trans proline' 0 C--O 1.237 0.439 0 CA-C-N 120.35 1.161 . . . . 41.31 114.509 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -99.1 7.48 45.83 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.669 0.668 . . . . 43.66 112.727 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' GLY . . . . . 0.64 ' HA2' ' HD3' ' B' ' 132' ' ' ARG . . . 75.36 3.86 72.25 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.168 -1.015 . . . . 41.53 114.376 -172.418 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 137' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -68.05 134.02 91.77 Favored Pre-proline 0 C--O 1.238 0.454 0 CA-C-N 117.92 0.86 . . . . 45.37 109.364 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -68.78 133.78 28.32 Favored 'Trans proline' 0 C--N 1.332 -0.312 0 C-N-CA 120.243 0.629 . . . . 47.02 111.329 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 75.2 mt -93.06 114.81 63.76 Favored Pre-proline 0 C--O 1.242 0.692 0 N-CA-C 107.629 -1.248 . . . . 38.26 107.629 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.79 152.57 80.01 Favored 'Trans proline' 0 C--N 1.332 -0.292 0 CA-C-N 119.286 0.781 . . . . 29.38 111.612 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' GLY . . . . . . . . . . . . . . . -77.6 168.84 54.55 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.412 -0.813 . . . . 38.94 111.886 173.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -61.85 -26.73 68.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.175 -0.512 . . . . 40.46 111.888 -177.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -98.21 5.25 48.64 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.492 0.553 . . . . 53.62 112.492 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' GLY . . . . . . . . . . . . . . . 87.36 37.08 8.37 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 118.001 0.364 . . . . 41.61 113.754 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -99.13 93.78 6.15 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.438 -1.319 . . . . 38.37 107.438 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 22.9 t -79.17 118.81 74.55 Favored Pre-proline 0 C--O 1.24 0.581 0 CA-C-N 115.94 -0.573 . . . . 30.68 110.037 -175.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -87.58 71.7 3.05 Favored 'Trans proline' 0 N--CA 1.481 0.793 0 C-N-CA 121.459 1.439 . . . . 24.22 112.448 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 53.5 m -67.78 126.24 92.35 Favored Pre-proline 0 C--O 1.238 0.46 0 CA-C-N 115.798 -0.637 . . . . 28.41 110.29 -177.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -83.16 147.42 12.95 Favored 'Trans proline' 0 C--O 1.24 0.612 0 C-N-CA 120.586 0.857 . . . . 36.99 110.815 176.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -80.76 88.14 1.43 Allowed 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 120.062 0.508 . . . . 46.45 112.235 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' ALA . . . . . 0.449 ' HB1' ' HB3' ' B' ' 225' ' ' TRP . . . -130.12 153.43 48.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.383 0.611 . . . . 58.24 110.886 -171.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 152' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -132.47 160.25 36.99 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.054 -0.976 . . . . 87.43 108.854 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -62.17 143.73 56.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.812 -0.631 . . . . 51.05 110.643 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' LEU . . . . . . . . . . . . . 23.9 tp -66.3 -34.43 77.97 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.879 -0.601 . . . . 54.09 111.39 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -63.15 -11.54 21.18 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.585 0.587 . . . . 83.98 112.585 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -92.47 -3.7 54.77 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 113.05 0.759 . . . . 70.57 113.05 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' CYS . . . . . . . . . . . . . 69.0 m -80.48 173.39 12.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 122.012 0.911 . . . . 75.67 110.752 -178.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' ARG . . . . . 0.411 ' HA ' ' HD3' ' B' ' 158' ' ' ARG . 1.2 mmt85 -134.76 146.38 49.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.231 -0.895 . . . . 90.67 109.394 179.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 159' ' ' ASP . . . . . 0.558 ' HB3' ' H ' ' B' ' 194' ' ' ALA . 4.3 p-10 -70.78 117.06 11.82 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.021 -0.536 . . . . 120.01 110.018 179.467 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 160' ' ' GLY . . . . . . . . . . . . . . . -137.78 95.24 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 115.639 1.016 . . . . 100.54 115.639 2.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 161' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -78.45 167.71 20.89 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.873 0.844 . . . . 74.42 110.133 173.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' THR . . . . . . . . . . . . . 1.7 p -110.32 -177.43 3.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.398 -0.819 . . . . 52.32 109.248 174.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 152.26 133.51 1.96 Allowed Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 116.518 1.367 . . . . 44.66 116.518 176.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 164' ' ' THR . . . . . . . . . . . . . 1.7 p -76.43 145.68 39.14 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.435 0.636 . . . . 38.33 110.531 174.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' VAL . . . . . 0.45 ' HA ' HG12 ' B' ' 226' ' ' VAL . 1.6 m -76.98 125.46 36.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 108.906 -0.775 . . . . 36.67 108.906 179.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 166' ' ' ALA . . . . . 0.414 ' HB2' HG23 ' B' ' 227' ' ' VAL . . . -99.22 -59.17 1.78 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.25 -0.432 . . . . 28.41 111.696 -179.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -128.21 143.16 51.02 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 109.428 -0.582 . . . . 31.39 109.428 -176.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 96.7 mt -125.85 130.8 72.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 107.909 -1.145 . . . . 33.04 107.909 175.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 7.4 t -63.0 151.03 40.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.577 0.703 . . . . 42.26 110.932 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -121.77 12.95 10.68 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.609 -0.723 . . . . 42.24 112.941 -178.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -62.48 -16.72 57.04 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.478 0.548 . . . . 42.82 112.478 -178.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 172' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -140.92 115.79 7.29 Favored Pre-proline 0 C--O 1.238 0.471 0 CA-C-N 118.183 0.447 . . . . 55.21 110.174 179.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 173' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -65.15 -16.56 55.59 Favored 'Trans proline' 0 C--O 1.237 0.452 0 CA-C-N 118.553 0.519 . . . . 36.15 113.113 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -65.79 -34.08 77.34 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 118.084 0.402 . . . . 46.87 111.53 174.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 175' ' ' MET . . . . . . . . . . . . . 30.4 tpp -75.16 -40.97 59.1 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 121.024 -0.27 . . . . 37.93 111.638 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 176' ' ' LEU . . . . . . . . . . . . . 67.9 mt -65.38 -44.67 86.85 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.386 -0.525 . . . . 33.3 111.044 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 -57.04 -39.12 74.22 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.6 -0.44 . . . . 48.58 110.959 174.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 178' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -68.41 -46.98 68.49 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.864 -0.335 . . . . 51.14 111.038 178.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 5.5 m-30 -59.66 -39.61 85.01 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.499 -0.48 . . . . 37.76 111.294 -176.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -68.53 -25.81 65.12 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.347 -0.541 . . . . 39.34 111.818 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 83.4 p -70.18 -40.88 74.41 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.434 -0.506 . . . . 45.64 111.54 -176.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 182' ' ' ILE . . . . . 0.505 HD12 HG11 ' B' ' 214' ' ' VAL . 5.0 pt -81.66 -31.6 11.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 120.189 -0.605 . . . . 49.7 111.513 -177.09 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 125.97 20.66 2.03 Favored Glycine 0 N--CA 1.449 -0.467 0 O-C-N 121.722 -0.611 . . . . 46.44 113.654 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 184' ' ' ILE . . . . . . . . . . . . . 11.6 mm -96.11 122.09 47.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 108.396 -0.965 . . . . 42.98 108.396 179.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 185' ' ' SER . . . . . 0.55 ' O ' ' OG ' ' B' ' 188' ' ' SER . 2.1 p -159.81 158.19 30.61 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.911 -1.144 . . . . 41.85 107.911 178.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 8.4 mt -47.6 141.01 5.56 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.655 -0.702 . . . . 38.45 110.999 -178.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 187' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 86.18 -12.24 0.62 Allowed 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 128.768 2.827 . . . . 38.74 112.772 178.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 188' ' ' SER . . . . . 0.55 ' OG ' ' O ' ' B' ' 185' ' ' SER . 2.1 p -72.16 134.54 45.78 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 119.274 0.943 . . . . 39.38 110.099 179.728 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 189' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' B' ' 207' ' ' ASP . 22.8 mtp85 -86.32 136.09 33.28 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.655 -0.498 . . . . 71.74 109.655 -178.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 190' ' ' LEU . . . . . . . . . . . . . 45.1 mt -123.3 149.23 45.09 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.167 0.508 . . . . 45.94 110.509 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 191' ' ' ARG . . . . . . . . . . . . . 20.5 ttp-105 -133.13 128.99 37.3 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.637 -0.875 . . . . 61.54 108.637 175.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 47.5 t -88.17 133.68 30.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 109.275 -0.639 . . . . 55.41 109.275 -173.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 5.5 mt -135.86 76.58 1.62 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 106.952 -1.499 . . . . 68.06 106.952 178.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 194' ' ' ALA . . . . . 1.115 ' HA ' ' HB2' ' B' ' 195' ' ' ARG . . . 64.42 129.38 0.02 OUTLIER 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.236 1.014 . . . . 82.86 109.374 -166.243 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 195' ' ' ARG . . . . . 1.115 ' HB2' ' HA ' ' B' ' 194' ' ' ALA . 0.0 OUTLIER 78.75 56.77 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 118.209 -0.901 . . . . 83.8 109.678 6.529 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 196' ' ' ARG . . . . . 0.567 ' HG2' ' HB1' ' B' ' 194' ' ' ALA . 0.8 OUTLIER -131.81 79.35 1.87 Allowed 'General case' 0 N--CA 1.487 1.397 0 CA-C-O 117.886 -1.054 . . . . 75.15 108.542 178.961 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 197' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -60.1 -45.05 94.24 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 117.488 -1.244 . . . . 74.64 110.514 -178.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 198' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -51.61 -31.88 26.69 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 123.984 0.802 . . . . 72.29 109.563 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 199' ' ' ALA . . . . . . . . . . . . . . . -92.92 -5.46 50.76 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.09 0.869 . . . . 76.91 112.948 179.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 200' ' ' GLY . . . . . . . . . . . . . . . 64.17 32.43 84.18 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 121.206 -0.521 . . . . 77.02 114.251 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 201' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -156.62 165.0 37.53 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.83 -0.804 . . . . 82.68 108.83 -178.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 202' ' ' ILE . . . . . 0.416 ' O ' HG13 ' B' ' 202' ' ' ILE . 2.0 pt -131.74 141.35 45.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 108.676 -0.861 . . . . 66.77 108.676 172.562 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 1.1 t -98.21 138.0 36.13 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.285 -0.635 . . . . 59.86 109.285 177.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 204' ' ' VAL . . . . . . . . . . . . . 20.1 m -129.69 146.71 33.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.585 0.707 . . . . 57.9 109.406 179.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -97.39 141.72 30.13 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.134 -1.061 . . . . 66.28 108.134 164.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 206' ' ' ILE . . . . . 0.461 HG12 ' C ' ' B' ' 208' ' ' SER . 5.8 tt -117.79 120.38 64.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 108.142 -1.059 . . . . 94.64 108.142 -177.722 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 207' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' B' ' 207' ' ' ASP . 1.4 p30 -141.49 89.61 2.23 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 106.095 -1.817 . . . . 125.5 106.095 179.738 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 208' ' ' SER . . . . . 0.461 ' C ' HG12 ' B' ' 206' ' ' ILE . 18.8 p . . . . . 0 N--CA 1.473 0.715 0 N-CA-C 118.307 2.706 . . . . 103.61 118.307 14.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 211' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 N-CA-C 113.302 0.081 . . . . 78.67 113.302 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' ALA . . . . . . . . . . . . . . . -63.37 161.67 13.7 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 122.078 0.942 . . . . 95.31 111.215 -173.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 213' ' ' THR . . . . . . . . . . . . . 1.3 m -112.88 127.62 56.24 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.043 -0.98 . . . . 103.83 108.947 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 214' ' ' VAL . . . . . 0.505 HG11 HD12 ' B' ' 182' ' ' ILE . 71.7 t -132.09 137.87 53.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 108.493 -0.929 . . . . 79.87 108.493 -176.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 215' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -106.57 132.4 52.61 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.423 -0.584 . . . . 76.11 109.423 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 2.5 mp -122.89 129.85 52.13 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.27 -0.641 . . . . 50.22 109.27 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . -68.46 163.62 48.95 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.276 -0.964 . . . . 45.76 112.054 173.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 218' ' ' SER . . . . . . . . . . . . . 47.0 t -52.79 -42.75 91.09 Favored Pre-proline 0 C--O 1.243 0.73 0 N-CA-C 114.006 1.113 . . . . 44.44 114.006 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 219' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -66.4 -31.52 42.61 Favored 'Trans proline' 0 C--O 1.237 0.474 0 CA-C-N 121.596 1.606 . . . . 50.53 113.29 176.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -71.45 -49.41 41.85 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.434 0.561 . . . . 48.52 111.207 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 221' ' ' ALA . . . . . . . . . . . . . . . -66.28 -19.77 65.91 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.432 0.53 . . . . 56.18 112.432 179.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 222' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -75.87 -9.82 58.92 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.907 0.706 . . . . 72.22 112.907 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 223' ' ' ALA . . . . . . . . . . . . . . . -109.45 29.09 7.88 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 118.39 0.541 . . . . 49.17 111.855 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 224' ' ' ILE . . . . . . . . . . . . . 19.4 mt -135.97 101.85 2.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 107.6 -1.259 . . . . 38.19 107.6 -177.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 225' ' ' TRP . . . . . 0.449 ' HB3' ' HB1' ' B' ' 151' ' ' ALA . 4.2 m-90 -89.03 141.95 28.05 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.713 -0.477 . . . . 39.11 109.713 172.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 226' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' B' ' 165' ' ' VAL . 3.0 m -136.81 157.61 36.29 Favored 'Isoleucine or valine' 0 C--O 1.231 0.102 0 CA-C-O 121.683 0.754 . . . . 32.6 110.45 -170.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 227' ' ' VAL . . . . . 0.414 HG23 ' HB2' ' B' ' 166' ' ' ALA . 76.7 t -115.94 116.01 51.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.127 -1.064 . . . . 44.98 108.127 -179.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 31.4 m -50.3 133.0 24.51 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.12 0.968 . . . . 52.56 112.872 -174.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 116.986 -1.483 . . . . 60.22 109.721 179.232 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 401' ' ' HOH . . . . . 0.53 ' O ' ' OG1' ' A' ' 148' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . 0.687 ' O ' ' NH2' ' A' ' 122' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' HOH . . . . . 0.416 ' O ' ' N ' ' A' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 401' ' ' HOH . . . . . 0.474 ' O ' ' NH1' ' B' ' 40' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.503 HG23 ' HB2' ' A' ' 16' ' ' ASP . 1.2 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.988 0.423 . . . . 68.11 110.371 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.32 -37.8 86.99 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.711 -0.677 . . . . 67.09 111.836 -170.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -65.39 -29.62 70.35 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.445 -0.502 . . . . 61.29 111.848 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.503 ' HB2' HG23 ' A' ' 13' ' ' VAL . 5.4 m-20 -61.63 -34.0 74.91 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.625 -0.43 . . . . 44.69 111.572 179.209 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.462 ' O ' HG12 ' A' ' 21' ' ' ILE . 56.7 m-85 -66.64 -48.51 69.22 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.673 -0.411 . . . . 64.75 111.627 -176.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.454 HD21 HD13 ' A' ' 60' ' ' LEU . 5.1 mp -62.14 -42.34 99.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.257 -0.977 . . . . 47.46 110.939 -177.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -63.29 -39.65 95.17 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.157 -0.617 . . . . 33.77 110.916 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 t -69.69 -42.49 80.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.517 -0.473 . . . . 37.41 110.663 -178.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.633 HD11 HD11 ' A' ' 37' ' ' LEU . 35.0 mm -58.97 -43.23 88.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 C-N-CA 120.087 -0.645 . . . . 49.14 109.755 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 68.7 t90 -69.34 -40.79 77.33 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.602 -0.439 . . . . 37.58 111.501 -176.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.8 p -66.86 -32.28 73.44 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.985 -0.686 . . . . 39.02 111.574 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.05 -39.01 89.79 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.323 -0.551 . . . . 53.06 111.11 176.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 21' ' ' ILE . 8.4 mt-30 -80.83 2.58 25.79 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.154 0.798 . . . . 69.36 113.154 177.684 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -77.4 -38.64 49.37 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 118.592 0.633 . . . . 43.52 111.888 -173.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -122.38 15.67 10.49 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.248 0.462 . . . . 53.04 112.248 -178.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.2 m -157.24 160.31 38.53 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.891 -0.781 . . . . 66.33 108.891 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -131.81 67.19 1.53 Allowed 'General case' 0 C--O 1.233 0.211 0 N-CA-C 108.355 -0.98 . . . . 82.33 108.355 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 0.4 OUTLIER -112.51 -121.5 0.29 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.978 -0.556 . . . . 77.61 109.553 179.545 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.479 ' HG2' ' HB2' ' A' ' 68' ' ' ALA . 4.7 mttp -141.48 146.29 36.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.655 -1.239 . . . . 76.47 107.655 176.864 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.529 HG11 HG23 ' A' ' 21' ' ' ILE . 2.3 p -111.44 87.62 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.368 0 C-N-CA 118.273 -1.371 . . . . 105.87 108.397 175.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 p -66.47 160.02 25.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.858 0.837 . . . . 117.79 110.217 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -62.94 -25.82 68.53 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.357 -0.838 . . . . 122.06 111.421 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 35' ' ' LYS . 1.3 tptt -73.63 -31.82 63.73 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.306 -0.558 . . . . 116.29 111.93 173.649 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 40.5 mtt -65.73 -42.26 91.26 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.478 -0.889 . . . . 117.65 110.889 173.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.633 HD11 HD11 ' A' ' 21' ' ' ILE . 27.8 mt -58.75 -49.29 78.16 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.744 0.307 . . . . 99.71 111.65 175.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.91 -47.32 86.26 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 120.781 0.324 . . . . 102.04 111.576 -170.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -73.12 -23.01 60.44 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.889 0.7 . . . . 115.14 112.889 -173.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -94.92 -37.09 11.34 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 118.801 0.728 . . . . 104.94 112.769 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.9 mt -67.33 -30.54 49.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 C-N-CA 120.281 -0.567 . . . . 100.05 110.148 173.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 106.18 14.12 21.33 Favored Glycine 0 N--CA 1.446 -0.633 0 N-CA-C 116.169 1.228 . . . . 100.49 116.169 172.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 16.4 m -125.7 164.71 24.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 118.823 1.312 . . . . 104.03 108.978 -179.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.8 p -64.05 150.4 45.47 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.143 -0.935 . . . . 96.85 110.938 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.82 -16.42 64.27 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.599 -0.728 . . . . 102.66 112.281 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.8 m -62.62 -44.92 95.07 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.7 -0.4 . . . . 83.41 110.913 176.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.8 p -87.1 -24.75 24.45 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.091 0.775 . . . . 79.26 113.091 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.47 -40.7 96.18 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.318 -0.553 . . . . 75.55 111.071 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.2 t -63.39 -43.96 96.1 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.452 -0.499 . . . . 84.07 110.991 174.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -64.89 -29.26 70.19 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.599 -0.44 . . . . 84.59 111.166 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . 0.421 ' O ' HD12 ' A' ' 55' ' ' LEU . 32.3 t -74.07 -59.44 2.72 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.752 -0.379 . . . . 74.6 111.058 177.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.7 tp -56.56 -25.96 22.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-O 120.671 0.272 . . . . 80.79 110.983 -176.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -63.17 -36.18 82.77 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 121.999 -0.438 . . . . 104.78 111.472 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -68.63 -46.52 69.0 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.88 -0.328 . . . . 78.85 111.451 -176.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.421 HD12 ' O ' ' A' ' 51' ' ' SER . 4.7 mp -66.56 -27.63 67.89 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.563 -0.455 . . . . 68.22 111.936 -174.9 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.86 -31.37 70.27 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.046 -0.662 . . . . 84.07 111.385 174.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -69.98 -30.38 67.71 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.662 -0.415 . . . . 104.02 111.578 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -79.96 1.92 25.55 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.954 0.724 . . . . 87.43 112.954 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.5 ' O ' ' OG ' ' A' ' 74' ' ' SER . . . 75.0 31.64 57.61 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.873 -0.68 . . . . 79.52 114.236 -178.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.454 HD13 HD21 ' A' ' 18' ' ' LEU . 51.0 mt -109.94 -32.88 6.88 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 113.879 1.066 . . . . 70.58 113.879 -177.822 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 35.2 m -136.59 -176.59 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 108.715 -0.846 . . . . 86.23 108.715 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -157.77 141.89 15.99 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.618 -0.882 . . . . 97.25 108.618 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 O-C-N 123.484 0.49 . . . . 106.23 112.074 176.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 404' ' ' HOH . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 113.726 0.251 . . . . 102.74 113.726 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.479 ' HB2' ' HG2' ' A' ' 31' ' ' LYS . . . -91.31 151.48 20.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.201 0.524 . . . . 100.33 110.846 -178.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 10.1 t -113.91 141.73 28.99 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 109.052 -0.721 . . . . 88.34 109.052 -177.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 t -139.43 162.69 34.43 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.321 -0.622 . . . . 75.22 109.321 179.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.574 HD23 ' HA ' ' A' ' 76' ' ' ARG . 3.6 mp -91.34 138.76 31.33 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.667 -0.697 . . . . 68.34 110.069 177.408 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.7 p -84.0 -171.12 3.43 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.275 -1.009 . . . . 69.35 108.275 167.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -78.09 -31.31 50.03 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.654 -0.818 . . . . 81.55 111.734 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . 0.5 ' OG ' ' O ' ' A' ' 59' ' ' GLY . 3.3 p -74.44 -25.79 59.65 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.094 -0.642 . . . . 65.98 111.195 173.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.31 -30.86 48.66 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.435 -0.888 . . . . 58.05 113.149 175.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.574 ' HA ' HD23 ' A' ' 71' ' ' LEU . 25.4 ttm-85 -66.25 -51.06 61.22 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 117.445 0.623 . . . . 53.47 111.053 178.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.8 mtm-85 -66.05 -24.84 66.81 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.276 -0.57 . . . . 73.99 111.817 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.67 -41.04 27.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.224 -0.59 . . . . 48.07 111.353 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.91 -39.43 83.57 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.319 -0.553 . . . . 44.82 111.18 177.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 87.8 mt -61.01 -31.54 71.16 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.221 -0.592 . . . . 44.7 111.316 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.91 -47.11 72.76 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.492 -0.483 . . . . 36.0 110.815 174.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 28.1 mmt -61.9 -42.59 99.26 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.752 -0.379 . . . . 41.93 111.313 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.12 -39.21 83.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 120.963 0.411 . . . . 25.79 110.36 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.41 ' HB2' ' HG2' ' A' ' 140' ' ' PRO . 62.6 ttt-85 -64.59 -43.6 93.31 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.385 -0.526 . . . . 40.38 111.421 -178.77 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 3.2 mtm-85 -65.58 -47.16 76.7 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.357 -0.537 . . . . 62.03 111.091 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -55.56 -45.18 77.32 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.824 0.345 . . . . 43.29 111.502 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -82.75 -31.74 28.21 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.268 -0.573 . . . . 32.06 112.446 -170.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.461 HD23 HD13 ' A' ' 139' ' ' ILE . 22.6 mt -69.26 -30.2 68.27 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.788 -0.765 . . . . 25.58 111.327 171.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.525 HD13 ' HB3' ' A' ' 111' ' ' LEU . 29.2 mt -70.82 -43.91 67.64 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.38 -0.528 . . . . 20.09 111.277 177.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -53.74 -45.78 70.67 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.02 0.438 . . . . 25.02 110.804 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.4 m -64.91 -39.13 93.04 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.956 -0.298 . . . . 20.83 111.479 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -69.93 -34.02 72.91 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.022 -0.671 . . . . 21.38 111.638 -178.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.551 HD23 HD12 ' A' ' 97' ' ' LEU . 85.9 mt -66.56 -29.62 69.73 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.408 -0.517 . . . . 17.74 111.983 178.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.561 HG23 HG11 ' A' ' 104' ' ' VAL . 43.2 t -85.05 -46.71 17.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.665 -0.414 . . . . 26.52 110.868 -178.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -84.36 -11.88 55.51 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 113.686 0.995 . . . . 27.36 113.686 -168.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -129.46 -30.9 2.08 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.893 0.77 . . . . 46.32 112.395 -177.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.551 HD12 HD23 ' A' ' 93' ' ' LEU . 63.1 mt -107.23 -7.41 16.78 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 114.023 1.12 . . . . 32.93 114.023 -175.325 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.52 20.83 53.45 Favored Glycine 0 N--CA 1.449 -0.47 0 N-CA-C 116.127 1.211 . . . . 29.59 116.127 172.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -69.86 158.44 35.52 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.645 1.223 . . . . 27.87 110.685 172.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 24.5 mtt85 -94.17 168.25 11.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.335 -0.848 . . . . 58.36 108.98 164.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -75.38 -9.05 58.22 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.265 -0.974 . . . . 34.93 113.39 -172.431 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -93.54 -13.03 28.26 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 119.004 0.82 . . . . 17.29 113.044 174.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -96.08 -6.83 37.69 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 113.23 0.826 . . . . 26.21 113.23 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.561 HG11 HG23 ' A' ' 94' ' ' VAL . 28.1 m -86.51 -28.14 5.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 113.458 0.91 . . . . 20.74 113.458 -169.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -72.32 -42.34 65.53 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.933 -1.107 . . . . 21.51 111.612 -169.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -66.5 -29.44 69.55 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.69 -0.804 . . . . 33.18 111.652 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -73.36 -54.81 7.43 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.558 -0.457 . . . . 36.17 111.166 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.36 -17.43 64.76 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.556 0.576 . . . . 26.33 112.556 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 26.5 tp10 -68.91 -26.17 64.95 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.313 -0.555 . . . . 36.47 111.374 175.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.35 -38.3 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 122.442 0.297 . . . . 24.78 111.615 177.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.525 ' HB3' HD13 ' A' ' 89' ' ' LEU . 2.4 mt -69.16 -12.44 61.68 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.28 0.845 . . . . 28.19 113.28 -179.325 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -71.73 -23.76 61.67 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.024 0.75 . . . . 34.24 113.024 -173.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -98.11 5.9 48.13 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 113.647 0.98 . . . . 32.68 113.647 -176.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -122.6 5.3 9.53 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.766 0.712 . . . . 40.55 112.717 -177.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.63 HG11 ' SD ' ' A' ' 120' ' ' MET . 66.6 t -102.08 136.67 33.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 118.427 0.558 . . . . 45.64 109.889 -174.235 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.7 p -87.74 160.61 18.01 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.649 0.738 . . . . 36.53 110.642 174.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -61.79 -28.98 69.84 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.363 -0.835 . . . . 44.15 111.784 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 31.7 ttm-85 -62.16 -40.29 95.49 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.856 -0.338 . . . . 54.7 111.164 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.58 HD23 HG13 ' A' ' 115' ' ' VAL . 41.6 tp -69.72 -41.15 75.7 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.396 -0.521 . . . . 27.22 111.344 -176.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' MET . . . . . 0.63 ' SD ' HG11 ' A' ' 115' ' ' VAL . 32.3 mmm -64.46 -29.07 70.12 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.086 -0.646 . . . . 36.38 111.731 175.811 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.27 -48.4 73.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.239 -0.585 . . . . 31.04 110.871 178.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.687 ' NH2' ' O ' ' A' ' 402' ' ' HOH . 0.9 OUTLIER -71.58 -32.47 68.11 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.051 -0.66 . . . . 47.25 111.635 177.694 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 22.1 mt -62.7 -48.67 87.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 121.187 0.518 . . . . 27.32 110.022 172.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.401 ' OD1' ' HA ' ' A' ' 129' ' ' PHE . 30.3 t0 -61.42 -42.21 98.39 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 122.042 -0.411 . . . . 39.09 111.161 178.523 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.33 80.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.508 -0.477 . . . . 29.14 111.473 -177.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -70.07 -34.56 73.35 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.086 -0.646 . . . . 29.69 111.587 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 82.2 mt -74.28 -2.55 25.49 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 113.039 0.755 . . . . 33.82 113.039 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 76.25 24.81 67.59 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.914 -0.66 . . . . 43.99 114.604 -176.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' PHE . . . . . 0.401 ' HA ' ' OD1' ' A' ' 124' ' ' ASP . 16.6 m-85 56.01 71.38 1.23 Allowed Pre-proline 0 C--O 1.238 0.477 0 C-N-CA 124.372 1.069 . . . . 53.36 110.293 -177.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -76.78 151.5 31.8 Favored 'Trans proline' 0 C--N 1.329 -0.449 0 CA-C-O 121.912 0.713 . . . . 48.67 111.216 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -107.12 -10.55 15.85 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 114.976 -1.011 . . . . 59.71 113.537 -179.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.509 ' HD2' ' HA2' ' A' ' 136' ' ' GLY . 20.8 ptt180 -142.69 157.45 44.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.767 0.794 . . . . 53.73 110.281 -176.754 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.567 ' HB3' ' H ' ' A' ' 135' ' ' HIS . 2.8 m-20 -70.34 175.93 2.19 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 126.171 1.789 . . . . 55.56 112.17 -176.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.5 -19.37 67.44 Favored 'Trans proline' 0 C--O 1.237 0.43 0 CA-C-N 118.302 0.429 . . . . 50.65 112.344 157.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HIS . . . . . 0.567 ' H ' ' HB3' ' A' ' 133' ' ' ASP . 8.2 m170 -97.97 0.18 45.92 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.735 0.814 . . . . 47.67 112.801 175.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.509 ' HA2' ' HD2' ' A' ' 132' ' ' ARG . . . 83.62 1.04 90.12 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-O 119.045 -0.864 . . . . 45.84 114.711 -174.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.436 ' H ' ' HB2' ' A' ' 133' ' ' ASP . 89.2 m-20 -59.91 128.13 86.49 Favored Pre-proline 0 C--O 1.239 0.504 0 CA-C-N 118.216 1.008 . . . . 46.62 109.502 176.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.76 135.72 36.48 Favored 'Trans proline' 0 C--N 1.332 -0.34 0 CA-C-N 118.969 0.668 . . . . 42.71 111.698 -176.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ILE . . . . . 0.461 HD13 HD23 ' A' ' 88' ' ' LEU . 51.2 mt -93.13 112.68 57.29 Favored Pre-proline 0 C--O 1.245 0.824 0 N-CA-C 107.734 -1.21 . . . . 46.05 107.734 179.335 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.62 ' HB3' HG22 ' A' ' 146' ' ' VAL . 15.3 Cg_endo -62.34 137.63 66.56 Favored 'Trans proline' 0 C--N 1.331 -0.344 0 CA-C-N 119.43 0.832 . . . . 51.53 111.152 178.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -66.19 163.38 42.06 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.306 -0.95 . . . . 68.7 112.149 175.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.11 -39.93 87.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.331 -0.548 . . . . 78.42 110.976 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -34.36 74.06 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 111.77 0.285 . . . . 97.97 111.77 172.485 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 105.04 40.63 2.08 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 114.563 0.585 . . . . 93.4 114.563 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -84.78 -47.46 10.38 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.05 0.425 . . . . 92.25 112.006 -177.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' VAL . . . . . 0.62 HG22 ' HB3' ' A' ' 140' ' ' PRO . 86.4 t 71.27 116.74 0.03 OUTLIER Pre-proline 0 C--O 1.239 0.533 0 C-N-CA 125.628 1.571 . . . . 55.33 109.512 -171.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -96.85 78.37 0.09 OUTLIER 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 120.386 0.724 . . . . 44.01 112.651 175.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' THR . . . . . 0.53 ' OG1' ' O ' ' A' ' 401' ' ' HOH . 26.1 m -77.35 128.48 80.29 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 110.039 -0.356 . . . . 47.98 110.039 -178.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -79.88 152.72 22.21 Favored 'Trans proline' 0 C--O 1.241 0.648 0 C-N-CA 120.484 0.789 . . . . 61.07 110.813 175.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -82.56 94.35 0.87 Allowed 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 120.145 0.563 . . . . 69.39 112.349 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -140.1 161.93 36.45 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.666 0.746 . . . . 53.04 110.532 -170.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' ARG . . . . . 0.406 ' NH1' ' OG ' ' A' ' 228' ' ' SER . 0.1 OUTLIER -139.92 164.85 28.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.927 -1.033 . . . . 64.99 108.601 171.491 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -65.37 149.56 49.79 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.534 -0.757 . . . . 34.51 111.066 -177.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.611 HD21 HG11 ' A' ' 204' ' ' VAL . 21.3 tp -61.32 -40.72 95.24 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.505 -0.77 . . . . 34.67 111.201 176.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -59.87 -31.33 69.68 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.872 -0.331 . . . . 40.16 111.66 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -76.3 -7.98 56.1 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 113.085 0.772 . . . . 42.62 113.085 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' CYS . . . . . . . . . . . . . 71.2 m -99.27 157.32 16.47 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.811 0.815 . . . . 50.88 110.111 177.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -110.39 174.54 5.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.783 0.801 . . . . 78.8 110.917 177.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -61.86 138.93 58.4 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 114.802 -1.09 . . . . 81.2 111.101 -172.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.31 -23.03 31.78 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 114.963 0.745 . . . . 71.1 114.963 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -66.59 151.93 46.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 118.141 0.971 . . . . 57.73 110.833 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 42.9 p -123.76 173.84 7.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.382 -0.826 . . . . 52.19 109.139 175.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . 170.23 165.17 27.16 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 119.87 -1.157 . . . . 44.5 114.948 177.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' THR . . . . . . . . . . . . . 1.5 m -105.46 128.75 53.71 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.456 0.702 . . . . 40.57 109.247 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 98.1 t -61.86 125.25 17.83 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 109.064 -0.717 . . . . 31.37 109.064 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -117.6 -25.88 6.77 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 114.29 1.218 . . . . 30.54 114.29 -175.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -158.81 134.37 8.69 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.512 -0.921 . . . . 35.18 108.512 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 17.8 mt -124.71 129.64 73.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.402 -0.962 . . . . 27.94 108.402 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 38.2 t -62.66 148.21 47.1 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.496 0.665 . . . . 40.91 110.624 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 38.6 p-10 -114.66 19.72 15.82 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.654 -0.703 . . . . 31.69 112.202 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.12 -28.12 69.21 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.215 -0.594 . . . . 29.47 111.728 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -123.68 107.62 31.39 Favored Pre-proline 0 C--O 1.246 0.875 0 N-CA-C 108.818 -0.808 . . . . 49.62 108.818 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -66.63 -27.47 45.39 Favored 'Trans proline' 0 C--O 1.238 0.495 0 CA-C-N 119.35 0.803 . . . . 24.66 112.816 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -59.18 -40.25 85.07 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.559 -0.456 . . . . 31.56 111.098 175.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' MET . . . . . . . . . . . . . 2.0 ttm -68.14 -34.31 76.12 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.645 -0.422 . . . . 48.76 111.75 -177.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 16.6 mt -65.19 -38.34 90.2 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.104 -0.638 . . . . 45.75 110.781 173.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -62.04 -45.82 91.89 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.0 0.429 . . . . 46.6 110.643 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -60.73 -42.38 97.22 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.65 -0.25 . . . . 37.39 111.183 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -63.01 -43.1 99.7 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.475 -0.49 . . . . 25.18 111.367 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -65.4 -32.66 74.4 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.756 -0.377 . . . . 28.29 111.813 -179.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 92.5 p -72.78 -31.02 64.56 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.302 -0.559 . . . . 34.38 112.031 -176.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 10.9 pt -92.4 -26.68 4.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 120.312 -0.555 . . . . 41.13 112.109 -179.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . 120.84 20.32 3.47 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 115.384 0.914 . . . . 32.41 115.384 173.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' ILE . . . . . . . . . . . . . 11.7 mt -97.25 94.33 3.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 106.327 -1.731 . . . . 46.94 106.327 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' SER . . . . . 0.488 ' O ' ' OG ' ' A' ' 188' ' ' SER . 1.5 m -109.9 177.61 4.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.595 0.712 . . . . 55.04 109.151 175.103 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' LEU . . . . . . . . . . . . . 78.0 mt -66.86 142.11 57.43 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 119.9 -0.72 . . . . 51.29 109.444 170.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 77.63 3.64 3.03 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 127.376 2.271 . . . . 55.84 112.593 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' SER . . . . . 0.488 ' OG ' ' O ' ' A' ' 185' ' ' SER . 2.1 p -79.79 137.38 36.97 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.543 1.065 . . . . 46.68 110.064 174.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' ARG . . . . . 0.758 ' NH1' ' OD2' ' A' ' 207' ' ' ASP . 3.8 mtp-105 -93.85 134.76 35.87 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.047 -0.524 . . . . 74.64 110.581 -176.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 6.8 mt -121.32 157.48 30.31 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.371 0.669 . . . . 44.33 110.255 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -132.79 136.12 46.11 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.684 -0.858 . . . . 81.5 108.684 161.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 98.0 t -79.24 128.36 38.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 109.204 -0.665 . . . . 37.0 109.204 175.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 44.2 mt -99.11 -51.92 3.69 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.47 0.544 . . . . 48.89 112.47 -179.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -145.21 105.36 4.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.611 -0.885 . . . . 45.73 108.611 -177.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' ARG . . . . . . . . . . . . . 68.9 ttt-85 -96.61 107.16 19.55 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.246 -1.02 . . . . 50.11 108.246 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' ARG . . . . . . . . . . . . . 57.3 mtm-85 -103.52 92.76 4.6 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.41 -1.329 . . . . 54.14 107.41 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -56.3 -33.69 65.78 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.82 -0.627 . . . . 84.1 111.441 -177.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' PHE . . . . . 0.408 ' HA ' ' HA ' ' A' ' 199' ' ' ALA . 5.5 t80 -110.94 118.52 36.3 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 105.905 -1.887 . . . . 68.26 105.905 164.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' ALA . . . . . 0.408 ' HA ' ' HA ' ' A' ' 198' ' ' PHE . . . -121.53 78.24 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.703 0.631 . . . . 76.65 112.703 7.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . 67.29 51.04 40.53 Favored Glycine 0 C--N 1.332 0.338 0 N-CA-C 115.023 0.769 . . . . 76.93 115.023 174.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' MET . . . . . . . . . . . . . 4.6 mmt -140.13 140.68 36.05 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.332 -0.618 . . . . 68.97 109.332 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ILE . . . . . . . . . . . . . 12.7 tt -142.1 131.13 22.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 108.408 -0.96 . . . . 50.09 108.408 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 9.6 t -103.63 124.34 48.65 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.061 -0.718 . . . . 46.54 109.061 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.611 HG11 HD21 ' A' ' 154' ' ' LEU . 4.3 m -124.6 160.03 29.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.89 0.852 . . . . 41.12 109.169 -179.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -117.08 114.19 23.38 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.131 -1.063 . . . . 49.2 108.131 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' ILE . . . . . . . . . . . . . 8.9 mm -78.18 124.67 36.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 108.497 -0.927 . . . . 55.57 108.497 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.758 ' OD2' ' NH1' ' A' ' 189' ' ' ARG . 52.5 t0 -78.66 95.2 5.2 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.941 -1.133 . . . . 75.75 107.941 176.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 85.3 p -130.69 -178.91 5.0 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.025 -0.732 . . . . 106.08 109.025 -178.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' ALA . . . . . . . . . . . . . . . -56.21 -64.75 0.76 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.615 -0.721 . . . . 125.58 110.78 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -78.24 -6.99 56.59 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.834 0.679 . . . . 144.97 112.834 174.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' GLY . . . . . . . . . . . . . . . 56.17 79.37 0.09 OUTLIER Glycine 0 C--N 1.334 0.429 0 N-CA-C 114.646 0.618 . . . . 123.21 114.646 175.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -92.11 174.38 7.34 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.973 0.892 . . . . 83.21 110.719 -176.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 5.1 m -132.37 130.7 41.05 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.65 -0.87 . . . . 50.24 108.65 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 11.4 m -127.97 158.76 39.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.815 0.817 . . . . 48.72 109.845 -177.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -118.49 103.49 9.79 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.145 -1.057 . . . . 67.86 108.145 -179.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' LEU . . . . . . . . . . . . . 19.9 mt -90.85 132.81 35.67 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.65 0.262 . . . . 51.51 110.571 -178.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -72.15 171.47 48.53 Favored Glycine 0 N--CA 1.444 -0.773 0 CA-C-O 122.49 1.05 . . . . 46.0 111.578 171.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' SER . . . . . . . . . . . . . 30.4 t -57.83 -43.31 98.55 Favored Pre-proline 0 C--O 1.244 0.805 0 N-CA-C 114.144 1.164 . . . . 38.86 114.144 -177.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -66.03 -36.31 30.52 Favored 'Trans proline' 0 C--O 1.238 0.481 0 CA-C-N 121.633 1.619 . . . . 35.35 113.295 -179.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' ALA . . . . . . . . . . . . . . . -66.24 -38.47 87.98 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.284 -0.566 . . . . 35.88 111.338 -179.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -71.11 -26.99 63.27 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.322 -0.551 . . . . 39.32 111.832 -179.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.17 -0.37 24.79 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.63 0.604 . . . . 41.89 112.63 176.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' ALA . . . . . . . . . . . . . . . -108.03 -7.91 16.01 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.383 0.883 . . . . 33.57 113.383 177.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 39.2 mt -106.0 109.49 28.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 108.212 -1.033 . . . . 33.37 108.212 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' TRP . . . . . . . . . . . . . 7.0 m-90 -91.62 136.36 33.19 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 109.454 -0.573 . . . . 33.09 109.454 171.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' VAL . . . . . . . . . . . . . 1.4 p -130.5 151.01 35.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.335 0.588 . . . . 34.32 109.882 -167.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 38.9 t -115.71 117.11 54.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 N-CA-C 108.298 -1.001 . . . . 60.39 108.298 179.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' SER . . . . . 0.406 ' OG ' ' NH1' ' A' ' 152' ' ' ARG . 58.5 m -78.36 95.89 5.18 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 124.177 0.923 . . . . 81.33 110.924 -177.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 229' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 O-C-N 124.673 1.233 . . . . 86.03 109.344 179.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.547 ' N ' ' HB2' ' B' ' 16' ' ' ASP . 1.3 m . . . . . 0 CA--C 1.533 0.305 0 N-CA-C 111.976 0.362 . . . . 63.58 111.976 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ALA . . . . . 0.767 ' HB1' HD11 ' B' ' 55' ' ' LEU . . . -98.45 -4.51 34.38 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.575 0.75 . . . . 58.93 109.571 -2.308 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -74.81 -28.63 60.79 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.312 -0.858 . . . . 52.98 111.705 -179.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ASP . . . . . 0.547 ' HB2' ' N ' ' B' ' 13' ' ' VAL . 13.6 m-20 -62.73 -36.91 84.52 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.476 -0.489 . . . . 50.68 111.476 172.802 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.485 ' O ' ' N ' ' B' ' 20' ' ' VAL . 22.4 m-85 -56.55 -75.62 0.04 OUTLIER 'General case' 0 C--O 1.235 0.319 0 C-N-CA 119.933 -0.707 . . . . 67.26 110.002 175.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 70.5 mt -40.58 -41.2 1.42 Allowed 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.846 0.684 . . . . 58.68 112.846 -177.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -61.22 -37.42 82.94 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.5 -0.48 . . . . 46.51 111.275 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.485 ' N ' ' O ' ' B' ' 17' ' ' TYR . 17.0 t -74.23 -42.47 51.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 120.292 -0.563 . . . . 44.05 110.988 -176.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.44 ' O ' ' HG2' ' B' ' 25' ' ' GLN . 5.0 mp -55.52 -41.89 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 119.331 -0.948 . . . . 41.86 111.294 177.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' TRP . . . . . . . . . . . . . 87.7 t90 -70.69 -43.43 69.06 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 118.429 -1.308 . . . . 38.14 111.722 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 39.5 p -66.52 -24.02 66.32 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.477 -0.489 . . . . 41.4 112.224 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.03 -40.78 68.16 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.215 -0.594 . . . . 44.73 111.291 178.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' B' ' 21' ' ' ILE . 3.9 pt20 -90.14 20.11 4.56 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.596 0.591 . . . . 60.24 112.596 179.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -83.83 -32.31 25.35 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.431 -0.508 . . . . 40.53 111.973 -178.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -122.46 -1.05 9.14 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 113.529 0.936 . . . . 54.32 113.529 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 4.5 p -145.6 170.29 16.74 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.789 -0.819 . . . . 69.71 108.789 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -110.65 0.25 17.44 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.529 -0.76 . . . . 81.9 112.88 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -60.82 133.38 56.04 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.09 -0.707 . . . . 85.5 109.09 168.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' B' ' 31' ' ' LYS . 1.2 tptm -100.51 172.92 6.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 122.252 1.025 . . . . 95.77 111.831 -168.15 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' B' ' 68' ' ' ALA . 28.9 t -99.75 134.61 38.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 114.598 -1.183 . . . . 112.31 109.496 -165.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 43.4 m -117.45 152.03 35.85 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.24 -0.652 . . . . 117.19 109.24 172.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 61.2 m -48.66 -33.83 10.69 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.353 -0.839 . . . . 125.41 112.255 -177.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -72.74 -39.79 66.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.603 -0.439 . . . . 129.12 111.622 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' MET . . . . . . . . . . . . . 3.3 mtp -64.65 -29.55 70.55 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.21 -0.596 . . . . 120.99 111.813 -178.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LEU . . . . . 0.541 HD12 HD11 ' B' ' 52' ' ' ILE . 51.1 mt -65.93 -31.69 72.76 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.995 -0.682 . . . . 95.36 111.256 170.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ALA . . . . . 0.443 ' HB1' ' O ' ' B' ' 43' ' ' VAL . . . -76.42 -25.57 54.63 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.489 -0.485 . . . . 91.76 111.766 -178.427 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -85.63 -19.61 30.71 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.844 0.683 . . . . 101.26 112.844 177.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.474 ' NH1' ' O ' ' B' ' 401' ' ' HOH . 0.0 OUTLIER -90.83 -47.96 7.3 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 118.148 0.431 . . . . 112.97 111.125 176.108 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 6.8 mm -78.25 -53.01 14.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 120.931 0.396 . . . . 101.77 110.609 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 115.0 80.22 0.88 Allowed Glycine 0 N--CA 1.45 -0.406 0 O-C-N 121.872 -0.518 . . . . 102.14 113.518 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.443 ' O ' ' HB1' ' B' ' 38' ' ' ALA . 2.3 p -162.68 175.31 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.558 -0.904 . . . . 97.26 108.558 -179.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 24.1 p -83.21 157.49 22.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.703 0.763 . . . . 96.61 110.622 178.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.7 -25.88 68.39 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.419 -0.809 . . . . 97.44 111.441 176.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.9 t -64.82 -62.42 1.58 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.01 0.433 . . . . 100.49 111.029 175.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.5 m -64.28 -28.61 69.84 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.215 -0.303 . . . . 102.74 111.693 -177.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.73 81.32 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.851 -0.34 . . . . 101.47 111.716 -176.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 26.5 t -72.09 -33.98 68.3 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.908 -0.717 . . . . 102.73 111.705 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.08 -32.13 72.25 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.449 -0.5 . . . . 116.56 111.485 178.917 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' SER . . . . . 0.463 ' O ' HD13 ' B' ' 55' ' ' LEU . 50.0 m -74.35 -28.93 61.35 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.097 -0.641 . . . . 99.41 111.446 174.212 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ILE . . . . . 0.541 HD11 HD12 ' B' ' 37' ' ' LEU . 3.2 mt -73.09 -36.56 50.88 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 120.731 -0.388 . . . . 83.35 110.577 176.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -35.52 78.73 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.974 -0.454 . . . . 96.55 112.011 -173.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -27.2 49.83 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.235 -0.986 . . . . 89.31 111.643 -176.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.767 HD11 ' HB1' ' B' ' 14' ' ' ALA . 9.3 mp -71.52 -28.43 63.88 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.327 -0.549 . . . . 82.96 111.237 169.251 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.72 -27.4 31.19 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.853 -0.339 . . . . 85.99 111.753 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -74.34 -14.19 60.85 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.296 0.48 . . . . 84.94 112.296 175.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -94.0 -9.77 35.79 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.449 0.907 . . . . 79.87 113.449 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.02 16.79 64.36 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.777 -0.725 . . . . 70.96 114.335 -173.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 68.4 mt -93.71 -12.28 29.6 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 117.887 0.843 . . . . 66.92 112.849 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' VAL . . . . . . . . . . . . . 7.1 p -166.31 145.96 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 108.72 -0.844 . . . . 77.06 108.72 -177.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.729 0.3 . . . . 79.56 110.785 177.262 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ALA . . . . . 0.61 ' N ' ' O ' ' B' ' 32' ' ' VAL . . . . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.667 0.27 . . . . 96.94 111.08 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 98.2 t -82.06 -73.48 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 109.386 -0.598 . . . . 105.56 109.386 -177.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' THR . . . . . . . . . . . . . 5.7 m 63.28 111.95 0.02 OUTLIER 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.591 1.157 . . . . 91.08 112.26 176.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.531 HD13 ' HB2' ' B' ' 76' ' ' ARG . 1.1 pp -89.35 161.87 16.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.752 0.787 . . . . 79.19 111.43 -177.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 2.7 p -97.06 -172.88 2.54 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.235 -0.893 . . . . 72.04 110.015 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -64.76 -49.35 71.12 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.171 -0.468 . . . . 65.15 111.227 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 67.8 p -66.98 -23.72 65.97 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.524 -0.47 . . . . 63.12 112.107 177.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.04 -42.0 11.48 Favored Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 118.032 0.378 . . . . 54.7 112.7 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ARG . . . . . 0.531 ' HB2' HD13 ' B' ' 71' ' ' LEU . 7.8 ttm-85 -57.6 -35.39 70.37 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.428 -0.509 . . . . 50.29 110.93 173.459 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -67.81 -44.68 76.73 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.446 -0.502 . . . . 57.42 111.307 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.62 -41.01 89.04 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.264 -0.575 . . . . 41.22 111.24 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.55 95.54 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.441 -0.503 . . . . 33.25 111.111 178.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.9 mt -63.16 -31.38 72.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.556 -0.458 . . . . 25.95 111.565 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.15 -40.82 71.12 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.205 -0.598 . . . . 21.83 111.1 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' MET . . . . . 0.504 ' SD ' ' NH1' ' B' ' 85' ' ' ARG . 77.4 mmm -65.34 -43.04 92.14 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.494 -0.483 . . . . 29.82 111.148 176.685 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' VAL . . . . . . . . . . . . . 73.8 t -60.86 -40.74 86.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-O 121.014 0.435 . . . . 21.79 110.297 176.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 27.0 ttt85 -64.68 -41.75 95.83 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.406 -0.517 . . . . 29.86 111.16 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ARG . . . . . 0.504 ' NH1' ' SD ' ' B' ' 82' ' ' MET . 62.8 mtt180 -63.48 -44.07 95.46 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.475 -0.49 . . . . 43.12 111.238 178.499 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -61.36 -47.25 86.71 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.798 -0.361 . . . . 26.63 111.304 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -77.82 -28.29 50.25 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.316 0.488 . . . . 28.78 112.316 -173.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 15.1 mt -65.74 -38.75 89.99 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.727 -0.789 . . . . 19.85 110.826 170.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 16.9 mt -64.38 -46.4 83.49 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.679 -0.408 . . . . 24.26 110.898 177.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -56.64 -38.15 71.74 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.942 -0.303 . . . . 41.24 111.168 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 6.3 m -73.22 -40.7 64.5 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.267 -0.573 . . . . 29.65 111.282 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -63.49 -40.19 96.42 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.209 -0.597 . . . . 31.45 111.188 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.412 HD23 HD12 ' B' ' 97' ' ' LEU . 95.0 mt -61.65 -47.73 84.05 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.716 -0.394 . . . . 34.09 111.263 -178.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.558 HG23 HG11 ' B' ' 104' ' ' VAL . 3.7 t -69.0 -47.33 76.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 120.454 -0.499 . . . . 36.96 110.534 -178.127 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -76.55 -30.07 56.93 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 112.942 0.719 . . . . 35.15 112.942 -169.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -110.78 -33.22 6.6 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 114.387 1.255 . . . . 42.72 114.387 -172.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LEU . . . . . 0.412 HD12 HD23 ' B' ' 93' ' ' LEU . 9.2 mt -115.38 18.97 15.8 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.893 0.701 . . . . 37.95 112.893 -172.829 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . 69.73 19.99 75.45 Favored Glycine 0 N--CA 1.449 -0.433 0 N-CA-C 115.94 1.136 . . . . 39.64 115.94 171.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -74.33 149.67 40.51 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.357 1.079 . . . . 33.55 110.785 175.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 62.4 mtm-85 -85.94 161.2 19.14 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.577 -0.738 . . . . 60.6 109.494 167.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -69.73 -18.01 63.49 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 119.206 -0.997 . . . . 40.14 112.695 -173.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -90.68 -2.28 57.84 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.969 0.729 . . . . 32.44 112.969 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -101.98 -12.97 17.78 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.242 0.83 . . . . 42.15 113.242 178.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.558 HG11 HG23 ' B' ' 94' ' ' VAL . 30.0 m -83.98 -30.19 7.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 113.287 0.847 . . . . 29.0 113.287 -166.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -62.89 -56.32 18.31 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.091 -0.643 . . . . 31.95 111.674 -169.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -61.71 -34.83 76.48 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.417 -0.513 . . . . 57.69 111.82 -175.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.7 -46.77 29.35 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.274 -0.57 . . . . 45.93 111.177 178.069 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.77 -19.93 66.08 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 120.478 -0.489 . . . . 32.61 112.216 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -65.41 -19.15 65.82 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 117.989 0.359 . . . . 46.7 111.657 172.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' VAL . . . . . . . . . . . . . 59.4 t -100.97 -42.98 10.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 122.591 0.356 . . . . 29.73 111.874 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.37 -27.4 69.04 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.492 -0.483 . . . . 30.31 112.203 -179.478 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -62.0 -15.22 42.38 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 113.106 0.78 . . . . 37.89 113.106 -170.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -96.94 -14.29 21.83 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 113.452 0.908 . . . . 42.63 113.452 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -123.17 39.76 3.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 118.522 0.601 . . . . 29.99 111.305 -176.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' VAL . . . . . 0.728 HG13 HD23 ' B' ' 119' ' ' LEU . 54.5 t -125.5 138.55 54.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.9 -0.778 . . . . 31.95 108.9 178.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 24.8 p -89.06 156.96 18.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.693 0.759 . . . . 20.39 110.716 179.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.9 -24.73 65.25 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.359 -0.837 . . . . 27.7 111.645 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -69.52 -40.31 77.0 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 119.577 -0.849 . . . . 20.49 110.716 173.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.728 HD23 HG13 ' B' ' 115' ' ' VAL . 26.6 tp -67.59 -39.41 84.83 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.402 -0.519 . . . . 20.38 111.119 179.085 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 2.1 mmt -60.81 -41.26 95.32 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.323 -0.551 . . . . 38.19 111.461 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.42 83.78 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.464 -0.494 . . . . 22.7 111.495 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.49 -36.87 57.58 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.259 -0.577 . . . . 26.97 111.402 178.34 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 68.6 mt -58.56 -47.61 87.99 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.278 0.561 . . . . 26.8 109.881 168.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.464 ' OD1' ' HA ' ' B' ' 129' ' ' PHE . 66.4 t0 -58.86 -43.71 90.89 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.474 -0.33 . . . . 33.76 110.9 -179.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.87 -33.93 68.8 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.353 -0.539 . . . . 20.2 111.931 -178.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -71.19 -30.85 66.91 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.924 -0.71 . . . . 34.61 111.443 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.3 mt -79.25 -3.49 46.16 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.963 0.727 . . . . 25.14 112.963 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 89.07 15.21 59.47 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-O 119.029 -0.873 . . . . 19.78 115.192 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' PHE . . . . . 0.464 ' HA ' ' OD1' ' B' ' 124' ' ' ASP . 50.1 m-85 63.95 61.97 1.56 Allowed Pre-proline 0 C--O 1.238 0.458 0 C-N-CA 125.359 1.464 . . . . 36.95 110.071 -176.347 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.79 148.52 36.43 Favored 'Trans proline' 0 C--N 1.33 -0.4 0 CA-C-O 121.896 0.707 . . . . 39.39 112.774 -172.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -92.11 -31.7 15.42 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.009 -0.996 . . . . 51.21 112.907 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ARG . . . . . 0.64 ' HD3' ' HA2' ' B' ' 136' ' ' GLY . 0.5 OUTLIER -122.02 149.55 43.34 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.28 0.562 . . . . 47.72 110.33 -179.666 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -90.35 179.94 1.36 Allowed Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 123.892 0.877 . . . . 43.05 109.15 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -57.96 -19.33 39.52 Favored 'Trans proline' 0 C--O 1.237 0.439 0 CA-C-N 120.35 1.161 . . . . 41.31 114.509 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -99.1 7.48 45.83 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.669 0.668 . . . . 43.66 112.727 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' GLY . . . . . 0.64 ' HA2' ' HD3' ' B' ' 132' ' ' ARG . . . 75.36 3.86 72.25 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.168 -1.015 . . . . 41.53 114.376 -172.418 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -68.05 134.02 91.77 Favored Pre-proline 0 C--O 1.238 0.454 0 CA-C-N 117.92 0.86 . . . . 45.37 109.364 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -68.78 133.78 28.32 Favored 'Trans proline' 0 C--N 1.332 -0.312 0 C-N-CA 120.243 0.629 . . . . 47.02 111.329 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 75.2 mt -93.06 114.81 63.76 Favored Pre-proline 0 C--O 1.242 0.692 0 N-CA-C 107.629 -1.248 . . . . 38.26 107.629 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.79 152.57 80.01 Favored 'Trans proline' 0 C--N 1.332 -0.292 0 CA-C-N 119.286 0.781 . . . . 29.38 111.612 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' GLY . . . . . . . . . . . . . . . -77.6 168.84 54.55 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.412 -0.813 . . . . 38.94 111.886 173.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -61.85 -26.73 68.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.175 -0.512 . . . . 40.46 111.888 -177.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -98.21 5.25 48.64 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.492 0.553 . . . . 53.62 112.492 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' GLY . . . . . . . . . . . . . . . 87.36 37.08 8.37 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 118.001 0.364 . . . . 41.61 113.754 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -99.13 93.78 6.15 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.438 -1.319 . . . . 38.37 107.438 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 22.9 t -79.17 118.81 74.55 Favored Pre-proline 0 C--O 1.24 0.581 0 CA-C-N 115.94 -0.573 . . . . 30.68 110.037 -175.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -87.58 71.7 3.05 Favored 'Trans proline' 0 N--CA 1.481 0.793 0 C-N-CA 121.459 1.439 . . . . 24.22 112.448 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 53.5 m -67.78 126.24 92.35 Favored Pre-proline 0 C--O 1.238 0.46 0 CA-C-N 115.798 -0.637 . . . . 28.41 110.29 -177.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -83.16 147.42 12.95 Favored 'Trans proline' 0 C--O 1.24 0.612 0 C-N-CA 120.586 0.857 . . . . 36.99 110.815 176.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -80.76 88.14 1.43 Allowed 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 120.062 0.508 . . . . 46.45 112.235 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' ALA . . . . . 0.449 ' HB1' ' HB3' ' B' ' 225' ' ' TRP . . . -130.12 153.43 48.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.383 0.611 . . . . 58.24 110.886 -171.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -132.47 160.25 36.99 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.054 -0.976 . . . . 87.43 108.854 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -62.17 143.73 56.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.812 -0.631 . . . . 51.05 110.643 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' LEU . . . . . . . . . . . . . 23.9 tp -66.3 -34.43 77.97 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.879 -0.601 . . . . 54.09 111.39 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -63.15 -11.54 21.18 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.585 0.587 . . . . 83.98 112.585 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -92.47 -3.7 54.77 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 113.05 0.759 . . . . 70.57 113.05 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' CYS . . . . . . . . . . . . . 69.0 m -80.48 173.39 12.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 122.012 0.911 . . . . 75.67 110.752 -178.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' ARG . . . . . 0.411 ' HA ' ' HD3' ' B' ' 158' ' ' ARG . 1.2 mmt85 -134.76 146.38 49.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.231 -0.895 . . . . 90.67 109.394 179.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' ASP . . . . . 0.558 ' HB3' ' H ' ' B' ' 194' ' ' ALA . 4.3 p-10 -70.78 117.06 11.82 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.021 -0.536 . . . . 120.01 110.018 179.467 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' GLY . . . . . . . . . . . . . . . -137.78 95.24 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 115.639 1.016 . . . . 100.54 115.639 2.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -78.45 167.71 20.89 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.873 0.844 . . . . 74.42 110.133 173.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' THR . . . . . . . . . . . . . 1.7 p -110.32 -177.43 3.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.398 -0.819 . . . . 52.32 109.248 174.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 152.26 133.51 1.96 Allowed Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 116.518 1.367 . . . . 44.66 116.518 176.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' THR . . . . . . . . . . . . . 1.7 p -76.43 145.68 39.14 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.435 0.636 . . . . 38.33 110.531 174.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' VAL . . . . . 0.45 ' HA ' HG12 ' B' ' 226' ' ' VAL . 1.6 m -76.98 125.46 36.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 108.906 -0.775 . . . . 36.67 108.906 179.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.414 ' HB2' HG23 ' B' ' 227' ' ' VAL . . . -99.22 -59.17 1.78 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.25 -0.432 . . . . 28.41 111.696 -179.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -128.21 143.16 51.02 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 109.428 -0.582 . . . . 31.39 109.428 -176.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 96.7 mt -125.85 130.8 72.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 107.909 -1.145 . . . . 33.04 107.909 175.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 7.4 t -63.0 151.03 40.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.577 0.703 . . . . 42.26 110.932 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -121.77 12.95 10.68 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.609 -0.723 . . . . 42.24 112.941 -178.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -62.48 -16.72 57.04 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.478 0.548 . . . . 42.82 112.478 -178.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -140.92 115.79 7.29 Favored Pre-proline 0 C--O 1.238 0.471 0 CA-C-N 118.183 0.447 . . . . 55.21 110.174 179.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -65.15 -16.56 55.59 Favored 'Trans proline' 0 C--O 1.237 0.452 0 CA-C-N 118.553 0.519 . . . . 36.15 113.113 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -65.79 -34.08 77.34 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 118.084 0.402 . . . . 46.87 111.53 174.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' MET . . . . . . . . . . . . . 30.4 tpp -75.16 -40.97 59.1 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 121.024 -0.27 . . . . 37.93 111.638 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' LEU . . . . . . . . . . . . . 67.9 mt -65.38 -44.67 86.85 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.386 -0.525 . . . . 33.3 111.044 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 177' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 -57.04 -39.12 74.22 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.6 -0.44 . . . . 48.58 110.959 174.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 178' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -68.41 -46.98 68.49 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.864 -0.335 . . . . 51.14 111.038 178.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 5.5 m-30 -59.66 -39.61 85.01 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.499 -0.48 . . . . 37.76 111.294 -176.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' ALA . . . . . . . . . . . . . . . -68.53 -25.81 65.12 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.347 -0.541 . . . . 39.34 111.818 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 83.4 p -70.18 -40.88 74.41 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.434 -0.506 . . . . 45.64 111.54 -176.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 182' ' ' ILE . . . . . 0.505 HD12 HG11 ' B' ' 214' ' ' VAL . 5.0 pt -81.66 -31.6 11.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 120.189 -0.605 . . . . 49.7 111.513 -177.09 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 125.97 20.66 2.03 Favored Glycine 0 N--CA 1.449 -0.467 0 O-C-N 121.722 -0.611 . . . . 46.44 113.654 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 184' ' ' ILE . . . . . . . . . . . . . 11.6 mm -96.11 122.09 47.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 108.396 -0.965 . . . . 42.98 108.396 179.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 185' ' ' SER . . . . . 0.55 ' O ' ' OG ' ' B' ' 188' ' ' SER . 2.1 p -159.81 158.19 30.61 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.911 -1.144 . . . . 41.85 107.911 178.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 8.4 mt -47.6 141.01 5.56 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.655 -0.702 . . . . 38.45 110.999 -178.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 187' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 86.18 -12.24 0.62 Allowed 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 128.768 2.827 . . . . 38.74 112.772 178.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' SER . . . . . 0.55 ' OG ' ' O ' ' B' ' 185' ' ' SER . 2.1 p -72.16 134.54 45.78 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 119.274 0.943 . . . . 39.38 110.099 179.728 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 189' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' B' ' 207' ' ' ASP . 22.8 mtp85 -86.32 136.09 33.28 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.655 -0.498 . . . . 71.74 109.655 -178.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 190' ' ' LEU . . . . . . . . . . . . . 45.1 mt -123.3 149.23 45.09 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.167 0.508 . . . . 45.94 110.509 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 191' ' ' ARG . . . . . . . . . . . . . 20.5 ttp-105 -133.13 128.99 37.3 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.637 -0.875 . . . . 61.54 108.637 175.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 47.5 t -88.17 133.68 30.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 109.275 -0.639 . . . . 55.41 109.275 -173.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 5.5 mt -135.86 76.58 1.62 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 106.952 -1.499 . . . . 68.06 106.952 178.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 194' ' ' ALA . . . . . 1.115 ' HA ' ' HB2' ' B' ' 195' ' ' ARG . . . 64.42 129.38 0.02 OUTLIER 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.236 1.014 . . . . 82.86 109.374 -166.243 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 195' ' ' ARG . . . . . 1.115 ' HB2' ' HA ' ' B' ' 194' ' ' ALA . 0.0 OUTLIER 78.75 56.77 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 118.209 -0.901 . . . . 83.8 109.678 6.529 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 196' ' ' ARG . . . . . 0.567 ' HG2' ' HB1' ' B' ' 194' ' ' ALA . 0.8 OUTLIER -131.81 79.35 1.87 Allowed 'General case' 0 N--CA 1.487 1.397 0 CA-C-O 117.886 -1.054 . . . . 75.15 108.542 178.961 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 197' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -60.1 -45.05 94.24 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 117.488 -1.244 . . . . 74.64 110.514 -178.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 198' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -51.61 -31.88 26.69 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 123.984 0.802 . . . . 72.29 109.563 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 199' ' ' ALA . . . . . . . . . . . . . . . -92.92 -5.46 50.76 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.09 0.869 . . . . 76.91 112.948 179.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 200' ' ' GLY . . . . . . . . . . . . . . . 64.17 32.43 84.18 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 121.206 -0.521 . . . . 77.02 114.251 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -156.62 165.0 37.53 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.83 -0.804 . . . . 82.68 108.83 -178.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.416 ' O ' HG13 ' B' ' 202' ' ' ILE . 2.0 pt -131.74 141.35 45.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 108.676 -0.861 . . . . 66.77 108.676 172.562 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 1.1 t -98.21 138.0 36.13 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.285 -0.635 . . . . 59.86 109.285 177.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' VAL . . . . . . . . . . . . . 20.1 m -129.69 146.71 33.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.585 0.707 . . . . 57.9 109.406 179.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' ALA . . . . . . . . . . . . . . . -97.39 141.72 30.13 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.134 -1.061 . . . . 66.28 108.134 164.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' ILE . . . . . 0.461 HG12 ' C ' ' B' ' 208' ' ' SER . 5.8 tt -117.79 120.38 64.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 108.142 -1.059 . . . . 94.64 108.142 -177.722 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' B' ' 207' ' ' ASP . 1.4 p30 -141.49 89.61 2.23 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 106.095 -1.817 . . . . 125.5 106.095 179.738 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' SER . . . . . 0.461 ' C ' HG12 ' B' ' 206' ' ' ILE . 18.8 p . . . . . 0 N--CA 1.473 0.715 0 N-CA-C 118.307 2.706 . . . . 103.61 118.307 14.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 N-CA-C 113.302 0.081 . . . . 78.67 113.302 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' ALA . . . . . . . . . . . . . . . -63.37 161.67 13.7 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 122.078 0.942 . . . . 95.31 111.215 -173.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' THR . . . . . . . . . . . . . 1.3 m -112.88 127.62 56.24 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.043 -0.98 . . . . 103.83 108.947 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' VAL . . . . . 0.505 HG11 HD12 ' B' ' 182' ' ' ILE . 71.7 t -132.09 137.87 53.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 108.493 -0.929 . . . . 79.87 108.493 -176.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -106.57 132.4 52.61 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.423 -0.584 . . . . 76.11 109.423 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 2.5 mp -122.89 129.85 52.13 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.27 -0.641 . . . . 50.22 109.27 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . -68.46 163.62 48.95 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.276 -0.964 . . . . 45.76 112.054 173.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 218' ' ' SER . . . . . . . . . . . . . 47.0 t -52.79 -42.75 91.09 Favored Pre-proline 0 C--O 1.243 0.73 0 N-CA-C 114.006 1.113 . . . . 44.44 114.006 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -66.4 -31.52 42.61 Favored 'Trans proline' 0 C--O 1.237 0.474 0 CA-C-N 121.596 1.606 . . . . 50.53 113.29 176.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -71.45 -49.41 41.85 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.434 0.561 . . . . 48.52 111.207 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 221' ' ' ALA . . . . . . . . . . . . . . . -66.28 -19.77 65.91 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.432 0.53 . . . . 56.18 112.432 179.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 222' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -75.87 -9.82 58.92 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.907 0.706 . . . . 72.22 112.907 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 223' ' ' ALA . . . . . . . . . . . . . . . -109.45 29.09 7.88 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 118.39 0.541 . . . . 49.17 111.855 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' ILE . . . . . . . . . . . . . 19.4 mt -135.97 101.85 2.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 107.6 -1.259 . . . . 38.19 107.6 -177.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 225' ' ' TRP . . . . . 0.449 ' HB3' ' HB1' ' B' ' 151' ' ' ALA . 4.2 m-90 -89.03 141.95 28.05 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.713 -0.477 . . . . 39.11 109.713 172.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 226' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' B' ' 165' ' ' VAL . 3.0 m -136.81 157.61 36.29 Favored 'Isoleucine or valine' 0 C--O 1.231 0.102 0 CA-C-O 121.683 0.754 . . . . 32.6 110.45 -170.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 227' ' ' VAL . . . . . 0.414 HG23 ' HB2' ' B' ' 166' ' ' ALA . 76.7 t -115.94 116.01 51.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.127 -1.064 . . . . 44.98 108.127 -179.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 31.4 m -50.3 133.0 24.51 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.12 0.968 . . . . 52.56 112.872 -174.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 116.986 -1.483 . . . . 60.22 109.721 179.232 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' HOH . . . . . 0.53 ' O ' ' OG1' ' A' ' 148' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . 0.687 ' O ' ' NH2' ' A' ' 122' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' HOH . . . . . 0.416 ' O ' ' N ' ' A' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 401' ' ' HOH . . . . . 0.474 ' O ' ' NH1' ' B' ' 40' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_