data_6vid_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 6vid _Structure_validation_residue.Date_analyzed 2020-08-14 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.5 t . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.769 0.319 . . . . 63.17 111.008 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ARG . . . . . 0.403 ' O ' ' NE2' ' A' ' 44' ' ' GLN . 82.7 mtt180 -118.96 15.05 13.34 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 112.879 0.696 . . . . 51.27 112.879 -178.118 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -102.37 102.72 13.09 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.726 -0.842 . . . . 65.52 108.726 -176.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PHE . . . . . 0.524 ' N ' ' OE1' ' A' ' 44' ' ' GLN . 54.3 m-85 -96.07 11.06 35.51 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.961 0.726 . . . . 56.09 112.961 178.735 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASN . . . . . 0.489 ' ND2' ' O ' ' A' ' 44' ' ' GLN . 26.2 m-80 -65.41 138.86 58.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 118.239 0.472 . . . . 65.54 111.277 -175.821 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.66 -174.82 19.28 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.48 -0.867 . . . . 56.08 112.248 171.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.9 m -102.95 127.24 50.25 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 122.967 0.507 . . . . 50.54 109.808 -179.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 58.1 m95 -120.83 120.78 36.57 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.587 -0.894 . . . . 52.13 108.587 -176.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -103.66 131.7 50.58 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.47 0.708 . . . . 78.07 109.254 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 57.8 ttm -68.02 141.1 56.32 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.062 0.764 . . . . 46.37 113.062 -173.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.272 2.4 mt-10 -124.73 -3.77 7.71 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 116.407 2.003 . . . . 79.06 116.407 163.642 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.4 m -145.51 161.12 40.49 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 120.33 1.423 . . . . 64.59 111.252 165.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -156.59 90.31 1.16 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 104.798 -2.297 . . . . 45.41 104.798 -178.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -103.76 135.24 45.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.432 -0.804 . . . . 72.49 110.035 -175.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.1 t30 50.69 46.47 25.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.883 0.849 . . . . 46.21 111.829 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -73.63 -38.38 65.06 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 115.543 -0.753 . . . . 33.2 110.863 170.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -69.44 -39.08 78.01 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 120.774 -0.37 . . . . 54.03 111.593 -176.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.06 -39.86 94.9 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 119.781 -1.2 . . . . 39.1 112.447 175.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -60.78 -44.42 96.82 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 122.348 -0.501 . . . . 39.52 111.436 175.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 59.0 mtm -69.98 -35.84 74.73 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 119.736 -0.785 . . . . 53.23 111.7 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -62.09 -41.64 98.39 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.107 -0.371 . . . . 51.44 111.393 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.37 70.61 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.162 -0.615 . . . . 43.53 111.698 176.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 21.9 mt -78.47 3.6 15.5 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.101 0.778 . . . . 35.1 113.101 176.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 55.13 49.28 17.75 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 122.098 0.951 . . . . 56.11 110.621 -177.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.1 mt -89.09 158.73 2.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.756 -1.201 . . . . 38.73 107.756 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -95.19 145.2 25.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.384 0.612 . . . . 51.81 110.413 -168.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -40.62 -45.26 2.3 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.601 1.161 . . . . 40.75 112.986 -178.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.4 -59.68 4.96 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 120.973 0.416 . . . . 35.8 111.828 -179.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.3 p -71.59 -21.54 61.85 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 119.066 -1.054 . . . . 40.68 111.975 -176.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.2 mtm105 -69.66 -42.65 73.93 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.494 -0.883 . . . . 42.11 110.661 172.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . 0.551 ' NZ ' ' O ' ' A' ' 301' ' ' HOH . 7.0 mmpt? -66.12 -32.1 73.35 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 111.81 0.3 . . . . 42.49 111.81 178.431 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 9.3 mt -72.54 -47.39 51.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 C-N-CA 118.864 -1.134 . . . . 54.99 110.592 174.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.74 -24.94 65.41 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 121.775 -0.578 . . . . 34.63 111.876 -173.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 33.2 m -72.81 -13.47 16.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 119.518 -0.873 . . . . 37.59 111.512 176.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 52.4 ttm-85 -103.91 36.41 2.34 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.723 0.809 . . . . 51.59 111.373 178.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 67.3 mt -134.18 169.78 16.66 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 120.817 -1.177 . . . . 34.12 110.676 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.4 t -142.87 158.21 43.84 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 106.503 -1.665 . . . . 39.89 106.503 167.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -127.58 151.07 49.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.478 0.656 . . . . 36.39 110.864 -169.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.0 m -132.43 121.57 23.62 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.423 -1.325 . . . . 45.33 107.423 173.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -111.15 123.28 49.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.707 -0.479 . . . . 64.15 109.707 -174.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.2 m -98.53 116.37 41.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.556 0 N-CA-C 107.526 -1.287 . . . . 54.58 107.526 172.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 55.3 mt -107.5 127.31 63.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 108.617 -0.883 . . . . 58.18 108.617 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -113.56 113.43 25.09 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 124.342 1.057 . . . . 83.89 109.337 170.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . 0.524 ' OE1' ' N ' ' A' ' 4' ' ' PHE . 33.8 tt0 -127.82 116.63 20.46 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.106 -0.701 . . . . 56.4 109.106 -171.66 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -116.03 101.48 8.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.263 -1.754 . . . . 75.42 106.263 173.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.45 -109.13 2.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.89 -0.671 . . . . 58.32 112.578 -177.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -103.81 2.7 33.09 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 112.867 0.691 . . . . 58.21 112.867 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . . . -94.79 128.97 41.89 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 118.436 0.562 . . . . 47.7 109.761 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -122.98 139.01 54.52 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.211 0.604 . . . . 54.23 110.435 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . . . -136.02 107.65 6.98 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.46 -1.311 . . . . 53.08 107.46 173.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.7 p -109.32 142.92 39.53 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.552 -0.536 . . . . 57.32 109.552 -174.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -131.21 119.39 21.78 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.546 -0.909 . . . . 66.64 108.546 172.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -106.37 106.77 17.44 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.766 0.826 . . . . 44.93 109.56 -175.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.7 p -91.14 142.58 27.59 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 123.52 0.728 . . . . 44.01 109.747 178.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.8 m -116.47 138.33 51.46 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.109 -0.496 . . . . 39.79 110.159 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 14.0 t -144.63 149.85 36.42 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.019 -1.104 . . . . 49.18 108.019 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -65.89 162.35 19.24 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.924 0.869 . . . . 39.95 110.464 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.2 tp -80.41 168.3 19.16 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.421 -0.809 . . . . 50.88 109.811 -172.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -112.35 114.85 27.81 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.745 -0.661 . . . . 67.89 109.404 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -83.17 101.81 11.46 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.162 0.985 . . . . 59.44 109.877 178.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -98.12 136.46 38.33 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.775 -0.824 . . . . 59.86 108.775 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 63.2 t -138.64 121.2 18.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 108.15 -1.055 . . . . 48.33 108.15 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -119.87 129.95 54.64 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 109.724 -0.473 . . . . 56.79 109.724 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -151.86 160.12 43.64 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.625 0.726 . . . . 39.39 109.237 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . . . -120.6 140.24 51.82 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.745 -1.116 . . . . 45.47 108.405 170.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.4 t -71.48 125.43 29.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 109.581 -0.526 . . . . 49.81 109.581 -173.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 100.96 -21.68 42.61 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-O 119.378 -0.679 . . . . 46.44 114.211 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.8 t -100.51 123.46 53.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.276 -1.009 . . . . 56.72 108.276 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -72.9 136.18 45.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.987 -1.006 . . . . 75.99 109.566 177.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -132.13 167.87 18.99 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.83 0.824 . . . . 54.81 110.768 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -99.98 126.68 46.2 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 114.874 -1.057 . . . . 64.1 109.162 179.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -121.26 123.58 42.54 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.483 -0.562 . . . . 57.83 109.483 -177.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . . . -102.16 104.35 14.93 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 107.011 -1.478 . . . . 57.29 107.011 171.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.2 p -78.82 69.29 4.96 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 122.311 1.053 . . . . 54.07 110.282 -173.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . . . -65.13 -30.58 71.52 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.209 -0.905 . . . . 45.55 112.079 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.0 p -56.15 -32.47 64.32 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 113.619 0.97 . . . . 65.24 113.619 173.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -119.94 -103.27 0.41 Allowed 'General case' 0 C--O 1.241 0.622 0 N-CA-C 109.589 -0.522 . . . . 60.84 109.589 -168.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . 0.574 ' N ' ' OD1' ' A' ' 78' ' ' ASP . 4.7 p-10 -90.1 2.37 55.34 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 121.101 -0.999 . . . . 56.06 113.494 -171.589 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 49.53 50.83 17.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.889 0.852 . . . . 56.87 111.167 -174.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . 0.475 ' NH1' ' OE2' ' A' ' 100' ' ' GLU . 7.3 mtm-85 -110.15 156.5 20.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.712 0.768 . . . . 51.33 110.05 175.2 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -97.57 126.56 42.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 61.79 108.546 174.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 22.5 m -132.75 151.32 34.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 108.036 -1.098 . . . . 51.67 108.036 177.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.2 tppt? -98.43 112.92 24.78 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 106.325 -1.732 . . . . 75.6 106.325 172.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -110.89 143.9 40.77 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.917 0.389 . . . . 52.99 110.397 -170.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.0 tp -135.3 138.51 43.52 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.905 -0.776 . . . . 43.03 108.905 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.1 t -113.13 136.26 50.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.762 -0.829 . . . . 45.77 108.762 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.5 m -134.07 157.51 45.96 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.544 0.688 . . . . 47.1 109.522 -179.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -91.62 120.53 32.47 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.918 -1.037 . . . . 39.51 109.584 173.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 76.1 mt-10 -115.17 90.69 3.4 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 104.256 -2.498 . . . . 46.17 104.256 168.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.59 -112.04 4.07 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 110.014 -1.234 . . . . 41.99 110.014 -173.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -114.31 27.03 9.78 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 122.744 0.418 . . . . 50.63 111.39 171.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 92.1 t -114.51 133.03 61.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 108.482 -0.932 . . . . 39.6 108.482 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.9 mt -86.33 110.78 19.9 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.506 -1.294 . . . . 40.01 107.506 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.0 t -110.48 120.59 61.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.429 -1.323 . . . . 47.91 107.429 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 13.4 t -117.66 131.08 56.69 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.999 -0.741 . . . . 37.34 108.999 -177.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.8 p -107.25 133.86 50.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 107.69 -1.226 . . . . 47.59 107.69 174.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -116.19 92.83 4.01 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.042 -1.466 . . . . 48.97 107.042 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 45.6 mmtt -75.45 133.98 40.97 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 110.027 -0.36 . . . . 58.7 110.027 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.12 -151.3 11.45 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.993 -0.549 . . . . 65.4 112.902 -178.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . 0.475 ' OE2' ' NH1' ' A' ' 80' ' ' ARG . 57.3 tt0 -64.32 -39.62 94.27 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.415 -0.514 . . . . 86.79 111.568 -178.345 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -83.32 136.15 34.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.018 0.437 . . . . 66.87 110.485 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -89.84 144.95 25.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.42 0.629 . . . . 80.84 110.781 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 1.8 t30 60.57 45.04 10.96 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.265 -0.88 . . . . 82.97 111.306 177.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.5 ttt85 -104.4 129.49 52.34 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.237 -0.653 . . . . 54.8 109.237 -177.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 176.44 -162.89 31.79 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.267 -0.968 . . . . 41.94 111.125 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 36.6 p-90 -159.19 166.97 30.25 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 119.63 -0.828 . . . . 44.28 110.442 176.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -133.44 139.01 46.48 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 114.632 -1.167 . . . . 45.11 109.694 176.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -132.15 130.89 41.71 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 124.026 0.931 . . . . 45.21 109.363 -176.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 20.9 p90 -154.79 169.5 23.83 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 119.261 -0.976 . . . . 48.43 110.381 176.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 13.1 mm -120.56 131.04 73.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 108.412 -0.959 . . . . 46.25 108.412 -173.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . . . -125.63 108.44 11.56 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 107.641 -1.244 . . . . 51.66 107.641 172.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 70.35 -105.93 1.71 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 110.199 -1.16 . . . . 64.45 110.199 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -123.94 21.26 9.07 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 122.658 0.383 . . . . 67.7 111.398 175.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -118.57 144.67 45.94 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.015 0.436 . . . . 55.18 110.358 179.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 24.0 tp -104.95 135.85 45.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.723 -0.671 . . . . 40.64 109.387 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -120.8 126.92 51.34 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.924 -0.769 . . . . 45.69 108.924 -179.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 23.8 tp -131.04 120.75 23.89 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.794 -0.817 . . . . 49.63 108.794 -177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -112.37 112.88 24.77 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.901 -1.148 . . . . 65.65 107.901 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 15.4 mt -92.62 130.13 38.35 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.228 -1.027 . . . . 46.54 108.228 175.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 22.2 m -127.7 103.06 7.09 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.077 0.551 . . . . 59.66 110.678 -167.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 34.7 t -122.34 155.27 36.34 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.103 -1.073 . . . . 60.11 108.103 168.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 20.88 -105.15 0.01 OUTLIER Glycine 0 C--N 1.336 0.582 0 N-CA-C 116.141 1.217 . . . . 71.79 116.141 -169.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -100.05 -19.09 16.69 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.568 0.951 . . . . 76.89 113.568 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -87.77 118.74 27.49 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 122.859 0.463 . . . . 64.4 111.281 -176.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 22.9 t -103.82 145.57 12.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 108.409 -0.96 . . . . 50.94 108.409 169.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 32.1 t -127.4 123.41 36.09 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.361 -0.977 . . . . 47.01 108.361 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . . . -106.66 125.63 51.25 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 110.132 -0.321 . . . . 44.2 110.132 -177.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -128.88 138.01 51.78 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 108.504 -0.924 . . . . 45.44 108.504 176.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 3.6 p -127.1 139.08 52.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.554 -0.906 . . . . 43.6 108.554 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -121.34 145.0 48.33 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 123.99 0.916 . . . . 46.2 109.121 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.1 tttp -102.01 140.85 35.74 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.44 -0.948 . . . . 70.57 108.44 174.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -78.06 133.05 37.97 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 120.648 -0.421 . . . . 43.54 110.244 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.93 -0.577 . . . . 65.5 110.837 -178.214 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' THR . . . . . . . . . . . . . 63.0 p . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.781 0.324 . . . . 49.65 110.86 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ARG . . . . . 0.517 ' O ' ' NE2' ' B' ' 44' ' ' GLN . 7.6 mmt180 68.94 -13.59 0.33 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.282 1.033 . . . . 44.81 113.531 173.51 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -105.2 98.26 7.99 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.983 -1.118 . . . . 40.8 107.983 176.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -99.42 8.82 44.27 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 112.583 0.586 . . . . 36.77 112.583 177.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -66.14 137.89 57.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.137 0.494 . . . . 35.75 111.312 -174.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 128.67 -174.93 18.88 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-O 121.872 0.707 . . . . 32.28 112.002 171.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 90.4 m -103.2 127.53 50.47 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.237 -0.653 . . . . 41.62 109.237 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' TRP . . . . . . . . . . . . . 62.5 m95 -120.56 122.22 40.09 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.89 -0.782 . . . . 37.6 108.89 -175.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -102.78 130.87 49.9 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.599 0.76 . . . . 79.54 110.074 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 38.5 ttm -67.74 142.83 56.15 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.468 0.651 . . . . 42.29 112.026 -174.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -123.29 -20.67 5.58 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 113.624 0.972 . . . . 64.71 113.624 172.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -143.83 160.55 40.57 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.819 0.818 . . . . 49.11 110.201 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -160.64 91.86 0.93 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 106.226 -1.768 . . . . 47.45 106.226 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -103.0 134.18 46.88 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.126 -0.488 . . . . 72.02 110.234 -175.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ASN . . . . . . . . . . . . . 50.4 t30 50.09 47.6 23.23 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.753 0.787 . . . . 49.27 111.796 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -73.59 -39.32 64.7 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.076 -0.649 . . . . 44.34 110.99 171.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -66.38 -40.85 89.96 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 120.736 0.303 . . . . 90.63 110.293 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.95 -39.17 94.79 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.551 -0.833 . . . . 50.01 112.31 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -61.16 -44.28 97.55 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.572 -0.451 . . . . 47.31 111.168 174.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 59.4 mtm -69.74 -36.22 75.64 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.799 -0.76 . . . . 47.52 111.693 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -62.15 -41.58 98.42 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 122.18 -0.325 . . . . 56.84 111.088 174.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.23 -30.55 71.18 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.988 -0.685 . . . . 49.27 110.826 175.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . 0.431 ' O ' ' NH2' ' A' ' 80' ' ' ARG . 40.6 mt -79.77 -0.97 36.62 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 119.222 -0.418 . . . . 50.47 111.912 172.382 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 52.17 52.47 14.25 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 122.119 0.961 . . . . 75.37 110.977 -178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 35.9 mt -86.05 159.72 3.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 107.728 -1.212 . . . . 51.18 107.728 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -93.17 144.91 24.82 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.58 0.705 . . . . 52.7 110.664 -167.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -39.85 -43.16 1.42 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.228 1.411 . . . . 60.66 114.37 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.62 -61.77 2.35 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 120.667 -0.413 . . . . 34.69 111.79 -178.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 15.5 p -74.1 -16.71 61.01 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 119.411 -0.916 . . . . 49.15 111.954 -177.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 10.6 mtm-85 -68.99 -41.61 77.6 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.662 -0.815 . . . . 56.24 110.424 170.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 38.6 mmtt -67.57 -31.82 72.15 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 121.102 -0.239 . . . . 53.82 111.441 175.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 19.3 mt -69.9 -49.81 53.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 C-N-CA 119.623 -0.831 . . . . 42.71 110.608 176.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.52 -24.5 63.75 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.821 0.675 . . . . 46.81 112.821 -173.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 2.0 p -73.51 -14.12 16.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 112.365 0.506 . . . . 48.75 112.365 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ARG . . . . . 0.455 ' NH2' ' O ' ' B' ' 76' ' ' SER . 4.2 mtp85 -105.54 40.6 1.52 Allowed 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.174 0.59 . . . . 59.45 111.825 176.438 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.46 171.96 12.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 122.397 1.094 . . . . 45.33 110.987 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' THR . . . . . . . . . . . . . 1.4 m -140.34 155.83 46.65 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 106.321 -1.733 . . . . 49.88 106.321 169.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -127.89 149.45 50.3 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.637 0.732 . . . . 38.76 109.885 -172.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 2.8 m -133.39 123.6 25.65 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.39 -1.337 . . . . 52.38 107.39 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -109.75 120.58 42.93 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.924 -0.769 . . . . 57.65 108.924 -176.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.79 114.01 36.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 106.667 -1.605 . . . . 36.14 106.667 172.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 57.2 mt -108.52 126.07 65.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 108.447 -0.946 . . . . 36.1 108.447 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -113.2 116.48 29.86 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 107.345 -1.354 . . . . 62.82 107.345 169.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLN . . . . . 0.517 ' NE2' ' O ' ' B' ' 2' ' ' ARG . 34.8 tt0 -125.44 117.89 24.64 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.494 -0.558 . . . . 39.78 109.494 -170.64 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -115.1 99.32 7.35 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.264 -1.384 . . . . 46.4 107.264 175.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.27 -109.49 2.76 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.173 -0.537 . . . . 40.2 112.312 -177.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -103.7 2.76 33.47 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.47 0.544 . . . . 50.87 112.47 177.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ASN . . . . . . . . . . . . . 11.5 m-20 -93.46 130.25 39.34 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.444 -0.576 . . . . 50.38 109.444 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -122.34 141.87 51.1 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.8 0.44 . . . . 43.74 110.237 -175.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -132.33 115.36 15.52 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.096 -1.075 . . . . 57.92 108.096 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 26.9 m -103.98 141.5 36.07 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 124.547 1.139 . . . . 50.07 111.152 -171.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 6.0 tttm -134.25 115.72 14.47 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 108.097 -1.075 . . . . 60.51 108.097 166.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -109.46 102.43 11.31 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.268 -1.012 . . . . 41.47 108.268 -178.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 20.7 p -95.65 141.87 28.64 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 122.909 0.484 . . . . 50.47 110.249 177.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.3 m -118.66 141.58 48.47 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 122.886 0.475 . . . . 49.9 110.536 179.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 10.5 m -140.61 161.15 38.43 Favored 'General case' 0 C--N 1.334 -0.094 0 N-CA-C 108.155 -1.054 . . . . 69.1 108.155 -176.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -82.41 158.02 23.46 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 118.224 -1.39 . . . . 37.75 110.666 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.9 mt -86.73 117.59 25.59 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.237 -0.892 . . . . 38.16 110.684 -173.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -58.63 116.76 3.91 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.376 -0.375 . . . . 53.53 111.196 174.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -81.85 120.19 24.86 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.706 -0.479 . . . . 63.12 109.706 177.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -107.97 136.51 47.55 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 122.787 0.435 . . . . 56.79 111.064 -176.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 27.3 m -139.78 121.4 15.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 108.168 -1.049 . . . . 58.41 108.168 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -119.77 127.13 52.52 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.926 -0.768 . . . . 71.56 108.926 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -153.67 159.32 42.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.525 0.679 . . . . 58.12 109.22 -176.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 29.2 p -125.3 141.89 51.82 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.936 -1.029 . . . . 64.91 109.709 169.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 6.8 t -70.84 128.44 34.07 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-N 115.603 -0.726 . . . . 66.31 110.232 -172.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 106.38 -23.07 29.48 Favored Glycine 0 C--N 1.335 0.495 0 N-CA-C 116.397 1.319 . . . . 74.74 116.397 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 1.5 m -102.52 127.75 55.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 119.253 1.526 . . . . 66.62 108.993 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . . . -69.33 137.49 52.98 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.223 -0.658 . . . . 69.72 109.223 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -131.51 168.75 17.13 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.857 0.837 . . . . 66.97 109.852 -179.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -97.98 125.16 42.78 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.919 -1.037 . . . . 89.91 108.768 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -121.63 123.84 42.9 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.319 -0.993 . . . . 74.77 108.319 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . . . -97.98 101.18 12.6 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 103.184 -2.895 . . . . 54.86 103.184 170.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.6 t -76.52 72.46 3.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 122.531 1.158 . . . . 62.14 108.984 -171.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' LYS . . . . . 0.765 ' O ' ' N ' ' B' ' 77' ' ' LEU . 32.5 mttt -63.92 -149.87 0.01 OUTLIER 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.791 -1.559 . . . . 70.39 106.791 172.48 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' SER . . . . . 0.513 ' OG ' ' O ' ' B' ' 75' ' ' LYS . 83.5 p 58.96 -37.02 0.06 Allowed 'General case' 0 N--CA 1.465 0.319 0 O-C-N 121.441 -0.787 . . . . 61.29 111.484 177.692 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' LEU . . . . . 0.765 ' N ' ' O ' ' B' ' 75' ' ' LYS . 14.6 mt -127.0 -104.4 0.33 Allowed 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.513 -0.551 . . . . 57.13 109.513 -171.092 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ASP . . . . . 0.498 ' N ' ' OD1' ' B' ' 78' ' ' ASP . 8.0 p-10 -92.44 -1.7 56.81 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 113.827 1.047 . . . . 55.49 113.827 -171.376 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 46.69 54.6 8.7 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.728 0.775 . . . . 77.77 111.866 -178.641 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 17.0 mtt180 -107.5 160.04 15.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.567 0.698 . . . . 61.29 110.144 176.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . . . -96.56 125.29 40.93 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.589 -0.893 . . . . 65.33 108.589 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 28.6 m -134.38 151.55 32.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.65 0.738 . . . . 59.94 109.726 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 2.9 mtpt -98.65 113.08 25.0 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 106.147 -1.797 . . . . 70.06 106.147 171.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -110.26 141.28 43.46 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.934 0.397 . . . . 58.62 110.443 -171.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 11.7 tp -137.46 128.87 28.14 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.77 -0.826 . . . . 68.8 108.77 175.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 p -112.63 138.55 41.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.967 -1.123 . . . . 66.4 107.967 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 3.1 p -132.82 157.61 44.56 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.779 0.799 . . . . 67.19 110.016 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -92.08 120.0 32.29 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 114.617 -1.174 . . . . 80.76 108.858 172.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -115.27 93.37 4.26 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 104.97 -2.233 . . . . 90.97 104.97 169.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.8 -111.46 3.74 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 109.728 -1.349 . . . . 81.48 109.728 -173.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . . . -115.37 27.0 9.65 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.868 0.322 . . . . 77.27 111.868 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.7 m -114.76 133.23 61.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 N-CA-C 108.764 -0.828 . . . . 68.48 108.764 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 12.8 mt -88.65 107.89 19.17 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 107.33 -1.359 . . . . 62.87 107.33 175.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 5.1 m -112.92 119.28 60.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 108.028 -1.101 . . . . 63.89 108.028 179.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 18.1 t -118.77 130.74 55.96 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.909 -0.775 . . . . 70.16 108.909 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.4 p -108.79 136.28 45.05 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 N-CA-C 107.963 -1.125 . . . . 56.11 107.963 173.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -113.93 94.81 5.0 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 107.548 -1.278 . . . . 62.47 107.548 -178.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . . . -74.01 134.92 43.09 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.832 -0.622 . . . . 64.68 110.548 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.05 -149.82 10.21 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.438 -0.801 . . . . 71.03 112.562 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -63.39 -39.63 95.05 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.642 -0.423 . . . . 71.92 111.538 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . . . -83.84 136.26 34.19 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.009 0.433 . . . . 72.97 110.676 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . . . -90.67 144.91 25.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.994 -0.548 . . . . 62.25 110.761 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 t30 60.56 44.02 12.16 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.681 -0.69 . . . . 72.8 111.777 176.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -105.16 130.47 53.32 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.735 -0.468 . . . . 61.58 109.735 -177.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.78 -161.72 29.02 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 119.818 -1.182 . . . . 47.96 111.648 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 51.9 p-90 -160.24 166.32 29.81 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.792 0.806 . . . . 56.28 110.475 175.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 11.9 mttt -132.43 140.68 48.53 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.566 -1.197 . . . . 74.45 109.892 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -131.86 131.39 42.74 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 123.533 0.733 . . . . 65.98 109.099 -178.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' TRP . . . . . . . . . . . . . 33.7 p90 -153.63 167.79 28.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.498 0.666 . . . . 74.5 109.936 175.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ILE . . . . . . . . . . . . . 19.6 mm -122.38 132.84 70.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 115.579 -0.737 . . . . 74.13 109.557 -171.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -125.64 106.45 9.75 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.787 -1.19 . . . . 74.66 107.787 171.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . 69.48 -105.09 1.42 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.219 -0.991 . . . . 84.81 111.754 179.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . . . -122.5 21.73 10.12 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.14 0.576 . . . . 80.66 111.15 176.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LYS . . . . . 0.415 ' NZ ' ' OE2' ' D' ' 11' ' ' GLU . 2.1 mmtt -117.75 142.67 47.0 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.941 -0.392 . . . . 68.36 109.941 179.177 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.3 tt -106.82 137.31 45.1 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.077 -0.712 . . . . 56.06 109.077 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -120.44 126.83 51.42 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.551 -0.907 . . . . 70.89 108.551 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 39.2 tp -130.6 120.24 23.69 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.936 -0.764 . . . . 54.73 108.936 -176.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -112.36 111.07 21.67 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.965 -1.124 . . . . 71.6 107.965 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 17.8 mt -94.83 130.45 41.41 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.206 -0.664 . . . . 54.71 109.206 176.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 7.3 p -124.73 145.58 49.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.718 0.294 . . . . 57.49 110.5 -169.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' CYS . . . . . . . . . . . . . 15.4 t -166.92 120.41 1.01 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.394 -0.821 . . . . 64.99 110.211 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . 56.0 -111.89 2.83 Favored Glycine 0 C--N 1.334 0.47 0 N-CA-C 111.506 -0.638 . . . . 63.73 111.506 -169.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -105.45 -11.71 16.31 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.627 0.603 . . . . 79.55 112.627 173.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' GLN . . . . . 0.445 ' OE1' ' ND2' ' D' ' 15' ' ' ASN . 72.7 mm-40 -86.19 113.46 22.24 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.874 -0.787 . . . . 63.39 108.874 -175.449 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 9.8 p -108.05 148.46 12.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 108.217 -1.031 . . . . 51.38 108.217 169.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' CYS . . . . . . . . . . . . . 5.2 t -125.18 123.65 40.07 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.266 -1.383 . . . . 49.17 107.266 178.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . . . -104.27 126.06 51.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.298 -0.63 . . . . 48.6 109.298 -176.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -127.18 140.59 52.14 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.769 -0.826 . . . . 57.19 108.769 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' VAL . . . . . . . . . . . . . 54.7 t -123.37 136.53 59.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 108.257 -1.016 . . . . 57.32 108.257 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -123.47 141.52 51.91 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.317 -0.623 . . . . 51.05 109.317 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' LYS . . . . . . . . . . . . . . . -104.7 141.0 37.24 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.939 -0.763 . . . . 52.83 108.939 174.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . . . -78.61 133.63 37.27 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.093 -0.643 . . . . 57.51 109.366 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 10.8 tptt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.164 -0.471 . . . . 80.03 110.799 -177.078 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.535 0.375 0 N-CA-C 109.605 -0.517 . . . . 78.17 109.605 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' ARG . . . . . . . . . . . . . . . -84.88 81.03 9.07 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 122.334 1.064 . . . . 81.07 109.7 -171.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . . . -163.91 100.15 0.88 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 114.936 -1.029 . . . . 69.42 109.253 169.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -97.35 12.4 33.23 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 113.769 1.026 . . . . 72.7 113.769 -178.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -64.38 137.79 58.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 118.483 0.583 . . . . 72.04 111.233 -175.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.38 -175.6 18.87 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-O 122.169 0.872 . . . . 67.68 112.265 171.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' THR . . . . . . . . . . . . . 26.8 m -103.57 127.29 51.01 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 114.829 -0.685 . . . . 65.33 109.796 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' TRP . . . . . . . . . . . . . 38.1 m95 -122.86 122.32 38.35 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.374 0.67 . . . . 67.66 109.619 -175.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' GLU . . . . . . . . . . . . . . . -104.06 131.03 51.74 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 122.89 0.476 . . . . 61.16 110.138 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' MET . . . . . . . . . . . . . 47.9 ttm -67.52 144.83 55.45 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.173 0.511 . . . . 55.91 112.063 -175.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -121.46 -21.05 6.39 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 114.488 1.292 . . . . 73.14 114.488 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 17.6 m -146.86 161.8 39.97 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 122.151 0.977 . . . . 61.26 110.624 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -156.54 91.99 1.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 103.886 -2.635 . . . . 64.62 103.886 -176.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -101.44 134.44 44.53 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.177 -0.675 . . . . 77.71 109.177 -175.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 50.12 46.3 24.79 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 122.017 0.913 . . . . 67.83 110.694 -175.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -74.05 -39.89 63.2 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.433 -0.803 . . . . 69.79 111.039 171.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -71.37 -36.96 71.63 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 119.889 -0.724 . . . . 103.01 111.886 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.54 93.06 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 119.728 -1.225 . . . . 71.95 112.356 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -59.05 -44.25 91.77 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 122.449 -0.442 . . . . 69.82 110.986 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' MET . . . . . . . . . . . . . 24.2 mtm -70.41 -31.5 68.73 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.814 -0.354 . . . . 83.19 111.416 177.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . . . -60.01 -42.22 93.85 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.797 -0.361 . . . . 72.97 110.776 173.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.83 -28.34 69.95 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.337 -0.545 . . . . 71.68 111.071 174.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' LEU . . . . . . . . . . . . . 28.7 mt -77.5 2.28 16.75 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 112.658 0.614 . . . . 70.27 112.658 175.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 54.06 46.27 25.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.827 0.822 . . . . 82.13 111.745 -177.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' ILE . . . . . . . . . . . . . 7.4 mt -93.2 162.33 2.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 107.662 -1.236 . . . . 80.7 107.662 173.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -90.19 148.46 22.93 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.965 0.906 . . . . 78.7 110.476 -166.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -53.59 -34.67 59.22 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.372 -0.831 . . . . 76.02 111.469 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.1 -58.7 7.48 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.049 0.452 . . . . 81.77 110.988 176.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 1.6 m -71.9 -23.19 61.45 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.705 0.631 . . . . 77.6 112.705 -175.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' ARG . . . . . . . . . . . . . 2.0 mtm180 -74.84 -41.78 59.21 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 119.747 -0.781 . . . . 79.01 111.775 174.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . . . -67.14 -30.83 70.93 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.201 -0.599 . . . . 84.06 111.04 175.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . . . -71.0 -49.37 49.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.508 -0.477 . . . . 82.67 110.647 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.31 -22.91 62.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.414 0.894 . . . . 78.31 113.414 -173.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' VAL . . . . . . . . . . . . . 1.4 p -72.14 -11.78 15.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 113.459 0.911 . . . . 79.95 113.459 -176.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' ARG . . . . . . . . . . . . . . . -104.04 41.41 1.3 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-N 118.35 0.523 . . . . 82.01 112.328 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 11.0 mp -130.34 173.08 11.16 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 121.345 -0.847 . . . . 76.72 109.553 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' THR . . . . . . . . . . . . . 2.4 t -143.87 159.42 42.58 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.742 -0.836 . . . . 66.6 108.742 166.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -126.56 152.17 46.93 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.134 -0.939 . . . . 68.65 110.238 -169.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' THR . . . . . 0.431 ' N ' ' O ' ' C' ' 54' ' ' THR . 9.0 m -133.76 123.2 24.49 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.141 -1.059 . . . . 70.19 108.141 174.852 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -109.95 120.37 42.26 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.939 -0.763 . . . . 75.61 108.939 -176.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 t -101.27 114.49 40.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 107.255 -1.387 . . . . 69.72 107.255 172.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' ILE . . . . . . . . . . . . . 61.6 mt -106.04 125.99 61.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 N-CA-C 108.074 -1.084 . . . . 74.41 108.074 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.64 117.91 33.6 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.605 -1.257 . . . . 89.92 107.605 171.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -124.27 116.84 23.3 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.711 -0.848 . . . . 72.68 108.711 -171.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -114.95 99.66 7.63 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 106.731 -1.581 . . . . 75.44 106.731 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.25 -108.95 2.42 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.823 -0.703 . . . . 73.94 111.366 -176.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -104.65 2.27 30.38 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.979 0.733 . . . . 79.36 112.979 177.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -94.41 131.44 40.07 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 122.939 0.495 . . . . 74.91 110.275 179.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -121.73 140.0 52.87 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 122.678 0.391 . . . . 66.81 110.268 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' LYS . . . . . . . . . . . . . . . -133.62 110.25 9.76 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 107.516 -1.29 . . . . 67.78 107.516 173.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' THR . . . . . . . . . . . . . . . -108.69 141.38 40.75 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.808 0.443 . . . . 81.58 109.978 -174.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' LYS . . . . . . . . . . . . . . . -133.3 118.23 18.28 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.038 -1.097 . . . . 79.33 108.038 171.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -107.0 104.81 14.58 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.155 -0.683 . . . . 84.47 109.155 -176.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' THR . . . . . 0.431 ' O ' ' N ' ' C' ' 39' ' ' THR . 1.3 m -92.55 136.89 32.83 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.549 -0.537 . . . . 83.15 109.549 177.427 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' SER . . . . . . . . . . . . . 1.2 t -122.69 144.09 49.37 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.008 -0.542 . . . . 90.13 111.003 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' THR . . . . . 0.546 ' OG1' ' N ' ' C' ' 57' ' ' PHE . 1.4 p -135.6 -136.64 0.15 Allowed 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.013 -1.106 . . . . 78.9 108.013 -179.607 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' PHE . . . . . 0.546 ' N ' ' OG1' ' C' ' 56' ' ' THR . 4.4 m-85 -119.24 -167.73 1.45 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.646 0.736 . . . . 79.73 111.511 -175.99 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' LEU . . . . . . . . . . . . . . . -79.65 -28.09 40.86 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.474 0.916 . . . . 88.21 113.474 -167.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 56.58 79.06 0.19 Allowed 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.16 -0.681 . . . . 81.67 109.16 178.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' TYR . . . . . . . . . . . . . . . -80.67 120.37 24.5 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.679 0.276 . . . . 85.22 110.776 -177.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.53 140.8 41.37 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.749 0.82 . . . . 92.39 109.898 -177.498 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . . 2.7 t -133.99 122.7 42.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 108.497 -0.927 . . . . 91.03 108.497 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -119.31 125.45 49.1 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.709 -0.849 . . . . 97.32 108.709 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -156.72 161.98 39.8 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.516 0.674 . . . . 94.4 110.224 -176.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' THR . . . . . . . . . . . . . . . -120.93 135.97 55.07 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.564 -1.273 . . . . 86.08 107.564 165.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 71.2 t -74.79 127.0 36.31 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 N-CA-C 109.502 -0.555 . . . . 97.48 109.502 -172.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.46 -21.04 42.45 Favored Glycine 0 N--CA 1.441 -0.989 0 CA-C-O 119.513 -0.604 . . . . 91.88 113.296 -173.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' VAL . . . . . . . . . . . . . 3.2 t -100.11 128.48 52.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 108.125 -1.065 . . . . 94.2 108.125 178.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' GLU . . . . . . . . . . . . . . . -69.49 136.76 51.89 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.289 0.566 . . . . 84.82 112.328 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' PHE . . . . . . . . . . . . . . . -134.19 166.08 23.61 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.885 0.85 . . . . 87.51 109.838 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' ASP . . . . . . . . . . . . . . . -103.64 129.01 50.87 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 114.975 -1.012 . . . . 81.83 109.104 177.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' GLU . . . . . . . . . . . . . . . -118.71 122.0 41.44 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 109.053 -0.721 . . . . 74.9 109.053 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -104.49 103.46 13.16 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.189 -1.041 . . . . 77.34 108.189 172.925 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' THR . . . . . . . . . . . . . . . -80.79 66.07 6.17 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 122.272 1.034 . . . . 73.12 109.916 -175.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' LYS . . . . . . . . . . . . . . . -66.87 -32.67 74.09 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.236 -0.893 . . . . 80.34 111.173 177.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' SER . . . . . . . . . . . . . 36.1 t -49.66 -33.65 16.21 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 118.962 -0.542 . . . . 84.26 111.774 171.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -121.99 -97.01 0.46 Allowed 'General case' 0 C--N 1.35 0.601 0 C-N-CA 117.416 -1.713 . . . . 89.69 110.535 -172.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' ASP . . . . . 0.499 ' OD1' ' N ' ' C' ' 78' ' ' ASP . 7.1 p-10 -87.09 2.1 50.84 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.801 0.84 . . . . 85.61 112.523 -171.831 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 48.99 51.97 15.18 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.562 0.745 . . . . 84.3 111.856 -177.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -111.23 156.71 21.04 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.685 0.755 . . . . 95.31 111.398 175.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -100.69 123.51 44.99 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.195 -0.912 . . . . 77.35 109.278 173.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 2.6 m -138.17 156.59 30.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 121.579 0.704 . . . . 77.49 109.342 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' LYS . . . . . . . . . . . . . . . -97.94 117.46 32.33 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.483 -0.781 . . . . 89.38 110.479 175.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' ALA . . . . . . . . . . . . . . . -111.81 155.83 22.94 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.91 1.284 . . . . 90.64 110.443 -173.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 12.1 tp -130.21 -54.31 1.11 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 114.134 1.161 . . . . 87.62 114.134 177.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' VAL . . . . . . . . . . . . . . . 67.71 132.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 124.627 1.171 . . . . 94.99 110.095 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' THR . . . . . . . . . . . . . 1.6 m -136.93 159.91 40.48 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.985 0.914 . . . . 97.58 110.604 -176.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' TRP . . . . . . . . . . . . . 26.5 m95 -89.33 119.16 29.55 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.89 -1.05 . . . . 92.14 108.785 171.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' GLU . . . . . . . . . . . . . . . -116.52 90.94 3.45 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.386 -2.079 . . . . 83.22 105.386 169.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.06 -110.89 3.52 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.7 -1.36 . . . . 82.37 109.7 -174.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -115.31 25.82 10.55 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 112.415 0.524 . . . . 88.04 112.415 172.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 2.7 m -116.68 133.07 64.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 109.043 -0.725 . . . . 82.97 109.043 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' LEU . . . . . . . . . . . . . 13.2 mt -90.38 110.25 21.34 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.683 -0.858 . . . . 86.16 108.683 176.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 32.9 t -111.44 123.11 66.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 108.854 -0.795 . . . . 95.45 108.854 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' CYS . . . . . . . . . . . . . 11.3 t -114.28 132.22 56.23 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.381 1.073 . . . . 96.35 109.645 -175.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -110.46 143.97 19.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 122.723 0.409 . . . . 96.17 110.391 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' GLN . . . . . 0.506 ' N ' ' O ' ' C' ' 104' ' ' ARG . . . -110.91 93.52 4.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 107.532 -1.285 . . . . 98.84 107.532 -179.086 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' LYS . . . . . . . . . . . . . . . -75.35 125.59 29.29 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.833 -1.173 . . . . 91.88 107.833 175.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' GLY . . . . . . . . . . . . . . . 169.71 -147.12 10.6 Favored Glycine 0 CA--C 1.509 -0.342 0 C-N-CA 119.822 -1.18 . . . . 92.01 110.573 -176.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' GLU . . . . . . . . . . . . . . . -60.76 -37.59 82.35 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.856 -0.737 . . . . 96.31 110.462 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' LYS . . . . . . . . . . . . . 13.7 mmmt -86.22 131.86 34.13 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 121.935 -0.478 . . . . 103.21 111.579 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -94.36 142.75 27.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.759 -0.655 . . . . 108.97 110.129 178.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' ASN . . . . . . . . . . . . . 60.6 t30 56.8 40.54 28.97 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.639 0.733 . . . . 114.09 109.707 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' ARG . . . . . 0.506 ' O ' ' N ' ' C' ' 97' ' ' GLN . . . -104.9 131.03 52.91 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.605 0.762 . . . . 112.48 109.822 -173.399 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.27 -159.21 25.28 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 119.878 -1.153 . . . . 91.69 112.707 179.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' TRP . . . . . . . . . . . . . 30.7 p-90 -152.8 166.59 31.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.814 -1.193 . . . . 90.26 110.386 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' LYS . . . . . . . . . . . . . . . -132.2 140.03 48.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.314 -1.312 . . . . 89.0 109.155 177.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' LYS . . . . . . . . . . . . . 9.1 ttmt -131.28 126.98 36.79 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.852 -0.796 . . . . 82.66 108.852 -176.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' TRP . . . . . . . . . . . . . 18.7 p90 -157.88 163.02 38.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.608 0.718 . . . . 92.47 111.364 174.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' ILE . . . . . . . . . . . . . 1.7 mt -142.11 133.29 25.75 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.858 0 C-N-CA 126.714 2.006 . . . . 95.87 113.331 -170.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -122.75 111.7 17.03 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 126.798 2.039 . . . . 127.24 106.842 169.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.45 -106.42 2.24 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 124.151 0.881 . . . . 94.89 114.966 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -126.63 16.81 7.53 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 114.269 1.211 . . . . 102.33 114.269 -178.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' LYS . . . . . . . . . . . . . . . -120.54 138.57 53.78 Favored 'General case' 0 C--O 1.212 -0.875 0 CA-C-O 123.239 1.495 . . . . 89.62 111.598 -175.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -102.86 135.45 44.5 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 119.146 -2.221 . . . . 86.28 110.257 -173.201 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -120.38 122.8 41.56 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.452 -0.944 . . . . 98.08 108.452 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' LEU . . . . . . . . . . . . . 5.5 tt -132.93 118.82 19.36 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.021 -1.474 . . . . 82.9 107.021 -176.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' GLU . . . . . . . . . . . . . . . -113.94 110.51 20.2 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.798 -0.816 . . . . 86.13 108.798 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' LEU . . . . . . . . . . . . . 45.2 mt -96.39 131.05 43.34 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 108.606 -0.887 . . . . 87.12 108.606 173.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' THR . . . . . . . . . . . . . 23.7 m -129.89 -58.26 1.09 Allowed 'General case' 0 C--O 1.239 0.524 0 C-N-CA 115.202 -2.599 . . . . 103.18 116.624 -171.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' C' ' 122' ' ' GLY . 6.8 t 62.62 -113.41 0.45 Allowed 'General case' 0 C--O 1.243 0.74 0 N-CA-C 106.201 -1.777 . . . . 104.58 106.201 -179.913 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' GLY . . . . . 0.432 ' N ' ' SG ' ' C' ' 121' ' ' CYS . . . -86.68 -102.05 0.79 Allowed Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 119.888 1.222 . . . . 107.35 112.75 -173.826 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -92.65 178.86 5.67 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 123.965 0.906 . . . . 114.49 109.02 176.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' GLN . . . . . . . . . . . . . . . 44.32 115.38 0.0 OUTLIER 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.767 1.227 . . . . 98.4 112.587 -177.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' VAL . . . . . . . . . . . . . 9.2 t -95.68 148.2 5.39 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-O 121.24 0.543 . . . . 96.88 109.705 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 126' ' ' CYS . . . . . . . . . . . . . 2.7 t -122.09 121.05 36.06 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 108.683 -0.858 . . . . 88.72 108.683 178.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 127' ' ' ARG . . . . . . . . . . . . . . . -106.86 127.62 53.57 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.264 1.026 . . . . 85.29 108.566 -178.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 128' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -126.9 140.29 52.44 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.498 -0.927 . . . . 84.97 108.498 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 129' ' ' VAL . . . . . 0.41 ' O ' ' N ' ' F' ' 11' ' ' GLU . 29.4 m -123.58 137.99 54.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 108.018 -1.104 . . . . 78.3 108.018 178.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 130' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -123.82 145.4 49.09 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.568 0.747 . . . . 79.21 109.896 -174.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 131' ' ' LYS . . . . . 0.62 ' N ' ' O ' ' F' ' 9' ' ' GLU . 1.1 mmtp -103.07 137.37 41.33 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.379 -0.6 . . . . 78.99 109.379 175.897 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -81.81 133.66 35.35 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.252 -1.018 . . . . 87.46 108.252 175.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 133' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.375 -0.375 . . . . 103.13 111.252 -176.655 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.918 0.389 . . . . 72.63 111.27 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' ARG . . . . . . . . . . . . . 52.2 mtt180 -94.47 12.65 26.53 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 112.694 0.627 . . . . 74.6 112.694 177.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -103.64 103.17 13.06 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.601 -0.518 . . . . 78.47 109.601 -171.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' PHE . . . . . 0.426 ' N ' ' OE1' ' D' ' 44' ' ' GLN . 62.4 m-85 -96.2 11.17 35.36 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.586 0.588 . . . . 63.87 112.586 177.625 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' ASN . . . . . 0.567 ' OD1' ' N ' ' D' ' 44' ' ' GLN . 34.2 m-80 -66.0 139.48 58.22 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.033 0.444 . . . . 77.28 111.637 -175.797 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.85 -174.98 19.3 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-O 121.909 0.727 . . . . 57.35 112.354 170.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' THR . . . . . . . . . . . . . 92.8 m -102.72 127.81 49.7 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.044 -0.725 . . . . 61.46 109.044 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -120.86 122.43 40.25 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.457 -0.571 . . . . 56.22 109.457 -174.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -103.06 129.39 49.85 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.917 -0.772 . . . . 59.09 108.917 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' MET . . . . . . . . . . . . . 45.8 ttm -68.15 141.65 55.97 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.368 0.604 . . . . 58.86 111.138 -174.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' GLU . . . . . 0.415 ' OE2' ' NZ ' ' B' ' 114' ' ' LYS . 21.5 pt-20 -123.77 -18.6 6.0 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 113.514 0.931 . . . . 68.77 113.514 173.281 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -141.42 157.3 45.35 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.995 0.816 . . . . 67.06 109.742 177.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -161.92 91.75 0.82 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 107.154 -1.425 . . . . 50.72 107.154 -176.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' GLU . . . . . . . . . . . . . . . -104.24 134.8 46.87 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.17 -0.468 . . . . 53.95 110.744 -175.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' ASN . . . . . 0.445 ' ND2' ' OE1' ' B' ' 124' ' ' GLN . 28.8 t30 49.64 47.51 22.68 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.874 0.87 . . . . 53.0 111.977 -178.622 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -73.39 -39.49 65.05 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 120.072 -0.651 . . . . 51.45 110.973 171.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -69.61 -38.4 77.26 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 120.48 -0.488 . . . . 68.63 111.202 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.89 -39.54 95.04 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.92 -1.133 . . . . 47.61 112.491 175.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -60.06 -43.74 95.21 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.339 -0.507 . . . . 51.42 111.072 175.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' MET . . . . . . . . . . . . . 60.7 mtm -69.26 -34.91 75.51 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.718 -0.793 . . . . 50.85 111.325 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -60.51 -42.69 96.9 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 122.049 -0.407 . . . . 57.84 111.168 174.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.31 -28.99 70.39 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.312 -0.555 . . . . 51.02 111.725 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' LEU . . . . . . . . . . . . . 24.8 mt -77.9 3.54 14.25 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.479 0.918 . . . . 55.1 113.479 177.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 55.47 51.4 12.9 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.926 0.869 . . . . 59.65 110.75 -177.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' ILE . . . . . . . . . . . . . 3.5 mm -87.68 158.79 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 108.333 -0.988 . . . . 48.41 108.333 176.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -96.53 144.33 26.71 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.551 -0.907 . . . . 53.52 108.551 -171.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -40.92 -45.93 2.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.089 -0.96 . . . . 46.82 113.242 -177.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.19 -59.83 4.51 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.782 -0.367 . . . . 40.14 111.456 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' THR . . . . . . . . . . . . . 14.8 p -72.02 -18.83 61.93 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.906 -0.718 . . . . 42.8 112.403 -176.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' ARG . . . . . . . . . . . . . 43.7 mtm-85 -70.1 -42.31 72.86 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.867 -0.733 . . . . 42.93 110.403 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -67.91 -29.45 68.54 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.657 -0.247 . . . . 52.93 111.606 176.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' ILE . . . . . . . . . . . . . 63.8 mt -68.92 -51.39 45.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 119.784 -0.767 . . . . 44.42 110.265 176.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.59 -24.23 62.72 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.921 0.712 . . . . 43.63 112.921 -173.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' VAL . . . . . . . . . . . . . 1.4 p -73.24 -14.45 16.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 112.762 0.653 . . . . 45.79 112.762 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' ARG . . . . . . . . . . . . . 8.0 mtp85 -105.84 37.73 2.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 118.384 0.538 . . . . 42.27 111.807 176.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 82.1 mt -131.96 171.01 14.1 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 122.368 1.08 . . . . 45.08 111.015 -177.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' THR . . . . . . . . . . . . . 11.1 t -141.04 156.41 46.02 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 113.58 -1.645 . . . . 43.57 107.007 167.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -127.49 149.82 49.95 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.251 -0.886 . . . . 43.02 110.507 -170.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' THR . . . . . . . . . . . . . 58.1 p -133.45 125.11 28.3 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.156 -1.424 . . . . 51.92 107.156 172.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -108.37 122.78 47.69 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.177 -0.675 . . . . 58.99 109.177 -175.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' VAL . . . . . . . . . . . . . 41.0 t -98.33 112.43 30.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 106.608 -1.627 . . . . 51.05 106.608 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' ILE . . . . . . . . . . . . . 11.4 mt -108.89 125.83 65.9 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 N-CA-C 108.151 -1.055 . . . . 59.5 108.151 -177.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -113.03 116.11 29.41 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.531 -1.285 . . . . 83.3 107.531 170.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' GLN . . . . . 0.567 ' N ' ' OD1' ' D' ' 5' ' ' ASN . 29.7 tt0 -126.31 117.64 23.43 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.458 -0.571 . . . . 68.51 109.458 -170.863 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -115.68 99.91 7.66 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.147 -1.427 . . . . 76.97 107.147 174.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.33 -109.52 2.79 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 111.505 -0.638 . . . . 72.69 111.505 -177.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -104.14 3.68 33.28 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.691 0.626 . . . . 73.7 112.691 176.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' ASN . . . . . . . . . . . . . 10.8 m-80 -91.99 127.95 37.65 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.04 -0.726 . . . . 73.0 109.04 177.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -122.8 138.92 54.5 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.568 0.347 . . . . 64.4 110.541 -176.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt -134.55 108.74 8.25 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.5 -1.296 . . . . 70.18 107.5 172.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' THR . . . . . . . . . . . . . 6.2 m -109.49 141.8 41.43 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.733 -0.469 . . . . 54.11 109.733 -175.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -132.06 117.55 18.5 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 108.593 -0.892 . . . . 68.47 108.593 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -107.46 104.45 14.03 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.326 -0.62 . . . . 45.55 109.326 -175.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' THR . . . . . . . . . . . . . 17.5 p -93.48 137.75 32.46 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.309 -0.626 . . . . 41.53 109.309 176.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' SER . . . . . . . . . . . . . 56.7 p -122.32 139.77 53.43 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.148 -0.478 . . . . 39.67 111.326 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t -143.36 -178.08 5.69 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 107.432 -1.322 . . . . 56.14 107.432 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -84.93 141.63 30.24 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 120.556 -0.457 . . . . 36.42 111.29 -173.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 pp -83.69 123.68 30.08 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.942 -0.762 . . . . 49.51 108.942 -174.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -56.94 145.55 29.71 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.567 0.699 . . . . 50.09 111.387 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -110.26 127.9 55.23 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.491 -0.777 . . . . 59.77 109.471 177.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -108.16 138.34 44.59 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.929 0.492 . . . . 61.04 110.98 -176.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 62' ' ' VAL . . . . . . . . . . . . . . . -137.15 117.81 17.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 106.711 -1.588 . . . . 54.45 106.711 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 63' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -121.41 128.32 52.06 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.011 -0.737 . . . . 63.11 109.011 -179.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 64' ' ' PHE . . . . . . . . . . . . . 55.6 p90 -153.44 163.0 40.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.488 0.661 . . . . 47.89 110.031 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 65' ' ' THR . . . . . . . . . . . . . 32.3 m -121.26 142.8 49.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.953 -1.021 . . . . 50.9 108.996 170.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 t -67.94 123.55 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 CA-C-N 115.294 -0.867 . . . . 44.68 108.883 -175.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.84 -17.22 57.65 Favored Glycine 0 N--CA 1.436 -1.359 0 O-C-N 121.461 -0.775 . . . . 47.21 114.662 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' VAL . . . . . . . . . . . . . 94.3 t -97.31 123.27 49.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 108.326 -0.99 . . . . 47.67 108.326 -178.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' GLU . . . . . . . . . . . . . 55.7 tt0 -73.03 134.41 44.62 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.576 -0.45 . . . . 57.09 109.961 176.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -135.52 168.7 18.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.494 0.664 . . . . 49.15 109.534 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -100.31 125.93 46.58 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.866 -0.79 . . . . 58.93 108.866 178.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 72' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -121.52 123.94 43.21 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 109.481 -0.563 . . . . 60.58 109.481 -177.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 73' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -102.63 106.11 16.71 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.449 -1.315 . . . . 70.67 107.449 171.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' THR . . . . . . . . . . . . . 40.7 p -76.73 70.07 3.17 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 122.43 1.11 . . . . 50.21 110.054 -172.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -63.67 -28.46 69.92 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.919 -1.037 . . . . 66.91 111.228 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -52.63 -36.18 56.14 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.296 0.48 . . . . 54.27 112.296 173.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' LEU . . . . . . . . . . . . . 48.5 mt -124.09 -102.51 0.38 Allowed 'General case' 0 C--O 1.236 0.384 0 O-C-N 122.108 -0.37 . . . . 46.57 110.563 -166.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' ASP . . . . . 0.434 ' N ' ' OD1' ' D' ' 78' ' ' ASP . 17.5 p-10 -89.56 1.25 56.21 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.362 0.875 . . . . 48.99 113.362 -171.261 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 48.95 52.82 13.59 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.815 0.817 . . . . 69.96 111.45 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' ARG . . . . . . . . . . . . . 33.0 mtt85 -109.12 157.58 18.61 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.676 -0.693 . . . . 52.64 110.145 175.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -97.27 124.62 41.43 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.498 -0.773 . . . . 63.95 108.965 175.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' VAL . . . . . . . . . . . . . 19.8 m -134.9 153.97 35.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 108.486 -0.931 . . . . 43.77 108.486 176.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -97.35 113.97 25.69 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.746 -1.575 . . . . 55.68 106.746 173.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' ALA . . . . . . . . . . . . . . . -109.6 140.87 42.9 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.048 0.451 . . . . 41.15 110.275 -171.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' LEU . . . . . . . . . . . . . 14.0 tp -137.93 132.62 32.67 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.069 -0.969 . . . . 42.7 109.044 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 t -113.24 138.37 43.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.853 -0.795 . . . . 41.74 108.853 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' THR . . . . . . . . . . . . . 15.9 p -132.43 157.8 43.65 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.701 0.8 . . . . 52.41 109.536 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -93.06 120.7 33.64 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.162 -0.926 . . . . 50.41 109.453 172.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -115.2 89.7 3.16 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 105.869 -1.9 . . . . 53.62 105.869 169.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.42 -110.63 3.38 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.522 -0.847 . . . . 50.11 111.179 -174.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -112.89 27.85 9.28 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.288 0.635 . . . . 69.97 110.835 172.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' VAL . . . . . . . . . . . . . 96.4 t -114.57 130.63 68.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.012 -0.736 . . . . 45.39 109.012 -178.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' LEU . . . . . . . . . . . . . 34.1 mt -90.3 111.89 23.25 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 106.882 -1.525 . . . . 39.13 106.882 173.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -108.6 120.0 59.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 107.988 -1.116 . . . . 48.62 107.988 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' CYS . . . . . . . . . . . . . 36.1 t -117.06 127.98 54.7 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.647 -0.871 . . . . 34.67 108.647 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' VAL . . . . . . . . . . . . . 95.8 t -108.46 132.14 57.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.36 -1.348 . . . . 38.18 107.36 174.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -115.54 93.2 4.18 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 106.994 -1.484 . . . . 39.98 106.994 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' LYS . . . . . . . . . . . . . 27.4 mttp -74.88 133.7 41.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.259 -0.428 . . . . 57.58 110.065 179.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 99' ' ' GLY . . . . . . . . . . . . . . . 175.43 -151.47 12.05 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.95 -0.568 . . . . 46.86 112.894 -178.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 100' ' ' GLU . . . . . . . . . . . . . . . -65.0 -39.29 93.24 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.684 -0.407 . . . . 53.92 111.824 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -82.81 137.18 34.42 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.113 0.482 . . . . 53.49 111.637 -176.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -89.12 144.59 26.02 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.726 -0.67 . . . . 72.7 110.287 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 60.38 41.17 16.52 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.552 -0.749 . . . . 73.4 111.506 177.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' ARG . . . . . . . . . . . . . 12.0 ttt180 -104.93 127.79 52.92 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.289 -0.634 . . . . 42.39 109.289 -176.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' GLY . . . . . . . . . . . . . . . 174.62 -161.19 30.83 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 109.929 -1.269 . . . . 41.54 109.929 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' TRP . . . . . . . . . . . . . 38.4 p-90 -157.76 165.59 34.96 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 118.947 -1.101 . . . . 40.1 110.269 174.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -133.62 137.42 45.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.6 -1.182 . . . . 56.97 109.103 175.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' LYS . . . . . . . . . . . . . 4.3 ttpt -133.1 132.03 41.24 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.244 -0.435 . . . . 55.52 110.017 -176.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' TRP . . . . . . . . . . . . . 22.3 p90 -153.99 168.18 27.29 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.378 -0.601 . . . . 48.31 109.378 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' ILE . . . . . . . . . . . . . 84.3 mt -123.47 131.26 73.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 108.597 -0.89 . . . . 57.86 108.597 -175.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -126.7 116.94 21.74 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 109.046 -0.724 . . . . 87.91 109.046 172.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 112' ' ' GLY . . . . . . . . . . . . . . . 71.97 -106.87 2.03 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 110.697 -0.961 . . . . 66.15 110.697 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 113' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -123.52 17.82 9.66 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 122.764 -0.257 . . . . 70.56 111.24 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 19.2 mtpt -124.05 145.48 49.2 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.492 0.663 . . . . 62.6 111.335 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 115' ' ' LEU . . . . . . . . . . . . . 8.3 tt -102.69 137.51 40.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.028 -0.987 . . . . 50.18 109.73 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 116' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -119.37 127.91 53.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 123.667 0.787 . . . . 61.48 109.009 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 117' ' ' LEU . . . . . . . . . . . . . 44.6 tp -130.66 120.6 24.17 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.369 -0.975 . . . . 36.99 108.369 -177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 118' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -111.69 111.01 21.69 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.167 -1.42 . . . . 60.42 107.167 177.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 119' ' ' LEU . . . . . . . . . . . . . 8.8 mt -95.06 129.01 42.32 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.818 -0.808 . . . . 41.41 108.818 175.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 120' ' ' THR . . . . . . . . . . . . . 9.5 m -129.46 146.58 51.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.011 0.434 . . . . 45.49 110.655 -170.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 121' ' ' CYS . . . . . . . . . . . . . 13.8 t -168.33 154.05 6.89 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 107.399 -1.334 . . . . 49.93 107.399 169.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 122' ' ' GLY . . . . . . . . . . . . . . . 33.27 -111.17 0.06 OUTLIER Glycine 0 C--N 1.335 0.481 0 CA-C-N 115.812 -0.631 . . . . 54.35 112.788 -164.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 123' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' D' ' 123' ' ' ASP . 9.9 p-10 -105.64 -10.81 16.61 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.455 0.909 . . . . 65.71 113.455 174.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 124' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -86.39 118.18 25.66 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.043 0.537 . . . . 50.14 110.618 -175.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 125' ' ' VAL . . . . . . . . . . . . . 12.3 t -104.33 146.49 11.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 C-N-CA 124.28 1.032 . . . . 41.68 108.908 170.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 126' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -127.23 123.19 35.96 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 107.673 -1.232 . . . . 42.78 107.673 178.404 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 127' ' ' ARG . . . . . . . . . . . . . . . -106.05 124.89 50.29 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.169 -0.678 . . . . 40.29 109.169 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 128' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -129.69 140.09 51.2 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.211 -0.662 . . . . 41.71 109.211 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 129' ' ' VAL . . . . . . . . . . . . . 2.4 p -126.75 138.54 54.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.375 -0.972 . . . . 44.93 108.375 176.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 130' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -121.42 145.6 47.76 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.455 1.102 . . . . 45.31 109.248 -176.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 131' ' ' LYS . . . . . . . . . . . . . 44.4 tttp -101.82 142.02 33.78 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.772 -0.649 . . . . 68.84 109.538 174.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 132' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -78.28 135.13 37.48 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.909 -0.587 . . . . 58.62 109.736 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 133' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.827 -0.624 . . . . 71.84 111.05 -177.308 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 1' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 CA--C 1.536 0.43 0 CA-C-O 121.924 0.868 . . . . 109.92 110.396 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 2' ' ' ARG . . . . . . . . . . . . . 13.2 ttt-85 -106.85 -7.18 17.23 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.943 -1.48 . . . . 99.67 113.373 -175.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 3' ' ' ASP . . . . . . . . . . . . . . . -99.87 104.3 15.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.566 0.621 . . . . 93.84 109.757 -169.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -95.89 12.33 30.64 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.008 0.744 . . . . 94.21 113.008 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 -63.02 137.35 58.24 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.22 0.533 . . . . 102.43 112.374 -172.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 6' ' ' GLY . . . . . . . . . . . . . . . 127.15 -177.41 17.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-O 122.181 0.878 . . . . 92.85 112.396 169.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 7' ' ' THR . . . . . . . . . . . . . 3.7 p -103.81 129.18 51.23 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.888 -0.656 . . . . 101.87 109.344 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 8' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -119.38 124.84 47.57 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 123.763 0.825 . . . . 102.95 109.295 -173.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 9' ' ' GLU . . . . . 0.595 ' O ' ' N ' ' F' ' 131' ' ' LYS . . . -101.27 131.26 47.38 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.367 0.667 . . . . 84.29 109.748 -178.72 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 10' ' ' MET . . . . . . . . . . . . . 11.0 ttp -66.41 145.95 55.11 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.854 0.835 . . . . 89.09 112.761 -172.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 11' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' F' ' 129' ' ' VAL . . . -122.66 -19.52 6.25 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 114.092 1.145 . . . . 90.0 114.092 174.396 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 12' ' ' SER . . . . . . . . . . . . . 4.5 t -144.19 159.03 43.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 119.134 0.879 . . . . 82.51 110.919 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 13' ' ' ASN . . . . . . . . . . . . . 38.1 t-20 -160.98 90.36 0.83 Allowed 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 107.522 -1.288 . . . . 83.53 107.522 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 14' ' ' GLU . . . . . . . . . . . . . . . -105.64 135.05 47.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.904 -0.589 . . . . 74.84 110.082 -177.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 15' ' ' ASN . . . . . . . . . . . . . . . 50.96 48.33 23.24 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.727 0.775 . . . . 83.5 112.434 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 16' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -71.59 -37.22 71.01 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.913 -0.715 . . . . 79.57 110.344 169.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 17' ' ' GLU . . . . . . . . . . . . . . . -68.94 -37.67 79.0 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 116.48 -0.327 . . . . 92.96 111.424 -176.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.88 -39.51 95.04 Favored Glycine 0 C--N 1.335 0.487 0 C-N-CA 119.512 -1.328 . . . . 89.06 112.353 174.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 19' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -58.6 -46.56 86.74 Favored 'General case' 0 C--O 1.245 0.861 0 O-C-N 122.125 -0.633 . . . . 90.96 110.469 174.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 20' ' ' MET . . . . . . . . . . . . . 63.5 mtm -68.34 -35.67 78.11 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.456 -0.497 . . . . 88.43 111.438 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 21' ' ' LYS . . . . . . . . . . . . . . . -61.7 -43.88 98.01 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 122.156 -0.34 . . . . 91.8 111.216 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.09 -30.58 71.63 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.618 -0.833 . . . . 95.52 111.39 175.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 23' ' ' LEU . . . . . . . . . . . . . 2.8 mt -79.83 4.03 17.79 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.96 1.096 . . . . 92.69 113.96 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 24' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 56.34 50.27 13.55 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.901 0.773 . . . . 98.13 111.738 -177.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 25' ' ' ILE . . . . . . . . . . . . . 35.6 mt -92.24 161.37 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 122.001 0.905 . . . . 92.7 109.815 175.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 26' ' ' ASP . . . . . . . . . . . . . 16.4 p30 -76.32 170.75 15.75 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 125.603 1.561 . . . . 96.82 111.037 -169.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 27' ' ' PHE . . . . . . . . . . . . . . . -73.86 -38.63 64.41 Favored 'General case' 0 C--O 1.243 0.745 0 CA-C-N 115.519 -0.764 . . . . 89.89 110.632 174.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.75 -59.25 5.5 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 111.597 0.221 . . . . 91.86 111.597 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 29' ' ' THR . . . . . . . . . . . . . 6.6 m -73.56 -16.38 61.26 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 118.801 -1.16 . . . . 88.59 112.569 -177.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 30' ' ' ARG . . . . . . . . . . . . . . . -70.01 -45.6 66.9 Favored 'General case' 0 C--O 1.248 0.987 0 C-N-CA 118.446 -1.302 . . . . 85.4 110.68 171.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 31' ' ' LYS . . . . . . . . . . . . . . . -65.63 -29.79 70.41 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.875 -0.602 . . . . 86.87 110.731 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 32' ' ' ILE . . . . . . . . . . . . . 31.9 mt -73.64 -48.94 38.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.604 0.716 . . . . 92.07 109.114 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.8 -25.87 63.06 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.209 1.404 . . . . 87.86 114.551 -169.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 34' ' ' VAL . . . . . . . . . . . . . 10.1 m -74.89 -9.44 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 114.545 -2.862 . . . . 86.52 113.979 -178.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 35' ' ' ARG . . . . . . . . . . . . . . . -107.79 39.34 1.95 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.502 1.668 . . . . 95.26 115.502 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 36' ' ' LEU . . . . . . . . . . . . . 3.0 mp -134.61 176.33 8.73 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 120.515 -1.366 . . . . 92.94 110.727 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 37' ' ' THR . . . . . . . . . . . . . 4.5 p -138.87 161.3 37.62 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 114.615 -1.175 . . . . 83.15 107.914 168.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 38' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -127.52 152.33 47.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.278 0.561 . . . . 88.11 110.413 -172.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 39' ' ' THR . . . . . . . . . . . . . 43.4 m -131.38 123.92 29.23 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.268 -1.012 . . . . 84.69 108.268 175.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 40' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -111.42 126.37 54.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.173 -0.467 . . . . 92.26 111.159 -173.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 41' ' ' VAL . . . . . . . . . . . . . 21.7 t -94.77 115.04 32.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 124.907 1.283 . . . . 87.13 108.588 176.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 42' ' ' ILE . . . . . . . . . . . . . 2.1 mm -108.6 122.46 63.18 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 108.635 -0.876 . . . . 88.34 108.635 -177.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 43' ' ' ASP . . . . . . . . . . . . . . . -116.96 113.79 22.89 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 106.652 -1.611 . . . . 82.57 106.652 167.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 44' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -129.3 117.74 21.15 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.769 -0.456 . . . . 86.43 109.769 -173.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 45' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -116.74 103.03 9.93 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.62 -1.252 . . . . 86.08 107.62 173.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 46' ' ' GLY . . . . . . . . . . . . . . . 65.74 -111.49 4.21 Favored Glycine 0 C--N 1.331 0.28 0 N-CA-C 114.457 0.543 . . . . 89.33 114.457 -176.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 47' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -104.33 1.81 30.72 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 117.528 0.664 . . . . 82.03 112.694 177.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 48' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -93.55 130.31 39.46 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.882 -0.785 . . . . 80.81 108.882 177.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 49' ' ' PHE . . . . . 0.436 ' N ' ' O ' ' F' ' 64' ' ' PHE . 39.2 m-85 -120.52 139.13 53.36 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.413 -0.588 . . . . 77.06 109.413 -175.901 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -134.38 110.12 9.24 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.261 -1.014 . . . . 86.16 108.261 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 51' ' ' THR . . . . . . . . . . . . . 6.3 p -108.26 147.07 31.94 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.416 1.086 . . . . 79.4 112.395 -171.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -130.21 115.87 17.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.055 -0.975 . . . . 85.76 108.935 172.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 53' ' ' ALA . . . . . . . . . . . . . . . -108.57 100.81 10.03 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.009 -0.737 . . . . 89.51 109.009 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 54' ' ' THR . . . . . . . . . . . . . 22.8 m -93.22 144.31 25.42 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.36 0.664 . . . . 99.72 109.269 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 55' ' ' SER . . . . . . . . . . . . . 6.4 t -111.96 140.56 46.52 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.337 -0.616 . . . . 88.39 109.337 -178.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -140.37 148.94 42.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.957 0.903 . . . . 90.29 109.734 -172.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 57' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -81.44 162.07 23.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 107.853 -1.165 . . . . 84.39 107.853 176.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 58' ' ' LEU . . . . . . . . . . . . . . . -80.35 167.84 19.74 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 116.797 -1.961 . . . . 100.81 110.569 -170.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 59' ' ' ASN . . . . . . . . . . . . . . . -105.73 115.72 30.72 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.764 -1.198 . . . . 98.5 107.764 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 60' ' ' TYR . . . . . . . . . . . . . . . -54.85 -59.23 5.02 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 123.458 0.474 . . . . 93.23 110.812 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 61' ' ' ASP . . . . . . . . . . . . . 7.5 t0 59.6 128.15 0.01 OUTLIER 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.589 1.556 . . . . 86.15 111.608 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 62' ' ' VAL . . . . . . . . . . . . . 41.0 t -141.58 121.98 12.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 107.765 -1.198 . . . . 77.64 107.765 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 63' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -119.63 125.95 49.98 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.597 -0.89 . . . . 75.24 108.597 177.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 64' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -155.05 162.06 41.15 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.499 0.666 . . . . 62.46 109.564 -176.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 65' ' ' THR . . . . . . . . . . . . . 4.6 m -121.07 140.46 51.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.067 -0.97 . . . . 69.77 108.517 169.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 66' ' ' VAL . . . . . . . . . . . . . 13.8 p -71.96 127.36 33.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 C-N-CA 119.964 -0.694 . . . . 66.14 109.188 -174.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.75 -21.03 41.93 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-O 119.264 -0.742 . . . . 75.61 114.449 -175.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 68' ' ' VAL . . . . . . . . . . . . . 2.8 m -99.85 126.89 53.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 118.187 0.994 . . . . 70.6 108.597 179.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 69' ' ' GLU . . . . . . . . . . . . . . . -71.9 137.19 47.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.95 -0.568 . . . . 75.68 109.975 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 70' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -131.92 167.28 19.89 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 122.045 0.926 . . . . 76.04 109.785 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.79 125.34 45.7 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 114.449 -1.251 . . . . 81.15 109.281 -179.114 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 72' ' ' GLU . . . . . 0.453 ' OE2' ' NE2' ' E' ' 97' ' ' GLN . 33.6 tt0 -122.21 122.92 40.28 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 110.029 -0.36 . . . . 74.49 110.029 -177.597 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 73' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -103.15 104.94 15.14 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 107.47 -1.308 . . . . 78.05 107.47 170.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 74' ' ' THR . . . . . . . . . . . . . 16.3 p -77.28 68.68 3.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 122.666 1.222 . . . . 79.11 108.781 -174.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 75' ' ' LYS . . . . . . . . . . . . . . . -65.47 -27.22 68.35 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 114.554 -1.203 . . . . 87.44 112.043 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 76' ' ' SER . . . . . . . . . . . . . 73.1 m -56.89 -34.86 68.3 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 112.303 0.483 . . . . 86.57 112.303 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 77' ' ' LEU . . . . . . . . . . . . . 37.0 mt -122.24 -100.9 0.41 Allowed 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.967 -0.458 . . . . 87.13 109.905 -165.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 78' ' ' ASP . . . . . 0.492 ' N ' ' OD1' ' E' ' 78' ' ' ASP . 10.9 p-10 -90.37 0.04 57.44 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.679 1.192 . . . . 86.73 113.953 -170.237 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 79' ' ' ASN . . . . . . . . . . . . . 1.7 m120 45.66 54.93 7.23 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 124.113 0.965 . . . . 93.71 111.33 -176.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 80' ' ' ARG . . . . . . . . . . . . . 85.1 mtt180 -107.91 155.52 20.2 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.049 -1.093 . . . . 76.72 108.049 171.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 81' ' ' HIS . . . . . . . . . . . . . 13.1 t-160 -96.49 126.32 41.59 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 107.897 -1.149 . . . . 73.57 107.897 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 82' ' ' VAL . . . . . . . . . . . . . 22.1 m -133.43 151.95 34.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.764 0.792 . . . . 70.33 108.997 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 83' ' ' LYS . . . . . . . . . . . . . . . -98.43 112.07 24.21 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.001 -1.852 . . . . 67.66 106.001 171.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 84' ' ' ALA . . . . . . . . . . . . . . . -113.04 140.19 48.04 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.135 -0.321 . . . . 61.79 110.135 -173.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 85' ' ' LEU . . . . . . . . . . . . . 4.3 tt -139.46 139.53 37.05 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.958 -0.756 . . . . 66.35 108.958 173.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 86' ' ' VAL . . . . . . . . . . . . . 4.1 m -114.86 139.95 38.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 N-CA-C 109.094 -0.706 . . . . 65.21 109.094 -178.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 87' ' ' THR . . . . . . . . . . . . . 8.5 p -133.44 160.99 35.76 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.902 0.858 . . . . 59.09 109.634 176.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 88' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -87.86 122.25 31.27 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.439 -1.255 . . . . 63.2 109.593 176.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -113.66 88.03 2.75 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.959 -1.867 . . . . 58.22 105.959 172.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 90' ' ' GLY . . . . . . . . . . . . . . . 69.55 -110.99 3.61 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.205 -1.158 . . . . 62.76 110.205 -173.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 91' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' E' ' 91' ' ' ASP . 10.0 p-10 -114.39 27.27 9.59 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.21 0.604 . . . . 66.84 111.328 171.694 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 92' ' ' VAL . . . . . . . . . . . . . 41.5 t -115.88 132.91 63.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 108.804 -0.813 . . . . 57.35 108.804 -179.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 93' ' ' LEU . . . . . . . . . . . . . 5.2 tp -88.72 111.32 21.83 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.138 -1.06 . . . . 59.08 108.138 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -110.16 122.76 65.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 108.545 -0.909 . . . . 56.77 108.545 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 95' ' ' CYS . . . . . . . . . . . . . 48.2 t -116.3 129.74 56.42 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.271 0.628 . . . . 56.62 109.566 -177.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 96' ' ' VAL . . . . . . . . . . . . . 9.9 t -108.54 131.99 57.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 N-CA-C 107.863 -1.162 . . . . 60.57 107.863 174.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 97' ' ' GLN . . . . . 0.453 ' NE2' ' OE2' ' E' ' 72' ' ' GLU . 43.5 mt-30 -117.05 92.72 3.93 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.228 -1.026 . . . . 65.58 108.228 179.546 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 98' ' ' LYS . . . . . . . . . . . . . . . -76.59 134.42 39.37 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.525 -0.307 . . . . 68.26 110.329 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.05 -150.87 11.02 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 121.394 -0.431 . . . . 71.46 113.637 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 100' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -63.46 -39.02 93.36 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.44 -0.504 . . . . 83.25 111.281 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 101' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -83.37 136.05 34.48 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 122.063 -0.398 . . . . 76.97 110.196 179.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 102' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -89.04 148.55 23.67 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.426 1.09 . . . . 90.5 108.819 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 103' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 60.19 42.98 14.57 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.228 1.196 . . . . 90.86 114.228 -176.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 104' ' ' ARG . . . . . . . . . . . . . 16.2 ttt180 -104.33 128.0 52.07 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 118.292 -1.363 . . . . 75.02 112.752 -176.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 105' ' ' GLY . . . . . . . . . . . . . . . 175.71 -164.01 34.0 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 119.545 -1.312 . . . . 57.14 112.352 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 106' ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -158.62 166.84 31.12 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.838 0.828 . . . . 55.23 110.086 176.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 107' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -133.53 140.64 47.33 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 114.646 -1.161 . . . . 59.09 109.813 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 108' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -130.91 130.66 43.79 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.818 0.847 . . . . 55.57 109.517 -175.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 109' ' ' TRP . . . . . . . . . . . . . 30.2 p90 -155.58 168.19 27.95 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.445 -0.946 . . . . 61.09 108.445 174.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 110' ' ' ILE . . . . . . . . . . . . . 7.2 mt -122.78 132.6 70.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 N-CA-C 107.453 -1.314 . . . . 65.37 107.453 -175.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 111' ' ' GLU . . . . . . . . . . . . . . . -123.34 105.76 10.11 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 107.248 -1.39 . . . . 73.17 107.248 174.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.69 -106.37 1.94 Allowed Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 116.01 -0.541 . . . . 71.2 112.352 -177.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 113' ' ' ASP . . . . . . . . . . . . . . . -122.73 19.69 10.24 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 122.566 -0.373 . . . . 70.41 111.724 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 114' ' ' LYS . . . . . . . . . . . . . 13.7 mttp -121.35 146.48 46.81 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.527 0.731 . . . . 66.03 109.757 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 115' ' ' LEU . . . . . . . . . . . . . 5.0 tt -104.23 137.33 42.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.559 -0.746 . . . . 59.58 109.707 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 116' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -119.6 127.79 53.28 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 109.222 -0.659 . . . . 72.16 109.222 -178.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 117' ' ' LEU . . . . . . . . . . . . . 3.5 tt -130.46 119.29 22.42 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.925 -1.139 . . . . 53.7 107.925 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 118' ' ' GLU . . . . . . . . . . . . . . . -112.08 112.27 23.77 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.019 -1.104 . . . . 59.65 108.019 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 119' ' ' LEU . . . . . . . . . . . . . 14.8 mt -93.8 132.43 38.2 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 122.807 0.443 . . . . 56.5 109.854 176.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 120' ' ' THR . . . . . . . . . . . . . 18.1 m -127.0 144.45 51.02 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.568 -0.901 . . . . 63.15 108.568 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 121' ' ' CYS . . . . . . . . . . . . . 1.9 t -163.79 114.83 1.35 Allowed 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.702 -0.851 . . . . 74.55 108.702 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 122' ' ' GLY . . . . . . . . . . . . . . . 56.52 -109.29 1.5 Allowed Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 111.602 -0.599 . . . . 82.27 111.602 -170.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 123' ' ' ASP . . . . . 0.487 ' N ' ' OD1' ' E' ' 123' ' ' ASP . 10.5 p-10 -103.43 -13.45 16.63 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.519 0.933 . . . . 83.6 113.519 176.115 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 124' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -87.86 118.82 27.65 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 118.469 0.577 . . . . 85.3 111.445 -174.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 125' ' ' VAL . . . . . . . . . . . . . 37.0 t -104.7 144.98 13.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 123.756 0.822 . . . . 58.43 109.745 170.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 126' ' ' CYS . . . . . . . . . . . . . 1.9 t -129.52 124.43 33.9 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.98 -1.118 . . . . 56.68 107.98 176.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 127' ' ' ARG . . . . . . . . . . . . . 63.9 mtp85 -105.6 126.64 52.38 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 110.095 -0.335 . . . . 73.02 110.095 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 128' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -128.94 140.57 51.6 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.031 0.532 . . . . 53.64 109.784 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 129' ' ' VAL . . . . . . . . . . . . . 3.6 t -126.79 139.83 50.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 109.433 -0.581 . . . . 50.62 109.433 178.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 130' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -123.08 146.29 47.82 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.188 0.995 . . . . 59.37 110.323 -175.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 131' ' ' LYS . . . . . . . . . . . . . 1.5 tttt -103.84 138.67 40.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.286 -0.415 . . . . 73.7 110.817 173.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 132' ' ' LYS . . . . . . . . . . . . . 8.4 tptm -75.41 149.23 38.64 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 128.443 2.697 . . . . 81.92 107.658 177.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 133' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt . . . . . 0 C--N 1.321 -0.637 0 C-N-CA 118.948 -1.101 . . . . 77.3 110.067 176.955 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.338 0 N-CA-C 110.223 -0.288 . . . . 94.93 110.223 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 4' ' ' PHE . . . . . 0.538 ' N ' ' OE1' ' F' ' 44' ' ' GLN . 11.1 m-85 -80.53 17.07 1.17 Allowed 'General case' 0 C--O 1.24 0.575 0 N-CA-C 112.606 0.595 . . . . 94.86 112.606 -175.328 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 5' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -57.86 138.47 55.66 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 120.371 -0.532 . . . . 104.61 111.798 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.33 -174.02 19.39 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 118.556 -1.783 . . . . 91.92 112.054 168.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 7' ' ' THR . . . . . . . . . . . . . 1.6 p -102.77 127.0 50.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.68 -0.76 . . . . 86.63 109.426 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 8' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -121.41 122.45 39.81 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.919 -0.771 . . . . 83.79 108.919 -176.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 9' ' ' GLU . . . . . 0.62 ' O ' ' N ' ' C' ' 131' ' ' LYS . . . -102.83 130.57 49.88 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 122.875 0.47 . . . . 77.44 109.825 -179.115 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 10' ' ' MET . . . . . . . . . . . . . 11.6 ttp -65.62 145.08 56.5 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.46 0.648 . . . . 82.93 110.856 -175.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 11' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' C' ' 129' ' ' VAL . . . -122.77 -26.34 4.49 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 114.637 1.347 . . . . 81.5 114.637 175.367 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -149.24 162.95 39.01 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.216 0.916 . . . . 83.64 109.287 175.679 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 13' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -155.73 92.44 1.38 Allowed 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 106.792 -1.559 . . . . 85.94 106.792 -173.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 14' ' ' GLU . . . . . . . . . . . . . . . -102.48 133.13 47.95 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.798 -0.637 . . . . 88.29 110.08 -174.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 15' ' ' ASN . . . . . . . . . . . . . 37.2 t30 48.28 47.12 19.9 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 123.82 0.848 . . . . 87.78 111.315 -176.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 16' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -72.34 -39.31 68.24 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.793 -0.763 . . . . 93.37 110.671 171.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 17' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -74.04 -31.37 62.86 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 120.011 -0.675 . . . . 108.93 111.75 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.36 -40.25 97.66 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 118.976 -1.583 . . . . 93.14 112.196 170.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 19' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -61.16 -42.51 98.69 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 122.057 -0.672 . . . . 93.57 111.356 174.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 20' ' ' MET . . . . . . . . . . . . . 56.0 mtm -67.97 -36.19 79.65 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.129 -0.629 . . . . 94.61 111.577 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 21' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -62.17 -42.01 98.85 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.439 -0.504 . . . . 94.06 110.703 172.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.52 -25.37 67.99 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.159 0.429 . . . . 100.29 112.159 174.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 23' ' ' LEU . . . . . . . . . . . . . 47.7 mt -72.94 1.04 9.56 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 112.542 0.571 . . . . 102.85 112.542 178.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 24' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 52.5 44.01 30.44 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.639 0.775 . . . . 118.88 111.502 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 25' ' ' ILE . . . . . . . . . . . . . 6.9 tp -93.5 155.77 3.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 105.869 -1.901 . . . . 112.31 105.869 170.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 26' ' ' ASP . . . . . . . . . . . . . . . -153.04 105.7 2.95 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 119.497 -0.881 . . . . 115.98 109.538 -168.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 27' ' ' PHE . . . . . . . . . . . . . . . -178.0 149.08 0.55 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 106.881 -1.526 . . . . 108.95 106.881 179.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.42 -52.86 63.08 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.875 0.845 . . . . 109.21 109.646 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 29' ' ' THR . . . . . . . . . . . . . 1.4 p -69.17 -19.93 64.01 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 125.236 1.415 . . . . 108.4 112.377 -174.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 30' ' ' ARG . . . . . . . . . . . . . . . -68.56 -43.34 76.82 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 124.11 0.881 . . . . 97.21 112.417 -173.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 31' ' ' LYS . . . . . . . . . . . . . . . -71.96 -40.55 68.58 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 117.706 -1.597 . . . . 97.74 110.933 176.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 32' ' ' ILE . . . . . 0.648 ' O ' ' N ' ' F' ' 34' ' ' VAL . . . -77.1 -160.81 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.258 0 C-N-CA 123.773 0.829 . . . . 89.91 110.105 174.908 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 33' ' ' ALA . . . . . . . . . . . . . . . 44.59 -29.33 0.0 OUTLIER 'General case' 0 C--O 1.237 0.411 0 N-CA-C 116.357 1.984 . . . . 76.76 116.357 -175.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 34' ' ' VAL . . . . . 0.648 ' N ' ' O ' ' F' ' 32' ' ' ILE . 2.5 t -74.03 -12.41 15.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 119.538 -0.865 . . . . 82.39 110.77 -179.702 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 35' ' ' ARG . . . . . . . . . . . . . . . -63.75 73.75 0.03 OUTLIER 'General case' 0 C--O 1.237 0.401 0 N-CA-C 108.278 -1.008 . . . . 78.59 108.278 174.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 36' ' ' LEU . . . . . 0.472 ' N ' ' O ' ' F' ' 34' ' ' VAL . . . -131.2 -162.59 1.23 Allowed 'General case' 0 C--O 1.237 0.445 0 N-CA-C 106.976 -1.49 . . . . 78.11 106.976 -176.659 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 37' ' ' THR . . . . . . . . . . . . . 1.1 t -136.12 156.75 48.25 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 121.57 -0.706 . . . . 84.06 110.102 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 38' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -128.14 150.27 50.06 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.089 -0.96 . . . . 82.08 110.275 -170.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 39' ' ' THR . . . . . . . . . . . . . 27.7 p -134.22 127.14 31.3 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 124.986 1.314 . . . . 84.24 108.56 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 40' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.29 124.56 50.52 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 122.632 0.373 . . . . 91.68 110.502 -174.709 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 t -98.02 111.85 28.72 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 107.005 -1.48 . . . . 84.84 107.005 173.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 42' ' ' ILE . . . . . . . . . . . . . 4.2 mt -110.44 128.2 66.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 123.523 0.729 . . . . 88.0 109.883 -176.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 43' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -111.61 119.12 37.63 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.221 -1.4 . . . . 110.9 107.221 166.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 44' ' ' GLN . . . . . 0.538 ' OE1' ' N ' ' F' ' 4' ' ' PHE . 35.3 tt0 -127.61 116.3 20.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.497 -0.557 . . . . 94.87 109.497 -177.499 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 45' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -116.46 99.66 7.33 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 106.638 -1.615 . . . . 100.89 106.638 174.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 46' ' ' GLY . . . . . . . . . . . . . . . 62.8 -109.31 2.59 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.396 -0.907 . . . . 94.41 111.049 -176.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 47' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -105.05 2.24 29.32 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 113.329 0.863 . . . . 110.68 113.329 177.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 48' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -94.34 127.77 40.43 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 118.85 0.75 . . . . 92.7 109.857 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 49' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -125.21 141.16 52.26 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.508 -0.314 . . . . 98.07 111.139 -175.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 3.8 mtmm -134.15 109.68 9.07 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 108.192 -1.04 . . . . 88.38 108.192 172.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 51' ' ' THR . . . . . . . . . . . . . 6.8 p -110.63 145.57 37.67 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 123.873 0.869 . . . . 80.6 111.16 -173.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 52' ' ' LYS . . . . . . . . . . . . . . . -130.91 119.67 22.49 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.371 -0.831 . . . . 78.75 108.904 173.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 53' ' ' ALA . . . . . . . . . . . . . . . -106.25 104.78 14.56 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 122.85 0.46 . . . . 78.68 110.024 -175.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 54' ' ' THR . . . . . . . . . . . . . 35.1 m -94.24 144.0 25.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.294 1.038 . . . . 82.33 110.623 177.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 55' ' ' SER . . . . . . . . . . . . . 2.7 m -117.74 142.38 47.33 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.846 -1.168 . . . . 83.91 107.846 175.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 56' ' ' THR . . . . . . . . . . . . . 2.0 p -135.93 9.64 3.31 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 116.181 1.919 . . . . 89.27 116.181 -168.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 57' ' ' PHE . . . . . . . . . . . . . 1.2 m-30 63.51 134.0 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.461 1.028 . . . . 85.72 112.603 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 58' ' ' LEU . . . . . . . . . . . . . 1.9 mt -82.67 114.18 20.86 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 122.857 0.463 . . . . 78.95 111.733 -168.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 59' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 -57.53 116.15 3.19 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 123.489 0.716 . . . . 94.43 111.334 172.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 60' ' ' TYR . . . . . . . . . . . . . . . -84.15 116.55 22.97 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.712 -0.847 . . . . 82.19 108.712 174.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 61' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -107.81 134.89 50.11 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 120.664 0.268 . . . . 85.4 110.774 -175.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 62' ' ' VAL . . . . . . . . . . . . . 2.1 p -139.06 119.1 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 N-CA-C 107.38 -1.341 . . . . 79.68 107.38 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 63' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -122.86 130.53 52.98 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.115 0.566 . . . . 82.11 109.568 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 64' ' ' PHE . . . . . 0.436 ' O ' ' N ' ' E' ' 49' ' ' PHE . 54.3 p90 -150.82 163.17 39.27 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.524 0.678 . . . . 68.64 110.371 -173.143 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 65' ' ' THR . . . . . . . . . . . . . 1.4 p -120.14 140.28 51.33 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.084 -0.962 . . . . 69.53 108.483 168.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 66' ' ' VAL . . . . . . . . . . . . . 34.7 t -71.55 128.3 34.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 115.903 -0.59 . . . . 74.73 110.326 -171.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 67' ' ' GLY . . . . . . . . . . . . . . . 104.27 -20.69 39.51 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-O 118.961 -0.911 . . . . 71.54 115.321 -177.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -100.75 127.62 53.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 118.59 1.195 . . . . 77.62 109.484 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 69' ' ' GLU . . . . . . . . . . . . . . . -72.9 136.02 45.19 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.443 -0.577 . . . . 77.06 109.443 173.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 70' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -133.28 168.3 18.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.694 0.759 . . . . 79.79 109.756 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 71' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -99.27 125.33 44.86 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.314 -0.857 . . . . 75.31 108.796 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 72' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -121.7 125.52 46.8 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 110.137 -0.32 . . . . 77.95 110.137 -176.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 73' ' ' TYR . . . . . . . . . . . . . . . -100.81 105.27 16.56 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.688 -1.227 . . . . 81.0 107.688 171.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 74' ' ' THR . . . . . . . . . . . . . 67.8 p -76.07 70.64 2.77 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 122.637 1.208 . . . . 80.86 109.41 -173.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 75' ' ' LYS . . . . . . . . . . . . . . . -63.39 -25.68 68.4 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.994 -1.003 . . . . 82.49 113.356 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 76' ' ' SER . . . . . . . . . . . . . 1.1 p -67.37 -31.33 71.51 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 112.793 0.664 . . . . 84.36 112.793 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 77' ' ' LEU . . . . . . . . . . . . . 84.3 mt -122.17 -101.21 0.41 Allowed 'General case' 0 C--O 1.237 0.432 0 N-CA-C 114.307 1.225 . . . . 90.7 114.307 -169.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 78' ' ' ASP . . . . . 0.517 ' N ' ' OD1' ' F' ' 78' ' ' ASP . 15.6 p-10 -87.08 -3.27 59.06 Favored 'General case' 0 CA--C 1.502 -0.883 0 C-N-CA 122.539 0.336 . . . . 80.62 111.535 -171.836 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 79' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 55.43 46.17 23.78 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-O 122.359 1.075 . . . . 91.13 110.37 172.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 80' ' ' ARG . . . . . . . . . . . . . . . -108.78 160.37 16.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.29 -1.323 . . . . 81.29 111.411 179.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 81' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -95.57 127.11 41.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.74 -1.118 . . . . 79.14 108.949 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 82' ' ' VAL . . . . . . . . . . . . . 30.2 m -132.33 151.43 34.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.618 0.723 . . . . 77.94 109.256 178.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 83' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -97.57 109.59 22.31 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 105.352 -2.092 . . . . 74.51 105.352 171.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 84' ' ' ALA . . . . . . . . . . . . . . . -112.09 140.14 47.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.969 0.414 . . . . 73.27 110.176 -171.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 85' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -137.99 135.7 36.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.388 -0.968 . . . . 73.28 108.388 175.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 86' ' ' VAL . . . . . . . . . . . . . 4.6 t -112.63 137.2 46.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 108.427 -0.953 . . . . 68.05 108.427 -177.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 87' ' ' THR . . . . . . . . . . . . . 47.4 p -132.81 159.14 40.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.013 0.911 . . . . 70.5 109.779 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 88' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -90.77 121.0 32.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.316 -1.311 . . . . 72.31 107.697 171.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 89' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -111.85 92.87 4.19 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 103.614 -2.736 . . . . 87.33 103.614 170.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 90' ' ' GLY . . . . . . . . . . . . . . . 71.94 -111.86 3.81 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 106.882 -2.487 . . . . 78.43 106.882 -170.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -116.95 28.89 8.25 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 119.131 -0.461 . . . . 86.16 111.647 171.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 92' ' ' VAL . . . . . . . . . . . . . 3.3 m -115.48 137.16 49.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 105.44 -2.059 . . . . 73.91 105.44 -177.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 93' ' ' LEU . . . . . . . . . . . . . 2.4 mt -86.45 111.22 20.33 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.336 -0.545 . . . . 75.28 109.736 178.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 94' ' ' VAL . . . . . . . . . . . . . 4.6 t -110.47 122.46 65.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.351 -0.981 . . . . 68.93 108.351 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 95' ' ' CYS . . . . . . . . . . . . . 6.3 t -116.92 130.33 56.63 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.352 -0.61 . . . . 73.0 109.352 -178.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 96' ' ' VAL . . . . . . . . . . . . . 3.6 t -109.26 131.43 60.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 107.834 -1.173 . . . . 75.51 107.834 174.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 97' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -116.46 93.68 4.32 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 107.337 -1.357 . . . . 81.14 107.337 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 98' ' ' LYS . . . . . . . . . . . . . . . -75.05 135.35 41.25 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.202 0.525 . . . . 68.93 110.952 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 99' ' ' GLY . . . . . . . . . . . . . . . 175.6 -150.59 11.0 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.7 -0.682 . . . . 81.09 113.151 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 100' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.22 -38.08 89.77 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.488 -0.485 . . . . 82.92 111.299 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 101' ' ' LYS . . . . . . . . . . . . . . . -79.81 134.14 36.33 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.695 -0.854 . . . . 87.7 108.695 -179.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 102' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -88.22 148.14 24.51 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.101 -1.074 . . . . 96.82 108.101 -179.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 103' ' ' ASN . . . . . 0.611 ' ND2' ' O ' ' F' ' 122' ' ' GLY . 12.3 t-20 62.59 36.87 13.47 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 118.652 -1.219 . . . . 112.83 113.183 176.406 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 104' ' ' ARG . . . . . 0.506 ' NH1' ' OD2' ' F' ' 78' ' ' ASP . 31.9 ttt180 -105.13 128.6 53.45 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 118.868 0.758 . . . . 88.14 111.456 -173.209 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.15 -163.39 32.08 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.329 -0.939 . . . . 81.88 110.998 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 106' ' ' TRP . . . . . . . . . . . . . 42.2 p-90 -158.68 167.15 30.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 122.033 0.92 . . . . 74.8 109.662 175.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 107' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt -130.27 138.22 50.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.182 -1.372 . . . . 73.71 108.492 176.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 108' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -131.45 129.99 41.9 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.218 -1.401 . . . . 71.76 107.218 -177.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 109' ' ' TRP . . . . . . . . . . . . . 15.9 p90 -153.8 169.61 22.96 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 118.733 -1.187 . . . . 85.75 109.889 176.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 110' ' ' ILE . . . . . . . . . . . . . 3.2 tp -123.53 131.28 73.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 113.782 -1.553 . . . . 106.64 109.304 -166.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 111' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -127.41 105.47 8.54 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 106.38 -1.711 . . . . 114.52 106.38 171.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 112' ' ' GLY . . . . . . . . . . . . . . . 68.57 -106.93 1.89 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.83 -1.308 . . . . 111.92 109.83 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -126.76 30.16 5.55 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.924 0.889 . . . . 108.12 111.026 175.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 114' ' ' LYS . . . . . . . . . . . . . . . -114.08 144.62 42.83 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.029 -0.73 . . . . 109.54 109.029 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 115' ' ' LEU . . . . . . . . . . . . . . . -104.36 134.6 47.3 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.106 -0.701 . . . . 90.94 109.106 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 116' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -121.5 123.58 42.36 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.663 -1.236 . . . . 89.55 107.663 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 117' ' ' LEU . . . . . . . . . . . . . 56.2 tp -133.54 118.39 18.23 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.573 -0.529 . . . . 70.93 109.573 -175.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 118' ' ' GLU . . . . . . . . . . . . . . . -114.23 111.26 21.25 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.037 -1.097 . . . . 76.75 108.037 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 119' ' ' LEU . . . . . . . . . . . . . 1.2 mp -94.95 126.6 40.4 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.383 -0.969 . . . . 76.3 108.383 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 120' ' ' THR . . . . . . . . . . . . . 1.6 p -127.09 106.74 9.47 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 110.026 -0.361 . . . . 93.18 110.026 -166.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 121' ' ' CYS . . . . . . . . . . . . . 47.2 t -113.04 155.82 24.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.939 -0.763 . . . . 100.29 108.939 169.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 122' ' ' GLY . . . . . 0.611 ' O ' ' ND2' ' F' ' 103' ' ' ASN . . . 20.21 -97.6 0.01 OUTLIER Glycine 0 C--N 1.338 0.681 0 N-CA-C 115.628 1.011 . . . . 108.98 115.628 -172.213 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 123' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -97.98 -39.57 8.89 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.943 1.297 . . . . 113.12 112.976 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 124' ' ' GLN . . . . . . . . . . . . . . . -83.21 118.94 23.96 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.249 0.547 . . . . 104.14 111.744 -173.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 125' ' ' VAL . . . . . . . . . . . . . 2.4 p -104.27 148.47 8.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.229 -1.026 . . . . 80.45 108.229 169.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 126' ' ' CYS . . . . . . . . . . . . . 6.7 t -123.84 124.05 41.79 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.057 1.343 . . . . 80.39 108.563 -177.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 127' ' ' ARG . . . . . . . . . . . . . . . -105.35 125.91 51.51 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.047 0.539 . . . . 79.49 109.768 -176.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 128' ' ' GLN . . . . . . . . . . . . . . . -129.37 141.1 51.15 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.537 0.735 . . . . 80.33 109.479 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 129' ' ' VAL . . . . . 0.571 ' O ' ' N ' ' E' ' 11' ' ' GLU . . . -124.75 138.03 55.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.414 -0.958 . . . . 83.82 108.414 177.946 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 130' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -122.86 142.65 50.54 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.172 -0.677 . . . . 91.74 109.172 -177.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 131' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' E' ' 9' ' ' GLU . . . -105.15 140.16 38.74 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.446 -0.576 . . . . 96.26 109.446 174.123 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 132' ' ' LYS . . . . . . . . . . . . . 44.3 tttt -79.47 132.57 36.39 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.812 -0.81 . . . . 100.48 108.812 178.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 133' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 102.13 111.104 -176.736 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.551 ' O ' ' NZ ' ' A' ' 31' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.5 t . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.769 0.319 . . . . 63.17 111.008 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -118.96 15.05 13.34 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 112.879 0.696 . . . . 51.27 112.879 -178.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -102.37 102.72 13.09 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.726 -0.842 . . . . 65.52 108.726 -176.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -96.07 11.06 35.51 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.961 0.726 . . . . 56.09 112.961 178.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -65.41 138.86 58.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 118.239 0.472 . . . . 65.54 111.277 -175.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.66 -174.82 19.28 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.48 -0.867 . . . . 56.08 112.248 171.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . 0.439 HG23 HG12 ' A' ' 41' ' ' VAL . 16.9 m -102.95 127.24 50.25 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 122.967 0.507 . . . . 50.54 109.808 -179.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 58.1 m95 -120.83 120.78 36.57 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.587 -0.894 . . . . 52.13 108.587 -176.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -103.66 131.7 50.58 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.47 0.708 . . . . 78.07 109.254 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 57.8 ttm -68.02 141.1 56.32 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.062 0.764 . . . . 46.37 113.062 -173.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . 0.655 ' OE2' ' HD2' ' D' ' 131' ' ' LYS 0.272 2.4 mt-10 -124.73 -3.77 7.71 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 116.407 2.003 . . . . 79.06 116.407 163.642 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . 0.47 ' HB2' HG12 ' D' ' 129' ' ' VAL . 36.4 m -145.51 161.12 40.49 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 120.33 1.423 . . . . 64.59 111.252 165.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -156.59 90.31 1.16 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 104.798 -2.297 . . . . 45.41 104.798 -178.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -103.76 135.24 45.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.432 -0.804 . . . . 72.49 110.035 -175.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.1 t30 50.69 46.47 25.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.883 0.849 . . . . 46.21 111.829 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -73.63 -38.38 65.06 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 115.543 -0.753 . . . . 33.2 110.863 170.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -69.44 -39.08 78.01 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 120.774 -0.37 . . . . 54.03 111.593 -176.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.06 -39.86 94.9 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 119.781 -1.2 . . . . 39.1 112.447 175.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -60.78 -44.42 96.82 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 122.348 -0.501 . . . . 39.52 111.436 175.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 59.0 mtm -69.98 -35.84 74.73 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 119.736 -0.785 . . . . 53.23 111.7 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -62.09 -41.64 98.39 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.107 -0.371 . . . . 51.44 111.393 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.37 70.61 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.162 -0.615 . . . . 43.53 111.698 176.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 21.9 mt -78.47 3.6 15.5 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.101 0.778 . . . . 35.1 113.101 176.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 55.13 49.28 17.75 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 122.098 0.951 . . . . 56.11 110.621 -177.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.1 mt -89.09 158.73 2.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.756 -1.201 . . . . 38.73 107.756 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -95.19 145.2 25.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.384 0.612 . . . . 51.81 110.413 -168.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -40.62 -45.26 2.3 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.601 1.161 . . . . 40.75 112.986 -178.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . 0.541 ' O ' HG13 ' A' ' 32' ' ' ILE . . . -58.4 -59.68 4.96 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 120.973 0.416 . . . . 35.8 111.828 -179.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . 0.499 HG23 ' HB3' ' D' ' 31' ' ' LYS . 3.3 p -71.59 -21.54 61.85 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 119.066 -1.054 . . . . 40.68 111.975 -176.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . 0.495 ' O ' HG13 ' A' ' 34' ' ' VAL . 24.2 mtm105 -69.66 -42.65 73.93 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.494 -0.883 . . . . 42.11 110.661 172.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . 0.428 ' NZ ' ' O ' ' A' ' 301' ' ' HOH . 7.0 mmpt? -66.12 -32.1 73.35 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 111.81 0.3 . . . . 42.49 111.81 178.431 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 28' ' ' ALA . 9.3 mt -72.54 -47.39 51.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 C-N-CA 118.864 -1.134 . . . . 54.99 110.592 174.17 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.74 -24.94 65.41 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 121.775 -0.578 . . . . 34.63 111.876 -173.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 30' ' ' ARG . 33.2 m -72.81 -13.47 16.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 119.518 -0.873 . . . . 37.59 111.512 176.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 52.4 ttm-85 -103.91 36.41 2.34 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.723 0.809 . . . . 51.59 111.373 178.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 67.3 mt -134.18 169.78 16.66 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 120.817 -1.177 . . . . 34.12 110.676 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.4 t -142.87 158.21 43.84 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 106.503 -1.665 . . . . 39.89 106.503 167.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -127.58 151.07 49.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.478 0.656 . . . . 36.39 110.864 -169.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.0 m -132.43 121.57 23.62 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.423 -1.325 . . . . 45.33 107.423 173.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -111.15 123.28 49.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.707 -0.479 . . . . 64.15 109.707 -174.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . 0.439 HG12 HG23 ' A' ' 7' ' ' THR . 34.2 m -98.53 116.37 41.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.556 0 N-CA-C 107.526 -1.287 . . . . 54.58 107.526 172.542 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 55.3 mt -107.5 127.31 63.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 108.617 -0.883 . . . . 58.18 108.617 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -113.56 113.43 25.09 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 124.342 1.057 . . . . 83.89 109.337 170.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -127.82 116.63 20.46 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.106 -0.701 . . . . 56.4 109.106 -171.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -116.03 101.48 8.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.263 -1.754 . . . . 75.42 106.263 173.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.45 -109.13 2.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.89 -0.671 . . . . 58.32 112.578 -177.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -103.81 2.7 33.09 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 112.867 0.691 . . . . 58.21 112.867 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . . . -94.79 128.97 41.89 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 118.436 0.562 . . . . 47.7 109.761 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -122.98 139.01 54.52 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.211 0.604 . . . . 54.23 110.435 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . . . -136.02 107.65 6.98 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.46 -1.311 . . . . 53.08 107.46 173.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.7 p -109.32 142.92 39.53 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.552 -0.536 . . . . 57.32 109.552 -174.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -131.21 119.39 21.78 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.546 -0.909 . . . . 66.64 108.546 172.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -106.37 106.77 17.44 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.766 0.826 . . . . 44.93 109.56 -175.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.7 p -91.14 142.58 27.59 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 123.52 0.728 . . . . 44.01 109.747 178.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.8 m -116.47 138.33 51.46 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.109 -0.496 . . . . 39.79 110.159 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 14.0 t -144.63 149.85 36.42 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.019 -1.104 . . . . 49.18 108.019 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -65.89 162.35 19.24 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.924 0.869 . . . . 39.95 110.464 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.2 tp -80.41 168.3 19.16 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.421 -0.809 . . . . 50.88 109.811 -172.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -112.35 114.85 27.81 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.745 -0.661 . . . . 67.89 109.404 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' TYR . . . . . 0.564 ' HE2' ' H2 ' ' A' ' 203' ' ' GOL . 27.4 t80 -83.17 101.81 11.46 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.162 0.985 . . . . 59.44 109.877 178.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -98.12 136.46 38.33 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.775 -0.824 . . . . 59.86 108.775 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 63.2 t -138.64 121.2 18.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 108.15 -1.055 . . . . 48.33 108.15 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -119.87 129.95 54.64 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 109.724 -0.473 . . . . 56.79 109.724 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -151.86 160.12 43.64 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.625 0.726 . . . . 39.39 109.237 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . . . -120.6 140.24 51.82 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.745 -1.116 . . . . 45.47 108.405 170.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . 0.531 HG11 ' CD1' ' A' ' 88' ' ' TRP . 7.4 t -71.48 125.43 29.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 109.581 -0.526 . . . . 49.81 109.581 -173.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 100.96 -21.68 42.61 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-O 119.378 -0.679 . . . . 46.44 114.211 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.8 t -100.51 123.46 53.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.276 -1.009 . . . . 56.72 108.276 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -72.9 136.18 45.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.987 -1.006 . . . . 75.99 109.566 177.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -132.13 167.87 18.99 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.83 0.824 . . . . 54.81 110.768 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . 0.412 ' OD1' ' HD3' ' A' ' 83' ' ' LYS . 36.2 m-20 -99.98 126.68 46.2 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 114.874 -1.057 . . . . 64.1 109.162 179.754 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -121.26 123.58 42.54 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.483 -0.562 . . . . 57.83 109.483 -177.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . . . -102.16 104.35 14.93 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 107.011 -1.478 . . . . 57.29 107.011 171.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.2 p -78.82 69.29 4.96 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 122.311 1.053 . . . . 54.07 110.282 -173.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . . . -65.13 -30.58 71.52 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.209 -0.905 . . . . 45.55 112.079 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.0 p -56.15 -32.47 64.32 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 113.619 0.97 . . . . 65.24 113.619 173.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -119.94 -103.27 0.41 Allowed 'General case' 0 C--O 1.241 0.622 0 N-CA-C 109.589 -0.522 . . . . 60.84 109.589 -168.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -90.1 2.37 55.34 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 121.101 -0.999 . . . . 56.06 113.494 -171.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 49.53 50.83 17.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.889 0.852 . . . . 56.87 111.167 -174.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . 0.467 ' NH1' ' OE2' ' A' ' 100' ' ' GLU . 7.3 mtm-85 -110.15 156.5 20.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.712 0.768 . . . . 51.33 110.05 175.2 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -97.57 126.56 42.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 61.79 108.546 174.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 22.5 m -132.75 151.32 34.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 108.036 -1.098 . . . . 51.67 108.036 177.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LYS . . . . . 0.412 ' HD3' ' OD1' ' A' ' 71' ' ' ASP . 2.2 tppt? -98.43 112.92 24.78 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 106.325 -1.732 . . . . 75.6 106.325 172.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . 0.487 ' HA ' ' O ' ' A' ' 96' ' ' VAL . . . -110.89 143.9 40.77 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.917 0.389 . . . . 52.99 110.397 -170.946 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . 0.407 ' O ' ' HA ' ' A' ' 95' ' ' CYS . 15.0 tp -135.3 138.51 43.52 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.905 -0.776 . . . . 43.03 108.905 175.705 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.1 t -113.13 136.26 50.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.762 -0.829 . . . . 45.77 108.762 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.5 m -134.07 157.51 45.96 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.544 0.688 . . . . 47.1 109.522 -179.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' TRP . . . . . 0.531 ' CD1' HG11 ' A' ' 66' ' ' VAL . 51.3 m95 -91.62 120.53 32.47 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.918 -1.037 . . . . 39.51 109.584 173.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 76.1 mt-10 -115.17 90.69 3.4 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 104.256 -2.498 . . . . 46.17 104.256 168.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.59 -112.04 4.07 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 110.014 -1.234 . . . . 41.99 110.014 -173.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -114.31 27.03 9.78 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 122.744 0.418 . . . . 50.63 111.39 171.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . 0.507 HG22 ' HB3' ' A' ' 109' ' ' TRP . 92.1 t -114.51 133.03 61.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 108.482 -0.932 . . . . 39.6 108.482 -179.309 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.9 mt -86.33 110.78 19.9 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.506 -1.294 . . . . 40.01 107.506 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . 0.461 HG13 ' HG2' ' A' ' 107' ' ' LYS . 4.0 t -110.48 120.59 61.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.429 -1.323 . . . . 47.91 107.429 178.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 13.4 t -117.66 131.08 56.69 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.999 -0.741 . . . . 37.34 108.999 -177.517 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . 0.487 ' O ' ' HA ' ' A' ' 84' ' ' ALA . 9.8 p -107.25 133.86 50.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 107.69 -1.226 . . . . 47.59 107.69 174.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLN . . . . . 0.454 ' HB2' ' HD3' ' A' ' 104' ' ' ARG . 36.2 mt-30 -116.19 92.83 4.01 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.042 -1.466 . . . . 48.97 107.042 179.779 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 45.6 mmtt -75.45 133.98 40.97 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 110.027 -0.36 . . . . 58.7 110.027 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.12 -151.3 11.45 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.993 -0.549 . . . . 65.4 112.902 -178.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . 0.467 ' OE2' ' NH1' ' A' ' 80' ' ' ARG . 57.3 tt0 -64.32 -39.62 94.27 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.415 -0.514 . . . . 86.79 111.568 -178.345 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -83.32 136.15 34.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.018 0.437 . . . . 66.87 110.485 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . 0.416 ' H ' ' HG2' ' A' ' 102' ' ' GLU . 3.2 pt-20 -89.84 144.95 25.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.42 0.629 . . . . 80.84 110.781 -179.241 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 1.8 t30 60.57 45.04 10.96 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.265 -0.88 . . . . 82.97 111.306 177.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ARG . . . . . 0.454 ' HD3' ' HB2' ' A' ' 97' ' ' GLN . 11.5 ttt85 -104.4 129.49 52.34 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.237 -0.653 . . . . 54.8 109.237 -177.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 176.44 -162.89 31.79 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.267 -0.968 . . . . 41.94 111.125 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' TRP . . . . . 0.555 ' HB3' HD23 ' A' ' 119' ' ' LEU . 36.6 p-90 -159.19 166.97 30.25 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 119.63 -0.828 . . . . 44.28 110.442 176.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LYS . . . . . 0.461 ' HG2' HG13 ' A' ' 94' ' ' VAL . 87.3 mttt -133.44 139.01 46.48 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 114.632 -1.167 . . . . 45.11 109.694 176.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . 0.683 ' HG3' HD13 ' A' ' 117' ' ' LEU . 9.8 mttt -132.15 130.89 41.71 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 124.026 0.931 . . . . 45.21 109.363 -176.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' TRP . . . . . 0.507 ' HB3' HG22 ' A' ' 92' ' ' VAL . 20.9 p90 -154.79 169.5 23.83 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 119.261 -0.976 . . . . 48.43 110.381 176.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 13.1 mm -120.56 131.04 73.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 108.412 -0.959 . . . . 46.25 108.412 -173.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . . . -125.63 108.44 11.56 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 107.641 -1.244 . . . . 51.66 107.641 172.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 70.35 -105.93 1.71 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 110.199 -1.16 . . . . 64.45 110.199 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -123.94 21.26 9.07 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 122.658 0.383 . . . . 67.7 111.398 175.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -118.57 144.67 45.94 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.015 0.436 . . . . 55.18 110.358 179.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 24.0 tp -104.95 135.85 45.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.723 -0.671 . . . . 40.64 109.387 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -120.8 126.92 51.34 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.924 -0.769 . . . . 45.69 108.924 -179.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . 0.683 HD13 ' HG3' ' A' ' 108' ' ' LYS . 23.8 tp -131.04 120.75 23.89 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.794 -0.817 . . . . 49.63 108.794 -177.648 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -112.37 112.88 24.77 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.901 -1.148 . . . . 65.65 107.901 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . 0.555 HD23 ' HB3' ' A' ' 106' ' ' TRP . 15.4 mt -92.62 130.13 38.35 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.228 -1.027 . . . . 46.54 108.228 175.406 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 22.2 m -127.7 103.06 7.09 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.077 0.551 . . . . 59.66 110.678 -167.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 34.7 t -122.34 155.27 36.34 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.103 -1.073 . . . . 60.11 108.103 168.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 20.88 -105.15 0.01 OUTLIER Glycine 0 C--N 1.336 0.582 0 N-CA-C 116.141 1.217 . . . . 71.79 116.141 -169.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -100.05 -19.09 16.69 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.568 0.951 . . . . 76.89 113.568 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -87.77 118.74 27.49 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 122.859 0.463 . . . . 64.4 111.281 -176.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 22.9 t -103.82 145.57 12.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 108.409 -0.96 . . . . 50.94 108.409 169.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' CYS . . . . . 0.415 ' HB2' ' HB2' ' B' ' 19' ' ' TYR . 32.1 t -127.4 123.41 36.09 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.361 -0.977 . . . . 47.01 108.361 178.946 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . . . -106.66 125.63 51.25 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 110.132 -0.321 . . . . 44.2 110.132 -177.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -128.88 138.01 51.78 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 108.504 -0.924 . . . . 45.44 108.504 176.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 3.6 p -127.1 139.08 52.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.554 -0.906 . . . . 43.6 108.554 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -121.34 145.0 48.33 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 123.99 0.916 . . . . 46.2 109.121 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LYS . . . . . 0.627 ' HD3' ' HE2' ' A' ' 133' ' ' LYS . 14.1 tttp -102.01 140.85 35.74 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.44 -0.948 . . . . 70.57 108.44 174.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -78.06 133.05 37.97 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 120.648 -0.421 . . . . 43.54 110.244 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . 0.627 ' HE2' ' HD3' ' A' ' 131' ' ' LYS . 10.5 mmtp . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.93 -0.577 . . . . 65.5 110.837 -178.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' THR . . . . . . . . . . . . . 63.0 p . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.781 0.324 . . . . 49.65 110.86 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ARG . . . . . 0.512 ' O ' ' NE2' ' B' ' 44' ' ' GLN . 7.6 mmt180 68.94 -13.59 0.33 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.282 1.033 . . . . 44.81 113.531 173.51 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -105.2 98.26 7.99 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.983 -1.118 . . . . 40.8 107.983 176.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -99.42 8.82 44.27 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 112.583 0.586 . . . . 36.77 112.583 177.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -66.14 137.89 57.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.137 0.494 . . . . 35.75 111.312 -174.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 128.67 -174.93 18.88 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-O 121.872 0.707 . . . . 32.28 112.002 171.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 90.4 m -103.2 127.53 50.47 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.237 -0.653 . . . . 41.62 109.237 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' TRP . . . . . . . . . . . . . 62.5 m95 -120.56 122.22 40.09 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.89 -0.782 . . . . 37.6 108.89 -175.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -102.78 130.87 49.9 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.599 0.76 . . . . 79.54 110.074 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' MET . . . . . 0.401 ' HB3' HG22 ' B' ' 37' ' ' THR . 38.5 ttm -67.74 142.83 56.15 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.468 0.651 . . . . 42.29 112.026 -174.404 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -123.29 -20.67 5.58 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 113.624 0.972 . . . . 64.71 113.624 172.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -143.83 160.55 40.57 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.819 0.818 . . . . 49.11 110.201 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -160.64 91.86 0.93 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 106.226 -1.768 . . . . 47.45 106.226 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -103.0 134.18 46.88 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.126 -0.488 . . . . 72.02 110.234 -175.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ASN . . . . . . . . . . . . . 50.4 t30 50.09 47.6 23.23 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.753 0.787 . . . . 49.27 111.796 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -73.59 -39.32 64.7 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.076 -0.649 . . . . 44.34 110.99 171.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -66.38 -40.85 89.96 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 120.736 0.303 . . . . 90.63 110.293 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.95 -39.17 94.79 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.551 -0.833 . . . . 50.01 112.31 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' TYR . . . . . 0.415 ' HB2' ' HB2' ' A' ' 126' ' ' CYS . 73.0 t80 -61.16 -44.28 97.55 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.572 -0.451 . . . . 47.31 111.168 174.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 59.4 mtm -69.74 -36.22 75.64 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.799 -0.76 . . . . 47.52 111.693 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -62.15 -41.58 98.42 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 122.18 -0.325 . . . . 56.84 111.088 174.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.23 -30.55 71.18 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.988 -0.685 . . . . 49.27 110.826 175.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . 0.431 ' O ' ' NH2' ' A' ' 80' ' ' ARG . 40.6 mt -79.77 -0.97 36.62 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 119.222 -0.418 . . . . 50.47 111.912 172.382 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 52.17 52.47 14.25 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 122.119 0.961 . . . . 75.37 110.977 -178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 35.9 mt -86.05 159.72 3.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 107.728 -1.212 . . . . 51.18 107.728 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -93.17 144.91 24.82 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.58 0.705 . . . . 52.7 110.664 -167.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -39.85 -43.16 1.42 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.228 1.411 . . . . 60.66 114.37 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ALA . . . . . 0.424 ' O ' HG13 ' B' ' 32' ' ' ILE . . . -58.62 -61.77 2.35 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 120.667 -0.413 . . . . 34.69 111.79 -178.382 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' THR . . . . . 0.721 ' HA ' HD12 ' B' ' 32' ' ' ILE . 15.5 p -74.1 -16.71 61.01 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 119.411 -0.916 . . . . 49.15 111.954 -177.195 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 10.6 mtm-85 -68.99 -41.61 77.6 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.662 -0.815 . . . . 56.24 110.424 170.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 38.6 mmtt -67.57 -31.82 72.15 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 121.102 -0.239 . . . . 53.82 111.441 175.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ILE . . . . . 0.721 HD12 ' HA ' ' B' ' 29' ' ' THR . 19.3 mt -69.9 -49.81 53.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 C-N-CA 119.623 -0.831 . . . . 42.71 110.608 176.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.52 -24.5 63.75 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.821 0.675 . . . . 46.81 112.821 -173.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 2.0 p -73.51 -14.12 16.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 112.365 0.506 . . . . 48.75 112.365 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 4.2 mtp85 -105.54 40.6 1.52 Allowed 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.174 0.59 . . . . 59.45 111.825 176.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.46 171.96 12.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 122.397 1.094 . . . . 45.33 110.987 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' THR . . . . . 0.401 HG22 ' HB3' ' B' ' 10' ' ' MET . 1.4 m -140.34 155.83 46.65 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 106.321 -1.733 . . . . 49.88 106.321 169.124 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -127.89 149.45 50.3 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.637 0.732 . . . . 38.76 109.885 -172.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 2.8 m -133.39 123.6 25.65 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.39 -1.337 . . . . 52.38 107.39 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -109.75 120.58 42.93 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.924 -0.769 . . . . 57.65 108.924 -176.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.79 114.01 36.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 106.667 -1.605 . . . . 36.14 106.667 172.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 57.2 mt -108.52 126.07 65.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 108.447 -0.946 . . . . 36.1 108.447 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -113.2 116.48 29.86 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 107.345 -1.354 . . . . 62.82 107.345 169.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' B' ' 2' ' ' ARG . 34.8 tt0 -125.44 117.89 24.64 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.494 -0.558 . . . . 39.78 109.494 -170.64 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -115.1 99.32 7.35 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.264 -1.384 . . . . 46.4 107.264 175.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.27 -109.49 2.76 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.173 -0.537 . . . . 40.2 112.312 -177.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -103.7 2.76 33.47 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.47 0.544 . . . . 50.87 112.47 177.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ASN . . . . . . . . . . . . . 11.5 m-20 -93.46 130.25 39.34 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.444 -0.576 . . . . 50.38 109.444 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -122.34 141.87 51.1 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.8 0.44 . . . . 43.74 110.237 -175.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -132.33 115.36 15.52 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.096 -1.075 . . . . 57.92 108.096 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 26.9 m -103.98 141.5 36.07 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 124.547 1.139 . . . . 50.07 111.152 -171.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 6.0 tttm -134.25 115.72 14.47 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 108.097 -1.075 . . . . 60.51 108.097 166.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -109.46 102.43 11.31 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.268 -1.012 . . . . 41.47 108.268 -178.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 20.7 p -95.65 141.87 28.64 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 122.909 0.484 . . . . 50.47 110.249 177.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.3 m -118.66 141.58 48.47 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 122.886 0.475 . . . . 49.9 110.536 179.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 10.5 m -140.61 161.15 38.43 Favored 'General case' 0 C--N 1.334 -0.094 0 N-CA-C 108.155 -1.054 . . . . 69.1 108.155 -176.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -82.41 158.02 23.46 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 118.224 -1.39 . . . . 37.75 110.666 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.9 mt -86.73 117.59 25.59 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.237 -0.892 . . . . 38.16 110.684 -173.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -58.63 116.76 3.91 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.376 -0.375 . . . . 53.53 111.196 174.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -81.85 120.19 24.86 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.706 -0.479 . . . . 63.12 109.706 177.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -107.97 136.51 47.55 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 122.787 0.435 . . . . 56.79 111.064 -176.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 27.3 m -139.78 121.4 15.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 108.168 -1.049 . . . . 58.41 108.168 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -119.77 127.13 52.52 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.926 -0.768 . . . . 71.56 108.926 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' PHE . . . . . 0.414 ' CD1' HG11 ' B' ' 86' ' ' VAL . 49.6 p90 -153.67 159.32 42.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.525 0.679 . . . . 58.12 109.22 -176.943 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' THR . . . . . 0.904 HG22 ' HA ' ' D' ' 48' ' ' ASN . 29.2 p -125.3 141.89 51.82 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.936 -1.029 . . . . 64.91 109.709 169.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' VAL . . . . . 0.579 ' HA ' HG13 ' B' ' 86' ' ' VAL . 6.8 t -70.84 128.44 34.07 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-N 115.603 -0.726 . . . . 66.31 110.232 -172.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 106.38 -23.07 29.48 Favored Glycine 0 C--N 1.335 0.495 0 N-CA-C 116.397 1.319 . . . . 74.74 116.397 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 1.5 m -102.52 127.75 55.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 119.253 1.526 . . . . 66.62 108.993 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . . . -69.33 137.49 52.98 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.223 -0.658 . . . . 69.72 109.223 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -131.51 168.75 17.13 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.857 0.837 . . . . 66.97 109.852 -179.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -97.98 125.16 42.78 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.919 -1.037 . . . . 89.91 108.768 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -121.63 123.84 42.9 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.319 -0.993 . . . . 74.77 108.319 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . . . -97.98 101.18 12.6 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 103.184 -2.895 . . . . 54.86 103.184 170.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' THR . . . . . 0.509 HG23 ' H ' ' B' ' 80' ' ' ARG . 1.6 t -76.52 72.46 3.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 122.531 1.158 . . . . 62.14 108.984 -171.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' LYS . . . . . 0.765 ' O ' ' N ' ' B' ' 77' ' ' LEU . 32.5 mttt -63.92 -149.87 0.01 OUTLIER 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.791 -1.559 . . . . 70.39 106.791 172.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 83.5 p 58.96 -37.02 0.06 Allowed 'General case' 0 N--CA 1.465 0.319 0 O-C-N 121.441 -0.787 . . . . 61.29 111.484 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' LEU . . . . . 0.765 ' N ' ' O ' ' B' ' 75' ' ' LYS . 14.6 mt -127.0 -104.4 0.33 Allowed 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.513 -0.551 . . . . 57.13 109.513 -171.092 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -92.44 -1.7 56.81 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 113.827 1.047 . . . . 55.49 113.827 -171.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 46.69 54.6 8.7 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.728 0.775 . . . . 77.77 111.866 -178.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ARG . . . . . 0.509 ' H ' HG23 ' B' ' 74' ' ' THR . 17.0 mtt180 -107.5 160.04 15.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.567 0.698 . . . . 61.29 110.144 176.512 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . . . -96.56 125.29 40.93 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.589 -0.893 . . . . 65.33 108.589 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 28.6 m -134.38 151.55 32.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.65 0.738 . . . . 59.94 109.726 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 2.9 mtpt -98.65 113.08 25.0 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 106.147 -1.797 . . . . 70.06 106.147 171.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -110.26 141.28 43.46 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.934 0.397 . . . . 58.62 110.443 -171.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 11.7 tp -137.46 128.87 28.14 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.77 -0.826 . . . . 68.8 108.77 175.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' VAL . . . . . 0.579 HG13 ' HA ' ' B' ' 66' ' ' VAL . 3.5 p -112.63 138.55 41.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.967 -1.123 . . . . 66.4 107.967 -178.685 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 3.1 p -132.82 157.61 44.56 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.779 0.799 . . . . 67.19 110.016 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -92.08 120.0 32.29 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 114.617 -1.174 . . . . 80.76 108.858 172.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLU . . . . . 0.477 ' O ' HG22 ' B' ' 92' ' ' VAL . 2.7 mm-40 -115.27 93.37 4.26 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 104.97 -2.233 . . . . 90.97 104.97 169.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.8 -111.46 3.74 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 109.728 -1.349 . . . . 81.48 109.728 -173.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . . . -115.37 27.0 9.65 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.868 0.322 . . . . 77.27 111.868 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' VAL . . . . . 0.477 HG22 ' O ' ' B' ' 89' ' ' GLU . 2.7 m -114.76 133.23 61.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 N-CA-C 108.764 -0.828 . . . . 68.48 108.764 179.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 12.8 mt -88.65 107.89 19.17 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 107.33 -1.359 . . . . 62.87 107.33 175.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' VAL . . . . . 0.426 HG13 HG23 ' B' ' 92' ' ' VAL . 5.1 m -112.92 119.28 60.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 108.028 -1.101 . . . . 63.89 108.028 179.36 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 18.1 t -118.77 130.74 55.96 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.909 -0.775 . . . . 70.16 108.909 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.4 p -108.79 136.28 45.05 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 N-CA-C 107.963 -1.125 . . . . 56.11 107.963 173.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -113.93 94.81 5.0 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 107.548 -1.278 . . . . 62.47 107.548 -178.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . . . -74.01 134.92 43.09 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.832 -0.622 . . . . 64.68 110.548 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.05 -149.82 10.21 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.438 -0.801 . . . . 71.03 112.562 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -63.39 -39.63 95.05 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.642 -0.423 . . . . 71.92 111.538 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . . . -83.84 136.26 34.19 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.009 0.433 . . . . 72.97 110.676 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . . . -90.67 144.91 25.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.994 -0.548 . . . . 62.25 110.761 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 t30 60.56 44.02 12.16 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.681 -0.69 . . . . 72.8 111.777 176.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -105.16 130.47 53.32 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.735 -0.468 . . . . 61.58 109.735 -177.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.78 -161.72 29.02 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 119.818 -1.182 . . . . 47.96 111.648 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' TRP . . . . . 0.552 ' HB3' HD23 ' B' ' 119' ' ' LEU . 51.9 p-90 -160.24 166.32 29.81 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.792 0.806 . . . . 56.28 110.475 175.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 11.9 mttt -132.43 140.68 48.53 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.566 -1.197 . . . . 74.45 109.892 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LYS . . . . . 0.547 ' HG3' HD13 ' B' ' 117' ' ' LEU . 11.6 mttt -131.86 131.39 42.74 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 123.533 0.733 . . . . 65.98 109.099 -178.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' TRP . . . . . . . . . . . . . 33.7 p90 -153.63 167.79 28.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.498 0.666 . . . . 74.5 109.936 175.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ILE . . . . . . . . . . . . . 19.6 mm -122.38 132.84 70.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 115.579 -0.737 . . . . 74.13 109.557 -171.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -125.64 106.45 9.75 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.787 -1.19 . . . . 74.66 107.787 171.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . 69.48 -105.09 1.42 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.219 -0.991 . . . . 84.81 111.754 179.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . . . -122.5 21.73 10.12 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.14 0.576 . . . . 80.66 111.15 176.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 2.1 mmtt -117.75 142.67 47.0 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.941 -0.392 . . . . 68.36 109.941 179.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.3 tt -106.82 137.31 45.1 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.077 -0.712 . . . . 56.06 109.077 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -120.44 126.83 51.42 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.551 -0.907 . . . . 70.89 108.551 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' LEU . . . . . 0.547 HD13 ' HG3' ' B' ' 108' ' ' LYS . 39.2 tp -130.6 120.24 23.69 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.936 -0.764 . . . . 54.73 108.936 -176.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -112.36 111.07 21.67 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.965 -1.124 . . . . 71.6 107.965 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' LEU . . . . . 0.552 HD23 ' HB3' ' B' ' 106' ' ' TRP . 17.8 mt -94.83 130.45 41.41 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.206 -0.664 . . . . 54.71 109.206 176.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 120' ' ' THR . . . . . 0.489 HG22 HG23 ' B' ' 125' ' ' VAL . 7.3 p -124.73 145.58 49.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.718 0.294 . . . . 57.49 110.5 -169.456 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 121' ' ' CYS . . . . . . . . . . . . . 15.4 t -166.92 120.41 1.01 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.394 -0.821 . . . . 64.99 110.211 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . 56.0 -111.89 2.83 Favored Glycine 0 C--N 1.334 0.47 0 N-CA-C 111.506 -0.638 . . . . 63.73 111.506 -169.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -105.45 -11.71 16.31 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.627 0.603 . . . . 79.55 112.627 173.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -86.19 113.46 22.24 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.874 -0.787 . . . . 63.39 108.874 -175.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' VAL . . . . . 0.489 HG23 HG22 ' B' ' 120' ' ' THR . 9.8 p -108.05 148.46 12.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 108.217 -1.031 . . . . 51.38 108.217 169.249 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 126' ' ' CYS . . . . . . . . . . . . . 5.2 t -125.18 123.65 40.07 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.266 -1.383 . . . . 49.17 107.266 178.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . . . -104.27 126.06 51.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.298 -0.63 . . . . 48.6 109.298 -176.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -127.18 140.59 52.14 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.769 -0.826 . . . . 57.19 108.769 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' VAL . . . . . . . . . . . . . 54.7 t -123.37 136.53 59.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 108.257 -1.016 . . . . 57.32 108.257 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' PHE . . . . . 0.527 ' HB3' ' HB3' ' D' ' 8' ' ' TRP . 49.5 m-85 -123.47 141.52 51.91 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.317 -0.623 . . . . 51.05 109.317 -177.508 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 131' ' ' LYS . . . . . . . . . . . . . . . -104.7 141.0 37.24 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.939 -0.763 . . . . 52.83 108.939 174.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . . . -78.61 133.63 37.27 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.093 -0.643 . . . . 57.51 109.366 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 10.8 tptt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.164 -0.471 . . . . 80.03 110.799 -177.078 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' THR . . . . . 0.619 HG22 ' H ' ' C' ' 2' ' ' ARG . 1.3 m . . . . . 0 CA--C 1.535 0.375 0 N-CA-C 109.605 -0.517 . . . . 78.17 109.605 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 2' ' ' ARG . . . . . 0.619 ' H ' HG22 ' C' ' 1' ' ' THR . . . -84.88 81.03 9.07 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 122.334 1.064 . . . . 81.07 109.7 -171.384 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . . . -163.91 100.15 0.88 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 114.936 -1.029 . . . . 69.42 109.253 169.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -97.35 12.4 33.23 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 113.769 1.026 . . . . 72.7 113.769 -178.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -64.38 137.79 58.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 118.483 0.583 . . . . 72.04 111.233 -175.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.38 -175.6 18.87 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-O 122.169 0.872 . . . . 67.68 112.265 171.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' THR . . . . . 0.468 HG23 HG22 ' C' ' 41' ' ' VAL . 26.8 m -103.57 127.29 51.01 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 114.829 -0.685 . . . . 65.33 109.796 179.51 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' TRP . . . . . 0.49 ' HB3' ' HB3' ' E' ' 130' ' ' PHE . 38.1 m95 -122.86 122.32 38.35 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.374 0.67 . . . . 67.66 109.619 -175.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 9' ' ' GLU . . . . . . . . . . . . . . . -104.06 131.03 51.74 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 122.89 0.476 . . . . 61.16 110.138 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' MET . . . . . . . . . . . . . 47.9 ttm -67.52 144.83 55.45 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.173 0.511 . . . . 55.91 112.063 -175.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -121.46 -21.05 6.39 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 114.488 1.292 . . . . 73.14 114.488 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 17.6 m -146.86 161.8 39.97 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 122.151 0.977 . . . . 61.26 110.624 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -156.54 91.99 1.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 103.886 -2.635 . . . . 64.62 103.886 -176.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -101.44 134.44 44.53 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.177 -0.675 . . . . 77.71 109.177 -175.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 50.12 46.3 24.79 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 122.017 0.913 . . . . 67.83 110.694 -175.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' PHE . . . . . 0.46 ' O ' ' HG3' ' C' ' 20' ' ' MET . 8.3 t80 -74.05 -39.89 63.2 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.433 -0.803 . . . . 69.79 111.039 171.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -71.37 -36.96 71.63 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 119.889 -0.724 . . . . 103.01 111.886 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' GLY . . . . . 0.489 ' C ' ' HG2' ' E' ' 124' ' ' GLN . . . -66.19 -37.54 93.06 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 119.728 -1.225 . . . . 71.95 112.356 174.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -59.05 -44.25 91.77 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 122.449 -0.442 . . . . 69.82 110.986 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' C' ' 16' ' ' PHE . 24.2 mtm -70.41 -31.5 68.73 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.814 -0.354 . . . . 83.19 111.416 177.249 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . . . -60.01 -42.22 93.85 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.797 -0.361 . . . . 72.97 110.776 173.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.83 -28.34 69.95 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.337 -0.545 . . . . 71.68 111.071 174.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' LEU . . . . . . . . . . . . . 28.7 mt -77.5 2.28 16.75 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 112.658 0.614 . . . . 70.27 112.658 175.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 54.06 46.27 25.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.827 0.822 . . . . 82.13 111.745 -177.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' ILE . . . . . 0.443 ' O ' ' HD3' ' C' ' 30' ' ' ARG . 7.4 mt -93.2 162.33 2.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 107.662 -1.236 . . . . 80.7 107.662 173.175 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -90.19 148.46 22.93 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.965 0.906 . . . . 78.7 110.476 -166.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -53.59 -34.67 59.22 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.372 -0.831 . . . . 76.02 111.469 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.1 -58.7 7.48 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.049 0.452 . . . . 81.77 110.988 176.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 1.6 m -71.9 -23.19 61.45 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.705 0.631 . . . . 77.6 112.705 -175.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' ARG . . . . . 0.443 ' HD3' ' O ' ' C' ' 25' ' ' ILE . 2.0 mtm180 -74.84 -41.78 59.21 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 119.747 -0.781 . . . . 79.01 111.775 174.333 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . . . -67.14 -30.83 70.93 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.201 -0.599 . . . . 84.06 111.04 175.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . . . -71.0 -49.37 49.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.508 -0.477 . . . . 82.67 110.647 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.31 -22.91 62.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.414 0.894 . . . . 78.31 113.414 -173.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' VAL . . . . . . . . . . . . . 1.4 p -72.14 -11.78 15.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 113.459 0.911 . . . . 79.95 113.459 -176.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' ARG . . . . . . . . . . . . . . . -104.04 41.41 1.3 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-N 118.35 0.523 . . . . 82.01 112.328 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 11.0 mp -130.34 173.08 11.16 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 121.345 -0.847 . . . . 76.72 109.553 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' THR . . . . . 0.548 HG22 ' O ' ' C' ' 57' ' ' PHE . 2.4 t -143.87 159.42 42.58 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.742 -0.836 . . . . 66.6 108.742 166.605 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -126.56 152.17 46.93 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.134 -0.939 . . . . 68.65 110.238 -169.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 9.0 m -133.76 123.2 24.49 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.141 -1.059 . . . . 70.19 108.141 174.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -109.95 120.37 42.26 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.939 -0.763 . . . . 75.61 108.939 -176.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' VAL . . . . . 0.468 HG22 HG23 ' C' ' 7' ' ' THR . 2.7 t -101.27 114.49 40.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 107.255 -1.387 . . . . 69.72 107.255 172.784 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 42' ' ' ILE . . . . . . . . . . . . . 61.6 mt -106.04 125.99 61.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 N-CA-C 108.074 -1.084 . . . . 74.41 108.074 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.64 117.91 33.6 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.605 -1.257 . . . . 89.92 107.605 171.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -124.27 116.84 23.3 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.711 -0.848 . . . . 72.68 108.711 -171.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -114.95 99.66 7.63 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 106.731 -1.581 . . . . 75.44 106.731 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.25 -108.95 2.42 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.823 -0.703 . . . . 73.94 111.366 -176.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' ASP . . . . . 0.524 ' HB3' HG12 ' E' ' 66' ' ' VAL . 70.7 m-20 -104.65 2.27 30.38 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.979 0.733 . . . . 79.36 112.979 177.8 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 48' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -94.41 131.44 40.07 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 122.939 0.495 . . . . 74.91 110.275 179.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 49' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -121.73 140.0 52.87 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 122.678 0.391 . . . . 66.81 110.268 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 50' ' ' LYS . . . . . . . . . . . . . . . -133.62 110.25 9.76 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 107.516 -1.29 . . . . 67.78 107.516 173.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 51' ' ' THR . . . . . . . . . . . . . . . -108.69 141.38 40.75 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.808 0.443 . . . . 81.58 109.978 -174.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' LYS . . . . . . . . . . . . . . . -133.3 118.23 18.28 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.038 -1.097 . . . . 79.33 108.038 171.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -107.0 104.81 14.58 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.155 -0.683 . . . . 84.47 109.155 -176.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' THR . . . . . . . . . . . . . 1.3 m -92.55 136.89 32.83 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.549 -0.537 . . . . 83.15 109.549 177.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' SER . . . . . . . . . . . . . 1.2 t -122.69 144.09 49.37 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.008 -0.542 . . . . 90.13 111.003 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' THR . . . . . 0.546 ' OG1' ' N ' ' C' ' 57' ' ' PHE . 1.4 p -135.6 -136.64 0.15 Allowed 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.013 -1.106 . . . . 78.9 108.013 -179.607 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 57' ' ' PHE . . . . . 0.548 ' O ' HG22 ' C' ' 37' ' ' THR . 4.4 m-85 -119.24 -167.73 1.45 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.646 0.736 . . . . 79.73 111.511 -175.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 58' ' ' LEU . . . . . . . . . . . . . . . -79.65 -28.09 40.86 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.474 0.916 . . . . 88.21 113.474 -167.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 56.58 79.06 0.19 Allowed 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.16 -0.681 . . . . 81.67 109.16 178.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' TYR . . . . . . . . . . . . . . . -80.67 120.37 24.5 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.679 0.276 . . . . 85.22 110.776 -177.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.53 140.8 41.37 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.749 0.82 . . . . 92.39 109.898 -177.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . . 2.7 t -133.99 122.7 42.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 108.497 -0.927 . . . . 91.03 108.497 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 63' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -119.31 125.45 49.1 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.709 -0.849 . . . . 97.32 108.709 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -156.72 161.98 39.8 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.516 0.674 . . . . 94.4 110.224 -176.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' THR . . . . . . . . . . . . . . . -120.93 135.97 55.07 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.564 -1.273 . . . . 86.08 107.564 165.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' VAL . . . . . 0.481 HG21 HD21 ' C' ' 93' ' ' LEU . 71.2 t -74.79 127.0 36.31 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 N-CA-C 109.502 -0.555 . . . . 97.48 109.502 -172.464 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.46 -21.04 42.45 Favored Glycine 0 N--CA 1.441 -0.989 0 CA-C-O 119.513 -0.604 . . . . 91.88 113.296 -173.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' VAL . . . . . . . . . . . . . 3.2 t -100.11 128.48 52.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 108.125 -1.065 . . . . 94.2 108.125 178.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 69' ' ' GLU . . . . . 0.438 ' HA ' HD12 ' C' ' 85' ' ' LEU . . . -69.49 136.76 51.89 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.289 0.566 . . . . 84.82 112.328 -179.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 70' ' ' PHE . . . . . . . . . . . . . . . -134.19 166.08 23.61 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.885 0.85 . . . . 87.51 109.838 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' ASP . . . . . . . . . . . . . . . -103.64 129.01 50.87 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 114.975 -1.012 . . . . 81.83 109.104 177.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 72' ' ' GLU . . . . . . . . . . . . . . . -118.71 122.0 41.44 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 109.053 -0.721 . . . . 74.9 109.053 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 73' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -104.49 103.46 13.16 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.189 -1.041 . . . . 77.34 108.189 172.925 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 74' ' ' THR . . . . . . . . . . . . . . . -80.79 66.07 6.17 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 122.272 1.034 . . . . 73.12 109.916 -175.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 75' ' ' LYS . . . . . . . . . . . . . . . -66.87 -32.67 74.09 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.236 -0.893 . . . . 80.34 111.173 177.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' SER . . . . . . . . . . . . . 36.1 t -49.66 -33.65 16.21 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 118.962 -0.542 . . . . 84.26 111.774 171.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -121.99 -97.01 0.46 Allowed 'General case' 0 C--N 1.35 0.601 0 C-N-CA 117.416 -1.713 . . . . 89.69 110.535 -172.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 78' ' ' ASP . . . . . 0.476 ' HA ' HD13 ' F' ' 25' ' ' ILE . 7.1 p-10 -87.09 2.1 50.84 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.801 0.84 . . . . 85.61 112.523 -171.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 79' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 48.99 51.97 15.18 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.562 0.745 . . . . 84.3 111.856 -177.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' ARG . . . . . 0.414 ' NH1' ' HD3' ' C' ' 101' ' ' LYS . 75.0 mtt180 -111.23 156.71 21.04 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.685 0.755 . . . . 95.31 111.398 175.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 81' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -100.69 123.51 44.99 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.195 -0.912 . . . . 77.35 109.278 173.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' VAL . . . . . 0.691 HG12 ' HA3' ' C' ' 99' ' ' GLY . 2.6 m -138.17 156.59 30.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 121.579 0.704 . . . . 77.49 109.342 176.255 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 83' ' ' LYS . . . . . . . . . . . . . . . -97.94 117.46 32.33 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.483 -0.781 . . . . 89.38 110.479 175.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' ALA . . . . . . . . . . . . . . . -111.81 155.83 22.94 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.91 1.284 . . . . 90.64 110.443 -173.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 85' ' ' LEU . . . . . 0.438 HD12 ' HA ' ' C' ' 69' ' ' GLU . 12.1 tp -130.21 -54.31 1.11 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 114.134 1.161 . . . . 87.62 114.134 177.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 86' ' ' VAL . . . . . . . . . . . . . . . 67.71 132.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 124.627 1.171 . . . . 94.99 110.095 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' THR . . . . . . . . . . . . . 1.6 m -136.93 159.91 40.48 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.985 0.914 . . . . 97.58 110.604 -176.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' TRP . . . . . . . . . . . . . 26.5 m95 -89.33 119.16 29.55 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.89 -1.05 . . . . 92.14 108.785 171.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 89' ' ' GLU . . . . . 0.427 ' O ' HG22 ' C' ' 92' ' ' VAL . . . -116.52 90.94 3.45 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.386 -2.079 . . . . 83.22 105.386 169.515 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.06 -110.89 3.52 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.7 -1.36 . . . . 82.37 109.7 -174.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 91' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -115.31 25.82 10.55 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 112.415 0.524 . . . . 88.04 112.415 172.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 92' ' ' VAL . . . . . 0.427 HG22 ' O ' ' C' ' 89' ' ' GLU . 2.7 m -116.68 133.07 64.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 109.043 -0.725 . . . . 82.97 109.043 178.657 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 93' ' ' LEU . . . . . 0.481 HD21 HG21 ' C' ' 66' ' ' VAL . 13.2 mt -90.38 110.25 21.34 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.683 -0.858 . . . . 86.16 108.683 176.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 32.9 t -111.44 123.11 66.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 108.854 -0.795 . . . . 95.45 108.854 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 95' ' ' CYS . . . . . 0.502 ' O ' ' HA3' ' C' ' 105' ' ' GLY . 11.3 t -114.28 132.22 56.23 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.381 1.073 . . . . 96.35 109.645 -175.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -110.46 143.97 19.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 122.723 0.409 . . . . 96.17 110.391 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' GLN . . . . . . . . . . . . . . . -110.91 93.52 4.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 107.532 -1.285 . . . . 98.84 107.532 -179.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 98' ' ' LYS . . . . . . . . . . . . . . . -75.35 125.59 29.29 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.833 -1.173 . . . . 91.88 107.833 175.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 99' ' ' GLY . . . . . 0.691 ' HA3' HG12 ' C' ' 82' ' ' VAL . . . 169.71 -147.12 10.6 Favored Glycine 0 CA--C 1.509 -0.342 0 C-N-CA 119.822 -1.18 . . . . 92.01 110.573 -176.523 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 100' ' ' GLU . . . . . . . . . . . . . . . -60.76 -37.59 82.35 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.856 -0.737 . . . . 96.31 110.462 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 101' ' ' LYS . . . . . 0.488 ' HE3' ' HA ' ' C' ' 101' ' ' LYS . 13.7 mmmt -86.22 131.86 34.13 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 121.935 -0.478 . . . . 103.21 111.579 -179.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -94.36 142.75 27.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.759 -0.655 . . . . 108.97 110.129 178.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 103' ' ' ASN . . . . . . . . . . . . . 60.6 t30 56.8 40.54 28.97 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.639 0.733 . . . . 114.09 109.707 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 104' ' ' ARG . . . . . 0.796 ' HA ' ' HA ' ' C' ' 121' ' ' CYS . . . -104.9 131.03 52.91 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.605 0.762 . . . . 112.48 109.822 -173.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 105' ' ' GLY . . . . . 0.502 ' HA3' ' O ' ' C' ' 95' ' ' CYS . . . 177.27 -159.21 25.28 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 119.878 -1.153 . . . . 91.69 112.707 179.606 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 106' ' ' TRP . . . . . 0.458 ' HB3' HD23 ' C' ' 119' ' ' LEU . 30.7 p-90 -152.8 166.59 31.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.814 -1.193 . . . . 90.26 110.386 178.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 107' ' ' LYS . . . . . . . . . . . . . . . -132.2 140.03 48.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.314 -1.312 . . . . 89.0 109.155 177.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 108' ' ' LYS . . . . . . . . . . . . . 9.1 ttmt -131.28 126.98 36.79 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.852 -0.796 . . . . 82.66 108.852 -176.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 109' ' ' TRP . . . . . . . . . . . . . 18.7 p90 -157.88 163.02 38.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.608 0.718 . . . . 92.47 111.364 174.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 110' ' ' ILE . . . . . 0.642 HD13 ' CH2' ' F' ' 8' ' ' TRP . 1.7 mt -142.11 133.29 25.75 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.858 0 C-N-CA 126.714 2.006 . . . . 95.87 113.331 -170.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 111' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -122.75 111.7 17.03 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 126.798 2.039 . . . . 127.24 106.842 169.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.45 -106.42 2.24 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 124.151 0.881 . . . . 94.89 114.966 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 113' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -126.63 16.81 7.53 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 114.269 1.211 . . . . 102.33 114.269 -178.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 114' ' ' LYS . . . . . . . . . . . . . . . -120.54 138.57 53.78 Favored 'General case' 0 C--O 1.212 -0.875 0 CA-C-O 123.239 1.495 . . . . 89.62 111.598 -175.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 115' ' ' LEU . . . . . 0.804 ' HB3' ' HB2' ' C' ' 130' ' ' PHE . 0.8 OUTLIER -102.86 135.45 44.5 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 119.146 -2.221 . . . . 86.28 110.257 -173.201 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 116' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -120.38 122.8 41.56 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.452 -0.944 . . . . 98.08 108.452 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 117' ' ' LEU . . . . . . . . . . . . . 5.5 tt -132.93 118.82 19.36 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.021 -1.474 . . . . 82.9 107.021 -176.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 118' ' ' GLU . . . . . . . . . . . . . . . -113.94 110.51 20.2 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.798 -0.816 . . . . 86.13 108.798 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 119' ' ' LEU . . . . . 0.458 HD23 ' HB3' ' C' ' 106' ' ' TRP . 45.2 mt -96.39 131.05 43.34 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 108.606 -0.887 . . . . 87.12 108.606 173.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 120' ' ' THR . . . . . 0.537 HG23 HG22 ' C' ' 125' ' ' VAL . 23.7 m -129.89 -58.26 1.09 Allowed 'General case' 0 C--O 1.239 0.524 0 C-N-CA 115.202 -2.599 . . . . 103.18 116.624 -171.016 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 121' ' ' CYS . . . . . 0.796 ' HA ' ' HA ' ' C' ' 104' ' ' ARG . 6.8 t 62.62 -113.41 0.45 Allowed 'General case' 0 C--O 1.243 0.74 0 N-CA-C 106.201 -1.777 . . . . 104.58 106.201 -179.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 122' ' ' GLY . . . . . 0.432 ' N ' ' SG ' ' C' ' 121' ' ' CYS . . . -86.68 -102.05 0.79 Allowed Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 119.888 1.222 . . . . 107.35 112.75 -173.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 123' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -92.65 178.86 5.67 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 123.965 0.906 . . . . 114.49 109.02 176.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 124' ' ' GLN . . . . . . . . . . . . . . . 44.32 115.38 0.0 OUTLIER 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.767 1.227 . . . . 98.4 112.587 -177.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 125' ' ' VAL . . . . . 0.537 HG22 HG23 ' C' ' 120' ' ' THR . 9.2 t -95.68 148.2 5.39 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-O 121.24 0.543 . . . . 96.88 109.705 177.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 126' ' ' CYS . . . . . 0.512 ' HG ' ' HD1' ' F' ' 16' ' ' PHE . 2.7 t -122.09 121.05 36.06 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 108.683 -0.858 . . . . 88.72 108.683 178.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 127' ' ' ARG . . . . . . . . . . . . . . . -106.86 127.62 53.57 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.264 1.026 . . . . 85.29 108.566 -178.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 128' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -126.9 140.29 52.44 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.498 -0.927 . . . . 84.97 108.498 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 129' ' ' VAL . . . . . 0.507 ' HA ' ' O ' ' C' ' 115' ' ' LEU . 29.4 m -123.58 137.99 54.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 108.018 -1.104 . . . . 78.3 108.018 178.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 130' ' ' PHE . . . . . 0.804 ' HB2' ' HB3' ' C' ' 115' ' ' LEU . 49.5 m-85 -123.82 145.4 49.09 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.568 0.747 . . . . 79.21 109.896 -174.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 131' ' ' LYS . . . . . 0.429 ' N ' ' O ' ' F' ' 9' ' ' GLU . 1.1 mmtp -103.07 137.37 41.33 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.379 -0.6 . . . . 78.99 109.379 175.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -81.81 133.66 35.35 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.252 -1.018 . . . . 87.46 108.252 175.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 133' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.375 -0.375 . . . . 103.13 111.252 -176.655 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.918 0.389 . . . . 72.63 111.27 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' ARG . . . . . . . . . . . . . 52.2 mtt180 -94.47 12.65 26.53 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 112.694 0.627 . . . . 74.6 112.694 177.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -103.64 103.17 13.06 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.601 -0.518 . . . . 78.47 109.601 -171.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -96.2 11.17 35.36 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.586 0.588 . . . . 63.87 112.586 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' D' ' 44' ' ' GLN . 34.2 m-80 -66.0 139.48 58.22 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.033 0.444 . . . . 77.28 111.637 -175.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.85 -174.98 19.3 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-O 121.909 0.727 . . . . 57.35 112.354 170.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' THR . . . . . . . . . . . . . 92.8 m -102.72 127.81 49.7 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.044 -0.725 . . . . 61.46 109.044 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' TRP . . . . . 0.527 ' HB3' ' HB3' ' B' ' 130' ' ' PHE . 70.7 m95 -120.86 122.43 40.25 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.457 -0.571 . . . . 56.22 109.457 -174.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 9' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -103.06 129.39 49.85 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.917 -0.772 . . . . 59.09 108.917 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' MET . . . . . . . . . . . . . 45.8 ttm -68.15 141.65 55.97 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.368 0.604 . . . . 58.86 111.138 -174.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -123.77 -18.6 6.0 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 113.514 0.931 . . . . 68.77 113.514 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -141.42 157.3 45.35 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.995 0.816 . . . . 67.06 109.742 177.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -161.92 91.75 0.82 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 107.154 -1.425 . . . . 50.72 107.154 -176.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' GLU . . . . . . . . . . . . . . . -104.24 134.8 46.87 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.17 -0.468 . . . . 53.95 110.744 -175.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' ASN . . . . . . . . . . . . . 28.8 t30 49.64 47.51 22.68 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.874 0.87 . . . . 53.0 111.977 -178.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -73.39 -39.49 65.05 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 120.072 -0.651 . . . . 51.45 110.973 171.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -69.61 -38.4 77.26 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 120.48 -0.488 . . . . 68.63 111.202 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.89 -39.54 95.04 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.92 -1.133 . . . . 47.61 112.491 175.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -60.06 -43.74 95.21 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.339 -0.507 . . . . 51.42 111.072 175.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' MET . . . . . . . . . . . . . 60.7 mtm -69.26 -34.91 75.51 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.718 -0.793 . . . . 50.85 111.325 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -60.51 -42.69 96.9 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 122.049 -0.407 . . . . 57.84 111.168 174.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.31 -28.99 70.39 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.312 -0.555 . . . . 51.02 111.725 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' LEU . . . . . . . . . . . . . 24.8 mt -77.9 3.54 14.25 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.479 0.918 . . . . 55.1 113.479 177.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 55.47 51.4 12.9 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.926 0.869 . . . . 59.65 110.75 -177.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' ILE . . . . . . . . . . . . . 3.5 mm -87.68 158.79 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 108.333 -0.988 . . . . 48.41 108.333 176.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -96.53 144.33 26.71 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.551 -0.907 . . . . 53.52 108.551 -171.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -40.92 -45.93 2.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.089 -0.96 . . . . 46.82 113.242 -177.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' ALA . . . . . 0.5 ' O ' HG13 ' D' ' 32' ' ' ILE . . . -57.19 -59.83 4.51 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.782 -0.367 . . . . 40.14 111.456 -179.389 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 29' ' ' THR . . . . . . . . . . . . . 14.8 p -72.02 -18.83 61.93 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.906 -0.718 . . . . 42.8 112.403 -176.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' ARG . . . . . . . . . . . . . 43.7 mtm-85 -70.1 -42.31 72.86 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.867 -0.733 . . . . 42.93 110.403 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 31' ' ' LYS . . . . . 0.499 ' HB3' HG23 ' A' ' 29' ' ' THR . 11.6 mmtm -67.91 -29.45 68.54 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.657 -0.247 . . . . 52.93 111.606 176.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 32' ' ' ILE . . . . . 0.5 HG13 ' O ' ' D' ' 28' ' ' ALA . 63.8 mt -68.92 -51.39 45.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 119.784 -0.767 . . . . 44.42 110.265 176.111 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.59 -24.23 62.72 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.921 0.712 . . . . 43.63 112.921 -173.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 34' ' ' VAL . . . . . . . . . . . . . 1.4 p -73.24 -14.45 16.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 112.762 0.653 . . . . 45.79 112.762 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 35' ' ' ARG . . . . . . . . . . . . . 8.0 mtp85 -105.84 37.73 2.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 118.384 0.538 . . . . 42.27 111.807 176.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 82.1 mt -131.96 171.01 14.1 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 122.368 1.08 . . . . 45.08 111.015 -177.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 37' ' ' THR . . . . . . . . . . . . . 11.1 t -141.04 156.41 46.02 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 113.58 -1.645 . . . . 43.57 107.007 167.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 38' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -127.49 149.82 49.95 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.251 -0.886 . . . . 43.02 110.507 -170.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 39' ' ' THR . . . . . . . . . . . . . 58.1 p -133.45 125.11 28.3 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.156 -1.424 . . . . 51.92 107.156 172.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -108.37 122.78 47.69 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.177 -0.675 . . . . 58.99 109.177 -175.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 41' ' ' VAL . . . . . . . . . . . . . 41.0 t -98.33 112.43 30.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 106.608 -1.627 . . . . 51.05 106.608 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 42' ' ' ILE . . . . . 0.45 HD12 ' CD1' ' D' ' 8' ' ' TRP . 11.4 mt -108.89 125.83 65.9 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 N-CA-C 108.151 -1.055 . . . . 59.5 108.151 -177.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 43' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -113.03 116.11 29.41 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.531 -1.285 . . . . 83.3 107.531 170.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 44' ' ' GLN . . . . . 0.413 ' N ' ' OD1' ' D' ' 5' ' ' ASN . 29.7 tt0 -126.31 117.64 23.43 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.458 -0.571 . . . . 68.51 109.458 -170.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 45' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -115.68 99.91 7.66 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.147 -1.427 . . . . 76.97 107.147 174.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.33 -109.52 2.79 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 111.505 -0.638 . . . . 72.69 111.505 -177.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 47' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -104.14 3.68 33.28 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.691 0.626 . . . . 73.7 112.691 176.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 48' ' ' ASN . . . . . 0.904 ' HA ' HG22 ' B' ' 65' ' ' THR . 10.8 m-80 -91.99 127.95 37.65 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.04 -0.726 . . . . 73.0 109.04 177.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 49' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -122.8 138.92 54.5 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.568 0.347 . . . . 64.4 110.541 -176.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 50' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt -134.55 108.74 8.25 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.5 -1.296 . . . . 70.18 107.5 172.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 51' ' ' THR . . . . . . . . . . . . . 6.2 m -109.49 141.8 41.43 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.733 -0.469 . . . . 54.11 109.733 -175.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 52' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -132.06 117.55 18.5 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 108.593 -0.892 . . . . 68.47 108.593 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -107.46 104.45 14.03 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.326 -0.62 . . . . 45.55 109.326 -175.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 54' ' ' THR . . . . . . . . . . . . . 17.5 p -93.48 137.75 32.46 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.309 -0.626 . . . . 41.53 109.309 176.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 55' ' ' SER . . . . . . . . . . . . . 56.7 p -122.32 139.77 53.43 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.148 -0.478 . . . . 39.67 111.326 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t -143.36 -178.08 5.69 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 107.432 -1.322 . . . . 56.14 107.432 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 57' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -84.93 141.63 30.24 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 120.556 -0.457 . . . . 36.42 111.29 -173.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 pp -83.69 123.68 30.08 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.942 -0.762 . . . . 49.51 108.942 -174.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 59' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -56.94 145.55 29.71 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.567 0.699 . . . . 50.09 111.387 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 60' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -110.26 127.9 55.23 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.491 -0.777 . . . . 59.77 109.471 177.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -108.16 138.34 44.59 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.929 0.492 . . . . 61.04 110.98 -176.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 62' ' ' VAL . . . . . . . . . . . . . . . -137.15 117.81 17.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 106.711 -1.588 . . . . 54.45 106.711 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 63' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -121.41 128.32 52.06 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.011 -0.737 . . . . 63.11 109.011 -179.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 64' ' ' PHE . . . . . . . . . . . . . 55.6 p90 -153.44 163.0 40.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.488 0.661 . . . . 47.89 110.031 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 65' ' ' THR . . . . . . . . . . . . . 32.3 m -121.26 142.8 49.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.953 -1.021 . . . . 50.9 108.996 170.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 t -67.94 123.55 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 CA-C-N 115.294 -0.867 . . . . 44.68 108.883 -175.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.84 -17.22 57.65 Favored Glycine 0 N--CA 1.436 -1.359 0 O-C-N 121.461 -0.775 . . . . 47.21 114.662 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 68' ' ' VAL . . . . . . . . . . . . . 94.3 t -97.31 123.27 49.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 108.326 -0.99 . . . . 47.67 108.326 -178.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 69' ' ' GLU . . . . . . . . . . . . . 55.7 tt0 -73.03 134.41 44.62 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.576 -0.45 . . . . 57.09 109.961 176.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 70' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -135.52 168.7 18.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.494 0.664 . . . . 49.15 109.534 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 71' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -100.31 125.93 46.58 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.866 -0.79 . . . . 58.93 108.866 178.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 72' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -121.52 123.94 43.21 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 109.481 -0.563 . . . . 60.58 109.481 -177.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 73' ' ' TYR . . . . . 0.457 ' CZ ' ' HB2' ' D' ' 81' ' ' HIS . 24.9 m-85 -102.63 106.11 16.71 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.449 -1.315 . . . . 70.67 107.449 171.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 74' ' ' THR . . . . . . . . . . . . . 40.7 p -76.73 70.07 3.17 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 122.43 1.11 . . . . 50.21 110.054 -172.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 75' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -63.67 -28.46 69.92 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.919 -1.037 . . . . 66.91 111.228 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -52.63 -36.18 56.14 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.296 0.48 . . . . 54.27 112.296 173.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 77' ' ' LEU . . . . . . . . . . . . . 48.5 mt -124.09 -102.51 0.38 Allowed 'General case' 0 C--O 1.236 0.384 0 O-C-N 122.108 -0.37 . . . . 46.57 110.563 -166.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 78' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -89.56 1.25 56.21 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.362 0.875 . . . . 48.99 113.362 -171.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 79' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 48.95 52.82 13.59 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.815 0.817 . . . . 69.96 111.45 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 80' ' ' ARG . . . . . . . . . . . . . 33.0 mtt85 -109.12 157.58 18.61 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.676 -0.693 . . . . 52.64 110.145 175.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 81' ' ' HIS . . . . . 0.457 ' HB2' ' CZ ' ' D' ' 73' ' ' TYR . 13.8 t60 -97.27 124.62 41.43 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.498 -0.773 . . . . 63.95 108.965 175.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 82' ' ' VAL . . . . . 0.488 HG21 ' HB3' ' D' ' 97' ' ' GLN . 19.8 m -134.9 153.97 35.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 108.486 -0.931 . . . . 43.77 108.486 176.816 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 83' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -97.35 113.97 25.69 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.746 -1.575 . . . . 55.68 106.746 173.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 84' ' ' ALA . . . . . . . . . . . . . . . -109.6 140.87 42.9 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.048 0.451 . . . . 41.15 110.275 -171.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 85' ' ' LEU . . . . . . . . . . . . . 14.0 tp -137.93 132.62 32.67 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.069 -0.969 . . . . 42.7 109.044 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 t -113.24 138.37 43.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.853 -0.795 . . . . 41.74 108.853 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 87' ' ' THR . . . . . . . . . . . . . 15.9 p -132.43 157.8 43.65 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.701 0.8 . . . . 52.41 109.536 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 88' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -93.06 120.7 33.64 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.162 -0.926 . . . . 50.41 109.453 172.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 89' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -115.2 89.7 3.16 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 105.869 -1.9 . . . . 53.62 105.869 169.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.42 -110.63 3.38 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.522 -0.847 . . . . 50.11 111.179 -174.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 91' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -112.89 27.85 9.28 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.288 0.635 . . . . 69.97 110.835 172.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 92' ' ' VAL . . . . . . . . . . . . . 96.4 t -114.57 130.63 68.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.012 -0.736 . . . . 45.39 109.012 -178.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 93' ' ' LEU . . . . . . . . . . . . . 34.1 mt -90.3 111.89 23.25 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 106.882 -1.525 . . . . 39.13 106.882 173.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -108.6 120.0 59.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 107.988 -1.116 . . . . 48.62 107.988 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 95' ' ' CYS . . . . . . . . . . . . . 36.1 t -117.06 127.98 54.7 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.647 -0.871 . . . . 34.67 108.647 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 96' ' ' VAL . . . . . . . . . . . . . 95.8 t -108.46 132.14 57.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.36 -1.348 . . . . 38.18 107.36 174.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 97' ' ' GLN . . . . . 0.604 ' HB2' ' HG2' ' D' ' 104' ' ' ARG . 46.2 mt-30 -115.54 93.2 4.18 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 106.994 -1.484 . . . . 39.98 106.994 -179.501 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 98' ' ' LYS . . . . . . . . . . . . . 27.4 mttp -74.88 133.7 41.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.259 -0.428 . . . . 57.58 110.065 179.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 99' ' ' GLY . . . . . . . . . . . . . . . 175.43 -151.47 12.05 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.95 -0.568 . . . . 46.86 112.894 -178.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 100' ' ' GLU . . . . . . . . . . . . . . . -65.0 -39.29 93.24 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.684 -0.407 . . . . 53.92 111.824 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 101' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -82.81 137.18 34.42 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.113 0.482 . . . . 53.49 111.637 -176.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -89.12 144.59 26.02 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.726 -0.67 . . . . 72.7 110.287 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 103' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 60.38 41.17 16.52 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.552 -0.749 . . . . 73.4 111.506 177.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 104' ' ' ARG . . . . . 0.604 ' HG2' ' HB2' ' D' ' 97' ' ' GLN . 12.0 ttt180 -104.93 127.79 52.92 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.289 -0.634 . . . . 42.39 109.289 -176.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 105' ' ' GLY . . . . . . . . . . . . . . . 174.62 -161.19 30.83 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 109.929 -1.269 . . . . 41.54 109.929 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 106' ' ' TRP . . . . . 0.426 ' HB3' HD23 ' D' ' 119' ' ' LEU . 38.4 p-90 -157.76 165.59 34.96 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 118.947 -1.101 . . . . 40.1 110.269 174.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 107' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -133.62 137.42 45.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.6 -1.182 . . . . 56.97 109.103 175.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 108' ' ' LYS . . . . . 0.497 ' HD3' HD13 ' D' ' 117' ' ' LEU . 4.3 ttpt -133.1 132.03 41.24 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.244 -0.435 . . . . 55.52 110.017 -176.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 109' ' ' TRP . . . . . . . . . . . . . 22.3 p90 -153.99 168.18 27.29 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.378 -0.601 . . . . 48.31 109.378 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 110' ' ' ILE . . . . . . . . . . . . . 84.3 mt -123.47 131.26 73.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 108.597 -0.89 . . . . 57.86 108.597 -175.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 111' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -126.7 116.94 21.74 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 109.046 -0.724 . . . . 87.91 109.046 172.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 112' ' ' GLY . . . . . . . . . . . . . . . 71.97 -106.87 2.03 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 110.697 -0.961 . . . . 66.15 110.697 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 113' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -123.52 17.82 9.66 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 122.764 -0.257 . . . . 70.56 111.24 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 19.2 mtpt -124.05 145.48 49.2 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.492 0.663 . . . . 62.6 111.335 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 115' ' ' LEU . . . . . . . . . . . . . 8.3 tt -102.69 137.51 40.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.028 -0.987 . . . . 50.18 109.73 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 116' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -119.37 127.91 53.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 123.667 0.787 . . . . 61.48 109.009 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 117' ' ' LEU . . . . . 0.497 HD13 ' HD3' ' D' ' 108' ' ' LYS . 44.6 tp -130.66 120.6 24.17 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.369 -0.975 . . . . 36.99 108.369 -177.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 118' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -111.69 111.01 21.69 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.167 -1.42 . . . . 60.42 107.167 177.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 119' ' ' LEU . . . . . 0.426 HD23 ' HB3' ' D' ' 106' ' ' TRP . 8.8 mt -95.06 129.01 42.32 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.818 -0.808 . . . . 41.41 108.818 175.978 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 120' ' ' THR . . . . . 0.528 HG23 HG22 ' D' ' 125' ' ' VAL . 9.5 m -129.46 146.58 51.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.011 0.434 . . . . 45.49 110.655 -170.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 121' ' ' CYS . . . . . . . . . . . . . 13.8 t -168.33 154.05 6.89 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 107.399 -1.334 . . . . 49.93 107.399 169.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 122' ' ' GLY . . . . . . . . . . . . . . . 33.27 -111.17 0.06 OUTLIER Glycine 0 C--N 1.335 0.481 0 CA-C-N 115.812 -0.631 . . . . 54.35 112.788 -164.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 123' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' D' ' 123' ' ' ASP . 9.9 p-10 -105.64 -10.81 16.61 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.455 0.909 . . . . 65.71 113.455 174.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 124' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -86.39 118.18 25.66 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.043 0.537 . . . . 50.14 110.618 -175.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 125' ' ' VAL . . . . . 0.528 HG22 HG23 ' D' ' 120' ' ' THR . 12.3 t -104.33 146.49 11.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 C-N-CA 124.28 1.032 . . . . 41.68 108.908 170.188 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 126' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -127.23 123.19 35.96 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 107.673 -1.232 . . . . 42.78 107.673 178.404 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 127' ' ' ARG . . . . . . . . . . . . . . . -106.05 124.89 50.29 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.169 -0.678 . . . . 40.29 109.169 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 128' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -129.69 140.09 51.2 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.211 -0.662 . . . . 41.71 109.211 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 129' ' ' VAL . . . . . 0.47 HG12 ' HB2' ' A' ' 12' ' ' SER . 2.4 p -126.75 138.54 54.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.375 -0.972 . . . . 44.93 108.375 176.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 130' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -121.42 145.6 47.76 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.455 1.102 . . . . 45.31 109.248 -176.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 131' ' ' LYS . . . . . 0.655 ' HD2' ' OE2' ' A' ' 11' ' ' GLU . 44.4 tttp -101.82 142.02 33.78 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.772 -0.649 . . . . 68.84 109.538 174.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 132' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -78.28 135.13 37.48 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.909 -0.587 . . . . 58.62 109.736 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 133' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.827 -0.624 . . . . 71.84 111.05 -177.308 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 1' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 CA--C 1.536 0.43 0 CA-C-O 121.924 0.868 . . . . 109.92 110.396 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 2' ' ' ARG . . . . . . . . . . . . . 13.2 ttt-85 -106.85 -7.18 17.23 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.943 -1.48 . . . . 99.67 113.373 -175.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 3' ' ' ASP . . . . . . . . . . . . . . . -99.87 104.3 15.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.566 0.621 . . . . 93.84 109.757 -169.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -95.89 12.33 30.64 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.008 0.744 . . . . 94.21 113.008 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 -63.02 137.35 58.24 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.22 0.533 . . . . 102.43 112.374 -172.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 6' ' ' GLY . . . . . . . . . . . . . . . 127.15 -177.41 17.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-O 122.181 0.878 . . . . 92.85 112.396 169.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 7' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' E' ' 40' ' ' ASP . 3.7 p -103.81 129.18 51.23 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.888 -0.656 . . . . 101.87 109.344 179.12 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 8' ' ' TRP . . . . . 0.504 ' O ' ' HA ' ' E' ' 39' ' ' THR . 30.2 m95 -119.38 124.84 47.57 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 123.763 0.825 . . . . 102.95 109.295 -173.69 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 9' ' ' GLU . . . . . 0.518 ' O ' ' N ' ' F' ' 131' ' ' LYS . . . -101.27 131.26 47.38 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.367 0.667 . . . . 84.29 109.748 -178.72 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 10' ' ' MET . . . . . 0.504 ' HA ' ' HA ' ' F' ' 130' ' ' PHE . 11.0 ttp -66.41 145.95 55.11 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.854 0.835 . . . . 89.09 112.761 -172.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 11' ' ' GLU . . . . . . . . . . . . . . . -122.66 -19.52 6.25 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 114.092 1.145 . . . . 90.0 114.092 174.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 12' ' ' SER . . . . . . . . . . . . . 4.5 t -144.19 159.03 43.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 119.134 0.879 . . . . 82.51 110.919 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 13' ' ' ASN . . . . . 0.596 ' OD1' ' HB2' ' E' ' 16' ' ' PHE . 38.1 t-20 -160.98 90.36 0.83 Allowed 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 107.522 -1.288 . . . . 83.53 107.522 179.215 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 14' ' ' GLU . . . . . . . . . . . . . . . -105.64 135.05 47.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.904 -0.589 . . . . 74.84 110.082 -177.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 15' ' ' ASN . . . . . . . . . . . . . . . 50.96 48.33 23.24 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.727 0.775 . . . . 83.5 112.434 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 16' ' ' PHE . . . . . 0.596 ' HB2' ' OD1' ' E' ' 13' ' ' ASN . 3.3 t80 -71.59 -37.22 71.01 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.913 -0.715 . . . . 79.57 110.344 169.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 17' ' ' GLU . . . . . . . . . . . . . . . -68.94 -37.67 79.0 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 116.48 -0.327 . . . . 92.96 111.424 -176.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.88 -39.51 95.04 Favored Glycine 0 C--N 1.335 0.487 0 C-N-CA 119.512 -1.328 . . . . 89.06 112.353 174.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 19' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -58.6 -46.56 86.74 Favored 'General case' 0 C--O 1.245 0.861 0 O-C-N 122.125 -0.633 . . . . 90.96 110.469 174.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 20' ' ' MET . . . . . . . . . . . . . 63.5 mtm -68.34 -35.67 78.11 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.456 -0.497 . . . . 88.43 111.438 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 21' ' ' LYS . . . . . . . . . . . . . . . -61.7 -43.88 98.01 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 122.156 -0.34 . . . . 91.8 111.216 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.09 -30.58 71.63 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.618 -0.833 . . . . 95.52 111.39 175.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 23' ' ' LEU . . . . . . . . . . . . . 2.8 mt -79.83 4.03 17.79 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.96 1.096 . . . . 92.69 113.96 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 24' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 56.34 50.27 13.55 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.901 0.773 . . . . 98.13 111.738 -177.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 25' ' ' ILE . . . . . . . . . . . . . 35.6 mt -92.24 161.37 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 122.001 0.905 . . . . 92.7 109.815 175.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 26' ' ' ASP . . . . . . . . . . . . . 16.4 p30 -76.32 170.75 15.75 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 125.603 1.561 . . . . 96.82 111.037 -169.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 27' ' ' PHE . . . . . . . . . . . . . . . -73.86 -38.63 64.41 Favored 'General case' 0 C--O 1.243 0.745 0 CA-C-N 115.519 -0.764 . . . . 89.89 110.632 174.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.75 -59.25 5.5 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 111.597 0.221 . . . . 91.86 111.597 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 29' ' ' THR . . . . . 0.722 ' HA ' HD12 ' E' ' 32' ' ' ILE . 6.6 m -73.56 -16.38 61.26 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 118.801 -1.16 . . . . 88.59 112.569 -177.828 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 30' ' ' ARG . . . . . . . . . . . . . . . -70.01 -45.6 66.9 Favored 'General case' 0 C--O 1.248 0.987 0 C-N-CA 118.446 -1.302 . . . . 85.4 110.68 171.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 31' ' ' LYS . . . . . . . . . . . . . . . -65.63 -29.79 70.41 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.875 -0.602 . . . . 86.87 110.731 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 32' ' ' ILE . . . . . 0.722 HD12 ' HA ' ' E' ' 29' ' ' THR . 31.9 mt -73.64 -48.94 38.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.604 0.716 . . . . 92.07 109.114 178.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 33' ' ' ALA . . . . . 0.442 ' HA ' ' CD1' ' E' ' 36' ' ' LEU . . . -70.8 -25.87 63.06 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.209 1.404 . . . . 87.86 114.551 -169.152 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 34' ' ' VAL . . . . . . . . . . . . . 10.1 m -74.89 -9.44 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 114.545 -2.862 . . . . 86.52 113.979 -178.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 35' ' ' ARG . . . . . . . . . . . . . . . -107.79 39.34 1.95 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.502 1.668 . . . . 95.26 115.502 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 36' ' ' LEU . . . . . 0.442 ' CD1' ' HA ' ' E' ' 33' ' ' ALA . 3.0 mp -134.61 176.33 8.73 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 120.515 -1.366 . . . . 92.94 110.727 -179.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 37' ' ' THR . . . . . . . . . . . . . 4.5 p -138.87 161.3 37.62 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 114.615 -1.175 . . . . 83.15 107.914 168.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 38' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -127.52 152.33 47.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.278 0.561 . . . . 88.11 110.413 -172.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 39' ' ' THR . . . . . 0.504 ' HA ' ' O ' ' E' ' 8' ' ' TRP . 43.4 m -131.38 123.92 29.23 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.268 -1.012 . . . . 84.69 108.268 175.747 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 40' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' E' ' 7' ' ' THR . 39.7 m-20 -111.42 126.37 54.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.173 -0.467 . . . . 92.26 111.159 -173.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 41' ' ' VAL . . . . . 0.654 ' HB ' ' HB2' ' E' ' 52' ' ' LYS . 21.7 t -94.77 115.04 32.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 124.907 1.283 . . . . 87.13 108.588 176.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 42' ' ' ILE . . . . . . . . . . . . . 2.1 mm -108.6 122.46 63.18 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 108.635 -0.876 . . . . 88.34 108.635 -177.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 43' ' ' ASP . . . . . . . . . . . . . . . -116.96 113.79 22.89 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 106.652 -1.611 . . . . 82.57 106.652 167.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 44' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -129.3 117.74 21.15 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.769 -0.456 . . . . 86.43 109.769 -173.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 45' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -116.74 103.03 9.93 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.62 -1.252 . . . . 86.08 107.62 173.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 46' ' ' GLY . . . . . . . . . . . . . . . 65.74 -111.49 4.21 Favored Glycine 0 C--N 1.331 0.28 0 N-CA-C 114.457 0.543 . . . . 89.33 114.457 -176.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 47' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -104.33 1.81 30.72 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 117.528 0.664 . . . . 82.03 112.694 177.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 48' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -93.55 130.31 39.46 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.882 -0.785 . . . . 80.81 108.882 177.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 49' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -120.52 139.13 53.36 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.413 -0.588 . . . . 77.06 109.413 -175.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -134.38 110.12 9.24 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.261 -1.014 . . . . 86.16 108.261 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 51' ' ' THR . . . . . 0.497 ' O ' ' HD3' ' E' ' 52' ' ' LYS . 6.3 p -108.26 147.07 31.94 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.416 1.086 . . . . 79.4 112.395 -171.042 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 52' ' ' LYS . . . . . 0.654 ' HB2' ' HB ' ' E' ' 41' ' ' VAL . 1.7 mppt? -130.21 115.87 17.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.055 -0.975 . . . . 85.76 108.935 172.04 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 53' ' ' ALA . . . . . . . . . . . . . . . -108.57 100.81 10.03 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.009 -0.737 . . . . 89.51 109.009 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 54' ' ' THR . . . . . . . . . . . . . 22.8 m -93.22 144.31 25.42 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.36 0.664 . . . . 99.72 109.269 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 55' ' ' SER . . . . . . . . . . . . . 6.4 t -111.96 140.56 46.52 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.337 -0.616 . . . . 88.39 109.337 -178.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -140.37 148.94 42.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.957 0.903 . . . . 90.29 109.734 -172.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 57' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -81.44 162.07 23.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 107.853 -1.165 . . . . 84.39 107.853 176.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 58' ' ' LEU . . . . . . . . . . . . . . . -80.35 167.84 19.74 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 116.797 -1.961 . . . . 100.81 110.569 -170.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 59' ' ' ASN . . . . . . . . . . . . . . . -105.73 115.72 30.72 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.764 -1.198 . . . . 98.5 107.764 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 60' ' ' TYR . . . . . . . . . . . . . . . -54.85 -59.23 5.02 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 123.458 0.474 . . . . 93.23 110.812 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 61' ' ' ASP . . . . . . . . . . . . . 7.5 t0 59.6 128.15 0.01 OUTLIER 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.589 1.556 . . . . 86.15 111.608 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 62' ' ' VAL . . . . . . . . . . . . . 41.0 t -141.58 121.98 12.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 107.765 -1.198 . . . . 77.64 107.765 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 63' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -119.63 125.95 49.98 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.597 -0.89 . . . . 75.24 108.597 177.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 64' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -155.05 162.06 41.15 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.499 0.666 . . . . 62.46 109.564 -176.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 65' ' ' THR . . . . . 0.464 ' O ' HG22 ' E' ' 68' ' ' VAL . 4.6 m -121.07 140.46 51.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.067 -0.97 . . . . 69.77 108.517 169.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 66' ' ' VAL . . . . . 0.524 HG12 ' HB3' ' C' ' 47' ' ' ASP . 13.8 p -71.96 127.36 33.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 C-N-CA 119.964 -0.694 . . . . 66.14 109.188 -174.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.75 -21.03 41.93 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-O 119.264 -0.742 . . . . 75.61 114.449 -175.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 68' ' ' VAL . . . . . 0.464 HG22 ' O ' ' E' ' 65' ' ' THR . 2.8 m -99.85 126.89 53.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 118.187 0.994 . . . . 70.6 108.597 179.11 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 69' ' ' GLU . . . . . . . . . . . . . . . -71.9 137.19 47.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.95 -0.568 . . . . 75.68 109.975 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 70' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -131.92 167.28 19.89 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 122.045 0.926 . . . . 76.04 109.785 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.79 125.34 45.7 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 114.449 -1.251 . . . . 81.15 109.281 -179.114 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 72' ' ' GLU . . . . . 0.453 ' OE2' ' NE2' ' E' ' 97' ' ' GLN . 33.6 tt0 -122.21 122.92 40.28 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 110.029 -0.36 . . . . 74.49 110.029 -177.597 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 73' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -103.15 104.94 15.14 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 107.47 -1.308 . . . . 78.05 107.47 170.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 74' ' ' THR . . . . . . . . . . . . . 16.3 p -77.28 68.68 3.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 122.666 1.222 . . . . 79.11 108.781 -174.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 75' ' ' LYS . . . . . . . . . . . . . . . -65.47 -27.22 68.35 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 114.554 -1.203 . . . . 87.44 112.043 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 76' ' ' SER . . . . . . . . . . . . . 73.1 m -56.89 -34.86 68.3 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 112.303 0.483 . . . . 86.57 112.303 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 77' ' ' LEU . . . . . . . . . . . . . 37.0 mt -122.24 -100.9 0.41 Allowed 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.967 -0.458 . . . . 87.13 109.905 -165.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 78' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -90.37 0.04 57.44 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.679 1.192 . . . . 86.73 113.953 -170.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 79' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 45.66 54.93 7.23 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 124.113 0.965 . . . . 93.71 111.33 -176.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 80' ' ' ARG . . . . . 0.57 HH12 ' HE2' ' E' ' 101' ' ' LYS . 85.1 mtt180 -107.91 155.52 20.2 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.049 -1.093 . . . . 76.72 108.049 171.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 81' ' ' HIS . . . . . . . . . . . . . 13.1 t-160 -96.49 126.32 41.59 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 107.897 -1.149 . . . . 73.57 107.897 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 82' ' ' VAL . . . . . . . . . . . . . 22.1 m -133.43 151.95 34.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.764 0.792 . . . . 70.33 108.997 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 83' ' ' LYS . . . . . . . . . . . . . . . -98.43 112.07 24.21 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.001 -1.852 . . . . 67.66 106.001 171.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 84' ' ' ALA . . . . . . . . . . . . . . . -113.04 140.19 48.04 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.135 -0.321 . . . . 61.79 110.135 -173.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 85' ' ' LEU . . . . . . . . . . . . . 4.3 tt -139.46 139.53 37.05 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.958 -0.756 . . . . 66.35 108.958 173.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 86' ' ' VAL . . . . . . . . . . . . . 4.1 m -114.86 139.95 38.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 N-CA-C 109.094 -0.706 . . . . 65.21 109.094 -178.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 87' ' ' THR . . . . . . . . . . . . . 8.5 p -133.44 160.99 35.76 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.902 0.858 . . . . 59.09 109.634 176.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 88' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -87.86 122.25 31.27 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.439 -1.255 . . . . 63.2 109.593 176.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -113.66 88.03 2.75 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.959 -1.867 . . . . 58.22 105.959 172.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 90' ' ' GLY . . . . . . . . . . . . . . . 69.55 -110.99 3.61 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.205 -1.158 . . . . 62.76 110.205 -173.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 91' ' ' ASP . . . . . 0.427 ' N ' ' OD1' ' E' ' 91' ' ' ASP . 10.0 p-10 -114.39 27.27 9.59 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.21 0.604 . . . . 66.84 111.328 171.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 92' ' ' VAL . . . . . . . . . . . . . 41.5 t -115.88 132.91 63.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 108.804 -0.813 . . . . 57.35 108.804 -179.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 93' ' ' LEU . . . . . . . . . . . . . 5.2 tp -88.72 111.32 21.83 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.138 -1.06 . . . . 59.08 108.138 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -110.16 122.76 65.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 108.545 -0.909 . . . . 56.77 108.545 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 95' ' ' CYS . . . . . . . . . . . . . 48.2 t -116.3 129.74 56.42 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.271 0.628 . . . . 56.62 109.566 -177.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 96' ' ' VAL . . . . . . . . . . . . . 9.9 t -108.54 131.99 57.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 N-CA-C 107.863 -1.162 . . . . 60.57 107.863 174.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 97' ' ' GLN . . . . . 0.981 ' HB2' ' HG2' ' E' ' 104' ' ' ARG . 43.5 mt-30 -117.05 92.72 3.93 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.228 -1.026 . . . . 65.58 108.228 179.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 98' ' ' LYS . . . . . . . . . . . . . . . -76.59 134.42 39.37 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.525 -0.307 . . . . 68.26 110.329 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.05 -150.87 11.02 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 121.394 -0.431 . . . . 71.46 113.637 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 100' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -63.46 -39.02 93.36 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.44 -0.504 . . . . 83.25 111.281 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 101' ' ' LYS . . . . . 0.57 ' HE2' HH12 ' E' ' 80' ' ' ARG . 20.2 mmtt -83.37 136.05 34.48 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 122.063 -0.398 . . . . 76.97 110.196 179.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 102' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -89.04 148.55 23.67 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.426 1.09 . . . . 90.5 108.819 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 103' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 60.19 42.98 14.57 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.228 1.196 . . . . 90.86 114.228 -176.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 104' ' ' ARG . . . . . 0.981 ' HG2' ' HB2' ' E' ' 97' ' ' GLN . 16.2 ttt180 -104.33 128.0 52.07 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 118.292 -1.363 . . . . 75.02 112.752 -176.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 105' ' ' GLY . . . . . . . . . . . . . . . 175.71 -164.01 34.0 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 119.545 -1.312 . . . . 57.14 112.352 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 106' ' ' TRP . . . . . 0.488 ' HB3' HD23 ' E' ' 119' ' ' LEU . 43.6 p-90 -158.62 166.84 31.12 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.838 0.828 . . . . 55.23 110.086 176.013 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 107' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -133.53 140.64 47.33 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 114.646 -1.161 . . . . 59.09 109.813 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 108' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -130.91 130.66 43.79 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.818 0.847 . . . . 55.57 109.517 -175.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 109' ' ' TRP . . . . . . . . . . . . . 30.2 p90 -155.58 168.19 27.95 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.445 -0.946 . . . . 61.09 108.445 174.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 110' ' ' ILE . . . . . . . . . . . . . 7.2 mt -122.78 132.6 70.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 N-CA-C 107.453 -1.314 . . . . 65.37 107.453 -175.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 111' ' ' GLU . . . . . . . . . . . . . . . -123.34 105.76 10.11 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 107.248 -1.39 . . . . 73.17 107.248 174.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.69 -106.37 1.94 Allowed Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 116.01 -0.541 . . . . 71.2 112.352 -177.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 113' ' ' ASP . . . . . . . . . . . . . . . -122.73 19.69 10.24 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 122.566 -0.373 . . . . 70.41 111.724 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 114' ' ' LYS . . . . . 0.689 ' HE3' ' HE3' ' E' ' 131' ' ' LYS . 13.7 mttp -121.35 146.48 46.81 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.527 0.731 . . . . 66.03 109.757 178.164 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 115' ' ' LEU . . . . . . . . . . . . . 5.0 tt -104.23 137.33 42.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.559 -0.746 . . . . 59.58 109.707 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 116' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -119.6 127.79 53.28 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 109.222 -0.659 . . . . 72.16 109.222 -178.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 117' ' ' LEU . . . . . . . . . . . . . 3.5 tt -130.46 119.29 22.42 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.925 -1.139 . . . . 53.7 107.925 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 118' ' ' GLU . . . . . . . . . . . . . . . -112.08 112.27 23.77 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.019 -1.104 . . . . 59.65 108.019 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 119' ' ' LEU . . . . . 0.488 HD23 ' HB3' ' E' ' 106' ' ' TRP . 14.8 mt -93.8 132.43 38.2 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 122.807 0.443 . . . . 56.5 109.854 176.475 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 120' ' ' THR . . . . . . . . . . . . . 18.1 m -127.0 144.45 51.02 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.568 -0.901 . . . . 63.15 108.568 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 121' ' ' CYS . . . . . . . . . . . . . 1.9 t -163.79 114.83 1.35 Allowed 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.702 -0.851 . . . . 74.55 108.702 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 122' ' ' GLY . . . . . . . . . . . . . . . 56.52 -109.29 1.5 Allowed Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 111.602 -0.599 . . . . 82.27 111.602 -170.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 123' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -103.43 -13.45 16.63 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.519 0.933 . . . . 83.6 113.519 176.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 124' ' ' GLN . . . . . 0.489 ' HG2' ' C ' ' C' ' 18' ' ' GLY . 1.9 tp-100 -87.86 118.82 27.65 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 118.469 0.577 . . . . 85.3 111.445 -174.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 125' ' ' VAL . . . . . . . . . . . . . 37.0 t -104.7 144.98 13.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 123.756 0.822 . . . . 58.43 109.745 170.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 126' ' ' CYS . . . . . . . . . . . . . 1.9 t -129.52 124.43 33.9 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.98 -1.118 . . . . 56.68 107.98 176.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 127' ' ' ARG . . . . . . . . . . . . . 63.9 mtp85 -105.6 126.64 52.38 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 110.095 -0.335 . . . . 73.02 110.095 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 128' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -128.94 140.57 51.6 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.031 0.532 . . . . 53.64 109.784 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 129' ' ' VAL . . . . . . . . . . . . . 3.6 t -126.79 139.83 50.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 109.433 -0.581 . . . . 50.62 109.433 178.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 130' ' ' PHE . . . . . 0.49 ' HB3' ' HB3' ' C' ' 8' ' ' TRP . 29.3 m-85 -123.08 146.29 47.82 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.188 0.995 . . . . 59.37 110.323 -175.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 131' ' ' LYS . . . . . 0.689 ' HE3' ' HE3' ' E' ' 114' ' ' LYS . 1.5 tttt -103.84 138.67 40.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.286 -0.415 . . . . 73.7 110.817 173.665 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 132' ' ' LYS . . . . . 0.406 ' HD3' ' CH2' ' C' ' 8' ' ' TRP . 8.4 tptm -75.41 149.23 38.64 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 128.443 2.697 . . . . 81.92 107.658 177.718 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 133' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt . . . . . 0 C--N 1.321 -0.637 0 C-N-CA 118.948 -1.101 . . . . 77.3 110.067 176.955 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.338 0 N-CA-C 110.223 -0.288 . . . . 94.93 110.223 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 4' ' ' PHE . . . . . 0.538 ' N ' ' OE1' ' F' ' 44' ' ' GLN . 11.1 m-85 -80.53 17.07 1.17 Allowed 'General case' 0 C--O 1.24 0.575 0 N-CA-C 112.606 0.595 . . . . 94.86 112.606 -175.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 5' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -57.86 138.47 55.66 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 120.371 -0.532 . . . . 104.61 111.798 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.33 -174.02 19.39 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 118.556 -1.783 . . . . 91.92 112.054 168.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 7' ' ' THR . . . . . . . . . . . . . 1.6 p -102.77 127.0 50.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.68 -0.76 . . . . 86.63 109.426 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 8' ' ' TRP . . . . . 0.642 ' CH2' HD13 ' C' ' 110' ' ' ILE . 43.4 m95 -121.41 122.45 39.81 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.919 -0.771 . . . . 83.79 108.919 -176.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 9' ' ' GLU . . . . . 0.429 ' O ' ' N ' ' C' ' 131' ' ' LYS . . . -102.83 130.57 49.88 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 122.875 0.47 . . . . 77.44 109.825 -179.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 10' ' ' MET . . . . . . . . . . . . . 11.6 ttp -65.62 145.08 56.5 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.46 0.648 . . . . 82.93 110.856 -175.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 11' ' ' GLU . . . . . . . . . . . . . . . -122.77 -26.34 4.49 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 114.637 1.347 . . . . 81.5 114.637 175.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -149.24 162.95 39.01 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.216 0.916 . . . . 83.64 109.287 175.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 13' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -155.73 92.44 1.38 Allowed 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 106.792 -1.559 . . . . 85.94 106.792 -173.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 14' ' ' GLU . . . . . . . . . . . . . . . -102.48 133.13 47.95 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.798 -0.637 . . . . 88.29 110.08 -174.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 15' ' ' ASN . . . . . . . . . . . . . 37.2 t30 48.28 47.12 19.9 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 123.82 0.848 . . . . 87.78 111.315 -176.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 16' ' ' PHE . . . . . 0.512 ' HD1' ' HG ' ' C' ' 126' ' ' CYS . 5.4 t80 -72.34 -39.31 68.24 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.793 -0.763 . . . . 93.37 110.671 171.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 17' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -74.04 -31.37 62.86 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 120.011 -0.675 . . . . 108.93 111.75 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.36 -40.25 97.66 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 118.976 -1.583 . . . . 93.14 112.196 170.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 19' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -61.16 -42.51 98.69 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 122.057 -0.672 . . . . 93.57 111.356 174.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 20' ' ' MET . . . . . 0.731 ' HA ' HD12 ' F' ' 23' ' ' LEU . 56.0 mtm -67.97 -36.19 79.65 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.129 -0.629 . . . . 94.61 111.577 -179.326 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 21' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -62.17 -42.01 98.85 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.439 -0.504 . . . . 94.06 110.703 172.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.52 -25.37 67.99 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.159 0.429 . . . . 100.29 112.159 174.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 23' ' ' LEU . . . . . 0.731 HD12 ' HA ' ' F' ' 20' ' ' MET . 47.7 mt -72.94 1.04 9.56 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 112.542 0.571 . . . . 102.85 112.542 178.031 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 24' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 52.5 44.01 30.44 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.639 0.775 . . . . 118.88 111.502 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 25' ' ' ILE . . . . . 0.476 HD13 ' HA ' ' C' ' 78' ' ' ASP . 6.9 tp -93.5 155.77 3.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 105.869 -1.901 . . . . 112.31 105.869 170.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 26' ' ' ASP . . . . . . . . . . . . . . . -153.04 105.7 2.95 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 119.497 -0.881 . . . . 115.98 109.538 -168.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 27' ' ' PHE . . . . . . . . . . . . . . . -178.0 149.08 0.55 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 106.881 -1.526 . . . . 108.95 106.881 179.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.42 -52.86 63.08 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.875 0.845 . . . . 109.21 109.646 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 29' ' ' THR . . . . . . . . . . . . . 1.4 p -69.17 -19.93 64.01 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 125.236 1.415 . . . . 108.4 112.377 -174.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 30' ' ' ARG . . . . . . . . . . . . . . . -68.56 -43.34 76.82 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 124.11 0.881 . . . . 97.21 112.417 -173.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 31' ' ' LYS . . . . . . . . . . . . . . . -71.96 -40.55 68.58 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 117.706 -1.597 . . . . 97.74 110.933 176.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 32' ' ' ILE . . . . . 0.577 ' O ' ' N ' ' F' ' 34' ' ' VAL . . . -77.1 -160.81 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.258 0 C-N-CA 123.773 0.829 . . . . 89.91 110.105 174.908 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 33' ' ' ALA . . . . . . . . . . . . . . . 44.59 -29.33 0.0 OUTLIER 'General case' 0 C--O 1.237 0.411 0 N-CA-C 116.357 1.984 . . . . 76.76 116.357 -175.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 34' ' ' VAL . . . . . 0.577 ' N ' ' O ' ' F' ' 32' ' ' ILE . 2.5 t -74.03 -12.41 15.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 119.538 -0.865 . . . . 82.39 110.77 -179.702 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 35' ' ' ARG . . . . . . . . . . . . . . . -63.75 73.75 0.03 OUTLIER 'General case' 0 C--O 1.237 0.401 0 N-CA-C 108.278 -1.008 . . . . 78.59 108.278 174.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 36' ' ' LEU . . . . . 0.471 ' N ' ' O ' ' F' ' 34' ' ' VAL . . . -131.2 -162.59 1.23 Allowed 'General case' 0 C--O 1.237 0.445 0 N-CA-C 106.976 -1.49 . . . . 78.11 106.976 -176.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 37' ' ' THR . . . . . . . . . . . . . 1.1 t -136.12 156.75 48.25 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 121.57 -0.706 . . . . 84.06 110.102 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 38' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -128.14 150.27 50.06 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.089 -0.96 . . . . 82.08 110.275 -170.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 39' ' ' THR . . . . . . . . . . . . . 27.7 p -134.22 127.14 31.3 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 124.986 1.314 . . . . 84.24 108.56 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 40' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.29 124.56 50.52 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 122.632 0.373 . . . . 91.68 110.502 -174.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 t -98.02 111.85 28.72 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 107.005 -1.48 . . . . 84.84 107.005 173.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 42' ' ' ILE . . . . . . . . . . . . . 4.2 mt -110.44 128.2 66.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 123.523 0.729 . . . . 88.0 109.883 -176.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 43' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -111.61 119.12 37.63 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.221 -1.4 . . . . 110.9 107.221 166.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 44' ' ' GLN . . . . . 0.538 ' OE1' ' N ' ' F' ' 4' ' ' PHE . 35.3 tt0 -127.61 116.3 20.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.497 -0.557 . . . . 94.87 109.497 -177.499 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 45' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -116.46 99.66 7.33 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 106.638 -1.615 . . . . 100.89 106.638 174.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 46' ' ' GLY . . . . . . . . . . . . . . . 62.8 -109.31 2.59 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.396 -0.907 . . . . 94.41 111.049 -176.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 47' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -105.05 2.24 29.32 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 113.329 0.863 . . . . 110.68 113.329 177.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 48' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -94.34 127.77 40.43 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 118.85 0.75 . . . . 92.7 109.857 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 49' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -125.21 141.16 52.26 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.508 -0.314 . . . . 98.07 111.139 -175.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 3.8 mtmm -134.15 109.68 9.07 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 108.192 -1.04 . . . . 88.38 108.192 172.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 51' ' ' THR . . . . . . . . . . . . . 6.8 p -110.63 145.57 37.67 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 123.873 0.869 . . . . 80.6 111.16 -173.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 52' ' ' LYS . . . . . . . . . . . . . . . -130.91 119.67 22.49 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.371 -0.831 . . . . 78.75 108.904 173.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 53' ' ' ALA . . . . . . . . . . . . . . . -106.25 104.78 14.56 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 122.85 0.46 . . . . 78.68 110.024 -175.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 54' ' ' THR . . . . . . . . . . . . . 35.1 m -94.24 144.0 25.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.294 1.038 . . . . 82.33 110.623 177.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 55' ' ' SER . . . . . . . . . . . . . 2.7 m -117.74 142.38 47.33 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.846 -1.168 . . . . 83.91 107.846 175.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 56' ' ' THR . . . . . . . . . . . . . 2.0 p -135.93 9.64 3.31 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 116.181 1.919 . . . . 89.27 116.181 -168.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 57' ' ' PHE . . . . . . . . . . . . . 1.2 m-30 63.51 134.0 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.461 1.028 . . . . 85.72 112.603 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 58' ' ' LEU . . . . . . . . . . . . . 1.9 mt -82.67 114.18 20.86 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 122.857 0.463 . . . . 78.95 111.733 -168.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 59' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 -57.53 116.15 3.19 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 123.489 0.716 . . . . 94.43 111.334 172.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 60' ' ' TYR . . . . . . . . . . . . . . . -84.15 116.55 22.97 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.712 -0.847 . . . . 82.19 108.712 174.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 61' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -107.81 134.89 50.11 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 120.664 0.268 . . . . 85.4 110.774 -175.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 62' ' ' VAL . . . . . . . . . . . . . 2.1 p -139.06 119.1 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 N-CA-C 107.38 -1.341 . . . . 79.68 107.38 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 63' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -122.86 130.53 52.98 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.115 0.566 . . . . 82.11 109.568 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 64' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -150.82 163.17 39.27 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.524 0.678 . . . . 68.64 110.371 -173.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 65' ' ' THR . . . . . . . . . . . . . 1.4 p -120.14 140.28 51.33 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.084 -0.962 . . . . 69.53 108.483 168.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 66' ' ' VAL . . . . . . . . . . . . . 34.7 t -71.55 128.3 34.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 115.903 -0.59 . . . . 74.73 110.326 -171.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 67' ' ' GLY . . . . . . . . . . . . . . . 104.27 -20.69 39.51 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-O 118.961 -0.911 . . . . 71.54 115.321 -177.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -100.75 127.62 53.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 118.59 1.195 . . . . 77.62 109.484 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 69' ' ' GLU . . . . . . . . . . . . . . . -72.9 136.02 45.19 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.443 -0.577 . . . . 77.06 109.443 173.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 70' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -133.28 168.3 18.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.694 0.759 . . . . 79.79 109.756 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 71' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -99.27 125.33 44.86 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.314 -0.857 . . . . 75.31 108.796 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 72' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -121.7 125.52 46.8 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 110.137 -0.32 . . . . 77.95 110.137 -176.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 73' ' ' TYR . . . . . . . . . . . . . . . -100.81 105.27 16.56 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.688 -1.227 . . . . 81.0 107.688 171.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 74' ' ' THR . . . . . . . . . . . . . 67.8 p -76.07 70.64 2.77 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 122.637 1.208 . . . . 80.86 109.41 -173.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 75' ' ' LYS . . . . . 0.473 ' HA ' ' OD1' ' F' ' 79' ' ' ASN . . . -63.39 -25.68 68.4 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.994 -1.003 . . . . 82.49 113.356 -176.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 76' ' ' SER . . . . . . . . . . . . . 1.1 p -67.37 -31.33 71.51 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 112.793 0.664 . . . . 84.36 112.793 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 77' ' ' LEU . . . . . . . . . . . . . 84.3 mt -122.17 -101.21 0.41 Allowed 'General case' 0 C--O 1.237 0.432 0 N-CA-C 114.307 1.225 . . . . 90.7 114.307 -169.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 78' ' ' ASP . . . . . 0.506 ' OD2' ' NH1' ' F' ' 104' ' ' ARG . 15.6 p-10 -87.08 -3.27 59.06 Favored 'General case' 0 CA--C 1.502 -0.883 0 C-N-CA 122.539 0.336 . . . . 80.62 111.535 -171.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 79' ' ' ASN . . . . . 0.473 ' OD1' ' HA ' ' F' ' 75' ' ' LYS . 6.7 m-20 55.43 46.17 23.78 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-O 122.359 1.075 . . . . 91.13 110.37 172.779 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 80' ' ' ARG . . . . . . . . . . . . . . . -108.78 160.37 16.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.29 -1.323 . . . . 81.29 111.411 179.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 81' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -95.57 127.11 41.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.74 -1.118 . . . . 79.14 108.949 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 82' ' ' VAL . . . . . . . . . . . . . 30.2 m -132.33 151.43 34.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.618 0.723 . . . . 77.94 109.256 178.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 83' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -97.57 109.59 22.31 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 105.352 -2.092 . . . . 74.51 105.352 171.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 84' ' ' ALA . . . . . . . . . . . . . . . -112.09 140.14 47.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.969 0.414 . . . . 73.27 110.176 -171.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 85' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -137.99 135.7 36.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.388 -0.968 . . . . 73.28 108.388 175.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 86' ' ' VAL . . . . . . . . . . . . . 4.6 t -112.63 137.2 46.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 108.427 -0.953 . . . . 68.05 108.427 -177.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 87' ' ' THR . . . . . . . . . . . . . 47.4 p -132.81 159.14 40.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.013 0.911 . . . . 70.5 109.779 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 88' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -90.77 121.0 32.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.316 -1.311 . . . . 72.31 107.697 171.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 89' ' ' GLU . . . . . 0.697 ' O ' HG22 ' F' ' 92' ' ' VAL . 41.5 mt-10 -111.85 92.87 4.19 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 103.614 -2.736 . . . . 87.33 103.614 170.828 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 90' ' ' GLY . . . . . . . . . . . . . . . 71.94 -111.86 3.81 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 106.882 -2.487 . . . . 78.43 106.882 -170.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -116.95 28.89 8.25 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 119.131 -0.461 . . . . 86.16 111.647 171.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 92' ' ' VAL . . . . . 0.697 HG22 ' O ' ' F' ' 89' ' ' GLU . 3.3 m -115.48 137.16 49.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 105.44 -2.059 . . . . 73.91 105.44 -177.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 93' ' ' LEU . . . . . . . . . . . . . 2.4 mt -86.45 111.22 20.33 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.336 -0.545 . . . . 75.28 109.736 178.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 94' ' ' VAL . . . . . . . . . . . . . 4.6 t -110.47 122.46 65.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.351 -0.981 . . . . 68.93 108.351 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 95' ' ' CYS . . . . . . . . . . . . . 6.3 t -116.92 130.33 56.63 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.352 -0.61 . . . . 73.0 109.352 -178.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 96' ' ' VAL . . . . . . . . . . . . . 3.6 t -109.26 131.43 60.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 107.834 -1.173 . . . . 75.51 107.834 174.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 97' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -116.46 93.68 4.32 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 107.337 -1.357 . . . . 81.14 107.337 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 98' ' ' LYS . . . . . . . . . . . . . . . -75.05 135.35 41.25 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.202 0.525 . . . . 68.93 110.952 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 99' ' ' GLY . . . . . . . . . . . . . . . 175.6 -150.59 11.0 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.7 -0.682 . . . . 81.09 113.151 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 100' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.22 -38.08 89.77 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.488 -0.485 . . . . 82.92 111.299 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 101' ' ' LYS . . . . . . . . . . . . . . . -79.81 134.14 36.33 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.695 -0.854 . . . . 87.7 108.695 -179.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 102' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -88.22 148.14 24.51 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.101 -1.074 . . . . 96.82 108.101 -179.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 103' ' ' ASN . . . . . 0.611 ' ND2' ' O ' ' F' ' 122' ' ' GLY . 12.3 t-20 62.59 36.87 13.47 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 118.652 -1.219 . . . . 112.83 113.183 176.406 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 104' ' ' ARG . . . . . 0.506 ' NH1' ' OD2' ' F' ' 78' ' ' ASP . 31.9 ttt180 -105.13 128.6 53.45 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 118.868 0.758 . . . . 88.14 111.456 -173.209 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.15 -163.39 32.08 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.329 -0.939 . . . . 81.88 110.998 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 106' ' ' TRP . . . . . . . . . . . . . 42.2 p-90 -158.68 167.15 30.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 122.033 0.92 . . . . 74.8 109.662 175.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 107' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt -130.27 138.22 50.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.182 -1.372 . . . . 73.71 108.492 176.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 108' ' ' LYS . . . . . 0.455 ' HG3' HD13 ' F' ' 117' ' ' LEU . 18.4 tttt -131.45 129.99 41.9 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.218 -1.401 . . . . 71.76 107.218 -177.223 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 109' ' ' TRP . . . . . 0.458 ' CB ' HG12 ' F' ' 92' ' ' VAL . 15.9 p90 -153.8 169.61 22.96 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 118.733 -1.187 . . . . 85.75 109.889 176.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 110' ' ' ILE . . . . . . . . . . . . . 3.2 tp -123.53 131.28 73.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 113.782 -1.553 . . . . 106.64 109.304 -166.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 111' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -127.41 105.47 8.54 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 106.38 -1.711 . . . . 114.52 106.38 171.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 112' ' ' GLY . . . . . . . . . . . . . . . 68.57 -106.93 1.89 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.83 -1.308 . . . . 111.92 109.83 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -126.76 30.16 5.55 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.924 0.889 . . . . 108.12 111.026 175.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 114' ' ' LYS . . . . . . . . . . . . . . . -114.08 144.62 42.83 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.029 -0.73 . . . . 109.54 109.029 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 115' ' ' LEU . . . . . . . . . . . . . . . -104.36 134.6 47.3 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.106 -0.701 . . . . 90.94 109.106 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 116' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -121.5 123.58 42.36 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.663 -1.236 . . . . 89.55 107.663 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 117' ' ' LEU . . . . . 0.455 HD13 ' HG3' ' F' ' 108' ' ' LYS . 56.2 tp -133.54 118.39 18.23 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.573 -0.529 . . . . 70.93 109.573 -175.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 118' ' ' GLU . . . . . . . . . . . . . . . -114.23 111.26 21.25 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.037 -1.097 . . . . 76.75 108.037 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 119' ' ' LEU . . . . . . . . . . . . . 1.2 mp -94.95 126.6 40.4 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.383 -0.969 . . . . 76.3 108.383 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 120' ' ' THR . . . . . 0.453 HG22 HG23 ' F' ' 125' ' ' VAL . 1.6 p -127.09 106.74 9.47 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 110.026 -0.361 . . . . 93.18 110.026 -166.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 121' ' ' CYS . . . . . . . . . . . . . 47.2 t -113.04 155.82 24.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.939 -0.763 . . . . 100.29 108.939 169.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 122' ' ' GLY . . . . . 0.611 ' O ' ' ND2' ' F' ' 103' ' ' ASN . . . 20.21 -97.6 0.01 OUTLIER Glycine 0 C--N 1.338 0.681 0 N-CA-C 115.628 1.011 . . . . 108.98 115.628 -172.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 123' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -97.98 -39.57 8.89 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.943 1.297 . . . . 113.12 112.976 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 124' ' ' GLN . . . . . . . . . . . . . . . -83.21 118.94 23.96 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.249 0.547 . . . . 104.14 111.744 -173.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 125' ' ' VAL . . . . . 0.453 HG23 HG22 ' F' ' 120' ' ' THR . 2.4 p -104.27 148.47 8.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.229 -1.026 . . . . 80.45 108.229 169.645 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 126' ' ' CYS . . . . . . . . . . . . . 6.7 t -123.84 124.05 41.79 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.057 1.343 . . . . 80.39 108.563 -177.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 127' ' ' ARG . . . . . . . . . . . . . . . -105.35 125.91 51.51 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.047 0.539 . . . . 79.49 109.768 -176.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 128' ' ' GLN . . . . . . . . . . . . . . . -129.37 141.1 51.15 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.537 0.735 . . . . 80.33 109.479 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 129' ' ' VAL . . . . . . . . . . . . . . . -124.75 138.03 55.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.414 -0.958 . . . . 83.82 108.414 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 130' ' ' PHE . . . . . 0.504 ' HA ' ' HA ' ' E' ' 10' ' ' MET . 5.0 m-85 -122.86 142.65 50.54 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.172 -0.677 . . . . 91.74 109.172 -177.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 131' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' E' ' 9' ' ' GLU . . . -105.15 140.16 38.74 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.446 -0.576 . . . . 96.26 109.446 174.123 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 132' ' ' LYS . . . . . . . . . . . . . 44.3 tttt -79.47 132.57 36.39 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.812 -0.81 . . . . 100.48 108.812 178.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 133' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 102.13 111.104 -176.736 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' GOL . . . . . 0.564 ' H2 ' ' HE2' ' A' ' 60' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.428 ' O ' ' NZ ' ' A' ' 31' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.5 t . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.769 0.319 . . . . 63.17 111.008 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -118.96 15.05 13.34 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 112.879 0.696 . . . . 51.27 112.879 -178.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -102.37 102.72 13.09 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.726 -0.842 . . . . 65.52 108.726 -176.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -96.07 11.06 35.51 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.961 0.726 . . . . 56.09 112.961 178.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -65.41 138.86 58.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 118.239 0.472 . . . . 65.54 111.277 -175.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.66 -174.82 19.28 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.48 -0.867 . . . . 56.08 112.248 171.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . 0.439 HG23 HG12 ' A' ' 41' ' ' VAL . 16.9 m -102.95 127.24 50.25 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 122.967 0.507 . . . . 50.54 109.808 -179.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 58.1 m95 -120.83 120.78 36.57 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.587 -0.894 . . . . 52.13 108.587 -176.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -103.66 131.7 50.58 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.47 0.708 . . . . 78.07 109.254 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 57.8 ttm -68.02 141.1 56.32 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.062 0.764 . . . . 46.37 113.062 -173.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.655 ' OE2' ' HD2' ' D' ' 131' ' ' LYS 0.272 2.4 mt-10 -124.73 -3.77 7.71 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 116.407 2.003 . . . . 79.06 116.407 163.642 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . 0.47 ' HB2' HG12 ' D' ' 129' ' ' VAL . 36.4 m -145.51 161.12 40.49 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 120.33 1.423 . . . . 64.59 111.252 165.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -156.59 90.31 1.16 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 104.798 -2.297 . . . . 45.41 104.798 -178.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -103.76 135.24 45.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.432 -0.804 . . . . 72.49 110.035 -175.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.1 t30 50.69 46.47 25.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.883 0.849 . . . . 46.21 111.829 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -73.63 -38.38 65.06 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 115.543 -0.753 . . . . 33.2 110.863 170.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -69.44 -39.08 78.01 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 120.774 -0.37 . . . . 54.03 111.593 -176.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.06 -39.86 94.9 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 119.781 -1.2 . . . . 39.1 112.447 175.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -60.78 -44.42 96.82 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 122.348 -0.501 . . . . 39.52 111.436 175.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 59.0 mtm -69.98 -35.84 74.73 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 119.736 -0.785 . . . . 53.23 111.7 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -62.09 -41.64 98.39 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.107 -0.371 . . . . 51.44 111.393 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.37 70.61 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.162 -0.615 . . . . 43.53 111.698 176.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 21.9 mt -78.47 3.6 15.5 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.101 0.778 . . . . 35.1 113.101 176.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 55.13 49.28 17.75 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 122.098 0.951 . . . . 56.11 110.621 -177.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.1 mt -89.09 158.73 2.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.756 -1.201 . . . . 38.73 107.756 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -95.19 145.2 25.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.384 0.612 . . . . 51.81 110.413 -168.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -40.62 -45.26 2.3 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.601 1.161 . . . . 40.75 112.986 -178.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.541 ' O ' HG13 ' A' ' 32' ' ' ILE . . . -58.4 -59.68 4.96 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 120.973 0.416 . . . . 35.8 111.828 -179.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . 0.499 HG23 ' HB3' ' D' ' 31' ' ' LYS . 3.3 p -71.59 -21.54 61.85 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 119.066 -1.054 . . . . 40.68 111.975 -176.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.495 ' O ' HG13 ' A' ' 34' ' ' VAL . 24.2 mtm105 -69.66 -42.65 73.93 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.494 -0.883 . . . . 42.11 110.661 172.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.428 ' NZ ' ' O ' ' A' ' 301' ' ' HOH . 7.0 mmpt? -66.12 -32.1 73.35 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 111.81 0.3 . . . . 42.49 111.81 178.431 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 28' ' ' ALA . 9.3 mt -72.54 -47.39 51.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 C-N-CA 118.864 -1.134 . . . . 54.99 110.592 174.17 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.74 -24.94 65.41 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 121.775 -0.578 . . . . 34.63 111.876 -173.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 30' ' ' ARG . 33.2 m -72.81 -13.47 16.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 119.518 -0.873 . . . . 37.59 111.512 176.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 52.4 ttm-85 -103.91 36.41 2.34 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.723 0.809 . . . . 51.59 111.373 178.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 67.3 mt -134.18 169.78 16.66 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 120.817 -1.177 . . . . 34.12 110.676 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.4 t -142.87 158.21 43.84 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 106.503 -1.665 . . . . 39.89 106.503 167.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -127.58 151.07 49.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.478 0.656 . . . . 36.39 110.864 -169.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.0 m -132.43 121.57 23.62 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.423 -1.325 . . . . 45.33 107.423 173.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -111.15 123.28 49.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.707 -0.479 . . . . 64.15 109.707 -174.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.439 HG12 HG23 ' A' ' 7' ' ' THR . 34.2 m -98.53 116.37 41.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.556 0 N-CA-C 107.526 -1.287 . . . . 54.58 107.526 172.542 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 55.3 mt -107.5 127.31 63.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 108.617 -0.883 . . . . 58.18 108.617 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -113.56 113.43 25.09 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 124.342 1.057 . . . . 83.89 109.337 170.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -127.82 116.63 20.46 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.106 -0.701 . . . . 56.4 109.106 -171.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -116.03 101.48 8.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.263 -1.754 . . . . 75.42 106.263 173.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.45 -109.13 2.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.89 -0.671 . . . . 58.32 112.578 -177.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -103.81 2.7 33.09 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 112.867 0.691 . . . . 58.21 112.867 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . . . -94.79 128.97 41.89 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 118.436 0.562 . . . . 47.7 109.761 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -122.98 139.01 54.52 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.211 0.604 . . . . 54.23 110.435 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . . . -136.02 107.65 6.98 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.46 -1.311 . . . . 53.08 107.46 173.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.7 p -109.32 142.92 39.53 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.552 -0.536 . . . . 57.32 109.552 -174.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -131.21 119.39 21.78 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.546 -0.909 . . . . 66.64 108.546 172.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -106.37 106.77 17.44 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.766 0.826 . . . . 44.93 109.56 -175.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.7 p -91.14 142.58 27.59 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 123.52 0.728 . . . . 44.01 109.747 178.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.8 m -116.47 138.33 51.46 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.109 -0.496 . . . . 39.79 110.159 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 14.0 t -144.63 149.85 36.42 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.019 -1.104 . . . . 49.18 108.019 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -65.89 162.35 19.24 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.924 0.869 . . . . 39.95 110.464 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.2 tp -80.41 168.3 19.16 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.421 -0.809 . . . . 50.88 109.811 -172.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -112.35 114.85 27.81 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.745 -0.661 . . . . 67.89 109.404 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.564 ' HE2' ' H2 ' ' A' ' 203' ' ' GOL . 27.4 t80 -83.17 101.81 11.46 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.162 0.985 . . . . 59.44 109.877 178.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -98.12 136.46 38.33 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 108.775 -0.824 . . . . 59.86 108.775 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 63.2 t -138.64 121.2 18.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 108.15 -1.055 . . . . 48.33 108.15 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -119.87 129.95 54.64 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 109.724 -0.473 . . . . 56.79 109.724 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -151.86 160.12 43.64 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.625 0.726 . . . . 39.39 109.237 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . . . -120.6 140.24 51.82 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.745 -1.116 . . . . 45.47 108.405 170.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.531 HG11 ' CD1' ' A' ' 88' ' ' TRP . 7.4 t -71.48 125.43 29.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 109.581 -0.526 . . . . 49.81 109.581 -173.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 100.96 -21.68 42.61 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-O 119.378 -0.679 . . . . 46.44 114.211 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.8 t -100.51 123.46 53.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.276 -1.009 . . . . 56.72 108.276 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -72.9 136.18 45.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.987 -1.006 . . . . 75.99 109.566 177.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -132.13 167.87 18.99 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.83 0.824 . . . . 54.81 110.768 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.412 ' OD1' ' HD3' ' A' ' 83' ' ' LYS . 36.2 m-20 -99.98 126.68 46.2 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 114.874 -1.057 . . . . 64.1 109.162 179.754 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -121.26 123.58 42.54 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.483 -0.562 . . . . 57.83 109.483 -177.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . . . -102.16 104.35 14.93 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 107.011 -1.478 . . . . 57.29 107.011 171.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.2 p -78.82 69.29 4.96 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 122.311 1.053 . . . . 54.07 110.282 -173.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . . . -65.13 -30.58 71.52 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.209 -0.905 . . . . 45.55 112.079 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.0 p -56.15 -32.47 64.32 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 113.619 0.97 . . . . 65.24 113.619 173.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -119.94 -103.27 0.41 Allowed 'General case' 0 C--O 1.241 0.622 0 N-CA-C 109.589 -0.522 . . . . 60.84 109.589 -168.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -90.1 2.37 55.34 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 121.101 -0.999 . . . . 56.06 113.494 -171.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 49.53 50.83 17.54 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.889 0.852 . . . . 56.87 111.167 -174.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.467 ' NH1' ' OE2' ' A' ' 100' ' ' GLU . 7.3 mtm-85 -110.15 156.5 20.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.712 0.768 . . . . 51.33 110.05 175.2 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -97.57 126.56 42.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 61.79 108.546 174.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 22.5 m -132.75 151.32 34.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 108.036 -1.098 . . . . 51.67 108.036 177.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.412 ' HD3' ' OD1' ' A' ' 71' ' ' ASP . 2.2 tppt? -98.43 112.92 24.78 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 106.325 -1.732 . . . . 75.6 106.325 172.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.487 ' HA ' ' O ' ' A' ' 96' ' ' VAL . . . -110.89 143.9 40.77 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.917 0.389 . . . . 52.99 110.397 -170.946 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.407 ' O ' ' HA ' ' A' ' 95' ' ' CYS . 15.0 tp -135.3 138.51 43.52 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.905 -0.776 . . . . 43.03 108.905 175.705 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.1 t -113.13 136.26 50.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.762 -0.829 . . . . 45.77 108.762 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.5 m -134.07 157.51 45.96 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.544 0.688 . . . . 47.1 109.522 -179.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.531 ' CD1' HG11 ' A' ' 66' ' ' VAL . 51.3 m95 -91.62 120.53 32.47 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.918 -1.037 . . . . 39.51 109.584 173.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 76.1 mt-10 -115.17 90.69 3.4 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 104.256 -2.498 . . . . 46.17 104.256 168.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.59 -112.04 4.07 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 110.014 -1.234 . . . . 41.99 110.014 -173.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -114.31 27.03 9.78 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 122.744 0.418 . . . . 50.63 111.39 171.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.507 HG22 ' HB3' ' A' ' 109' ' ' TRP . 92.1 t -114.51 133.03 61.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 108.482 -0.932 . . . . 39.6 108.482 -179.309 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.9 mt -86.33 110.78 19.9 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.506 -1.294 . . . . 40.01 107.506 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.461 HG13 ' HG2' ' A' ' 107' ' ' LYS . 4.0 t -110.48 120.59 61.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.429 -1.323 . . . . 47.91 107.429 178.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 13.4 t -117.66 131.08 56.69 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.999 -0.741 . . . . 37.34 108.999 -177.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.487 ' O ' ' HA ' ' A' ' 84' ' ' ALA . 9.8 p -107.25 133.86 50.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 107.69 -1.226 . . . . 47.59 107.69 174.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.454 ' HB2' ' HD3' ' A' ' 104' ' ' ARG . 36.2 mt-30 -116.19 92.83 4.01 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.042 -1.466 . . . . 48.97 107.042 179.779 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 45.6 mmtt -75.45 133.98 40.97 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 110.027 -0.36 . . . . 58.7 110.027 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.12 -151.3 11.45 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.993 -0.549 . . . . 65.4 112.902 -178.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.467 ' OE2' ' NH1' ' A' ' 80' ' ' ARG . 57.3 tt0 -64.32 -39.62 94.27 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.415 -0.514 . . . . 86.79 111.568 -178.345 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -83.32 136.15 34.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.018 0.437 . . . . 66.87 110.485 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.416 ' H ' ' HG2' ' A' ' 102' ' ' GLU . 3.2 pt-20 -89.84 144.95 25.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.42 0.629 . . . . 80.84 110.781 -179.241 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 1.8 t30 60.57 45.04 10.96 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.265 -0.88 . . . . 82.97 111.306 177.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.454 ' HD3' ' HB2' ' A' ' 97' ' ' GLN . 11.5 ttt85 -104.4 129.49 52.34 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.237 -0.653 . . . . 54.8 109.237 -177.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 176.44 -162.89 31.79 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.267 -0.968 . . . . 41.94 111.125 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' TRP . . . . . 0.555 ' HB3' HD23 ' A' ' 119' ' ' LEU . 36.6 p-90 -159.19 166.97 30.25 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 119.63 -0.828 . . . . 44.28 110.442 176.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.461 ' HG2' HG13 ' A' ' 94' ' ' VAL . 87.3 mttt -133.44 139.01 46.48 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 114.632 -1.167 . . . . 45.11 109.694 176.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.683 ' HG3' HD13 ' A' ' 117' ' ' LEU . 9.8 mttt -132.15 130.89 41.71 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 124.026 0.931 . . . . 45.21 109.363 -176.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.507 ' HB3' HG22 ' A' ' 92' ' ' VAL . 20.9 p90 -154.79 169.5 23.83 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 119.261 -0.976 . . . . 48.43 110.381 176.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 13.1 mm -120.56 131.04 73.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 108.412 -0.959 . . . . 46.25 108.412 -173.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . . . -125.63 108.44 11.56 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 107.641 -1.244 . . . . 51.66 107.641 172.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 70.35 -105.93 1.71 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 110.199 -1.16 . . . . 64.45 110.199 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -123.94 21.26 9.07 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 122.658 0.383 . . . . 67.7 111.398 175.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -118.57 144.67 45.94 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.015 0.436 . . . . 55.18 110.358 179.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 24.0 tp -104.95 135.85 45.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.723 -0.671 . . . . 40.64 109.387 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -120.8 126.92 51.34 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.924 -0.769 . . . . 45.69 108.924 -179.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.683 HD13 ' HG3' ' A' ' 108' ' ' LYS . 23.8 tp -131.04 120.75 23.89 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.794 -0.817 . . . . 49.63 108.794 -177.648 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -112.37 112.88 24.77 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.901 -1.148 . . . . 65.65 107.901 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.555 HD23 ' HB3' ' A' ' 106' ' ' TRP . 15.4 mt -92.62 130.13 38.35 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.228 -1.027 . . . . 46.54 108.228 175.406 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 22.2 m -127.7 103.06 7.09 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.077 0.551 . . . . 59.66 110.678 -167.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 34.7 t -122.34 155.27 36.34 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.103 -1.073 . . . . 60.11 108.103 168.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 20.88 -105.15 0.01 OUTLIER Glycine 0 C--N 1.336 0.582 0 N-CA-C 116.141 1.217 . . . . 71.79 116.141 -169.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -100.05 -19.09 16.69 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.568 0.951 . . . . 76.89 113.568 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -87.77 118.74 27.49 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 122.859 0.463 . . . . 64.4 111.281 -176.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 22.9 t -103.82 145.57 12.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 108.409 -0.96 . . . . 50.94 108.409 169.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.415 ' HB2' ' HB2' ' B' ' 19' ' ' TYR . 32.1 t -127.4 123.41 36.09 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.361 -0.977 . . . . 47.01 108.361 178.946 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . . . -106.66 125.63 51.25 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 110.132 -0.321 . . . . 44.2 110.132 -177.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -128.88 138.01 51.78 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 108.504 -0.924 . . . . 45.44 108.504 176.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 3.6 p -127.1 139.08 52.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.554 -0.906 . . . . 43.6 108.554 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -121.34 145.0 48.33 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 123.99 0.916 . . . . 46.2 109.121 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.627 ' HD3' ' HE2' ' A' ' 133' ' ' LYS . 14.1 tttp -102.01 140.85 35.74 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.44 -0.948 . . . . 70.57 108.44 174.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -78.06 133.05 37.97 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 120.648 -0.421 . . . . 43.54 110.244 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.627 ' HE2' ' HD3' ' A' ' 131' ' ' LYS . 10.5 mmtp . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.93 -0.577 . . . . 65.5 110.837 -178.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' THR . . . . . . . . . . . . . 63.0 p . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.781 0.324 . . . . 49.65 110.86 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.512 ' O ' ' NE2' ' B' ' 44' ' ' GLN . 7.6 mmt180 68.94 -13.59 0.33 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.282 1.033 . . . . 44.81 113.531 173.51 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -105.2 98.26 7.99 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.983 -1.118 . . . . 40.8 107.983 176.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -99.42 8.82 44.27 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 112.583 0.586 . . . . 36.77 112.583 177.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -66.14 137.89 57.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.137 0.494 . . . . 35.75 111.312 -174.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 128.67 -174.93 18.88 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-O 121.872 0.707 . . . . 32.28 112.002 171.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 90.4 m -103.2 127.53 50.47 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.237 -0.653 . . . . 41.62 109.237 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' TRP . . . . . . . . . . . . . 62.5 m95 -120.56 122.22 40.09 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.89 -0.782 . . . . 37.6 108.89 -175.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -102.78 130.87 49.9 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.599 0.76 . . . . 79.54 110.074 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' MET . . . . . 0.401 ' HB3' HG22 ' B' ' 37' ' ' THR . 38.5 ttm -67.74 142.83 56.15 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.468 0.651 . . . . 42.29 112.026 -174.404 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -123.29 -20.67 5.58 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 113.624 0.972 . . . . 64.71 113.624 172.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -143.83 160.55 40.57 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.819 0.818 . . . . 49.11 110.201 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -160.64 91.86 0.93 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 106.226 -1.768 . . . . 47.45 106.226 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -103.0 134.18 46.88 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.126 -0.488 . . . . 72.02 110.234 -175.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ASN . . . . . . . . . . . . . 50.4 t30 50.09 47.6 23.23 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.753 0.787 . . . . 49.27 111.796 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -73.59 -39.32 64.7 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.076 -0.649 . . . . 44.34 110.99 171.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -66.38 -40.85 89.96 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 120.736 0.303 . . . . 90.63 110.293 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.95 -39.17 94.79 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.551 -0.833 . . . . 50.01 112.31 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.415 ' HB2' ' HB2' ' A' ' 126' ' ' CYS . 73.0 t80 -61.16 -44.28 97.55 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.572 -0.451 . . . . 47.31 111.168 174.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 59.4 mtm -69.74 -36.22 75.64 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.799 -0.76 . . . . 47.52 111.693 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -62.15 -41.58 98.42 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 122.18 -0.325 . . . . 56.84 111.088 174.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.23 -30.55 71.18 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.988 -0.685 . . . . 49.27 110.826 175.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.431 ' O ' ' NH2' ' A' ' 80' ' ' ARG . 40.6 mt -79.77 -0.97 36.62 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 119.222 -0.418 . . . . 50.47 111.912 172.382 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 52.17 52.47 14.25 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 122.119 0.961 . . . . 75.37 110.977 -178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 35.9 mt -86.05 159.72 3.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 107.728 -1.212 . . . . 51.18 107.728 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -93.17 144.91 24.82 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.58 0.705 . . . . 52.7 110.664 -167.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -39.85 -43.16 1.42 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.228 1.411 . . . . 60.66 114.37 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.424 ' O ' HG13 ' B' ' 32' ' ' ILE . . . -58.62 -61.77 2.35 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 120.667 -0.413 . . . . 34.69 111.79 -178.382 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' THR . . . . . 0.721 ' HA ' HD12 ' B' ' 32' ' ' ILE . 15.5 p -74.1 -16.71 61.01 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 119.411 -0.916 . . . . 49.15 111.954 -177.195 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 10.6 mtm-85 -68.99 -41.61 77.6 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.662 -0.815 . . . . 56.24 110.424 170.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 38.6 mmtt -67.57 -31.82 72.15 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 121.102 -0.239 . . . . 53.82 111.441 175.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ILE . . . . . 0.721 HD12 ' HA ' ' B' ' 29' ' ' THR . 19.3 mt -69.9 -49.81 53.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 C-N-CA 119.623 -0.831 . . . . 42.71 110.608 176.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.52 -24.5 63.75 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.821 0.675 . . . . 46.81 112.821 -173.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 2.0 p -73.51 -14.12 16.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 112.365 0.506 . . . . 48.75 112.365 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 4.2 mtp85 -105.54 40.6 1.52 Allowed 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.174 0.59 . . . . 59.45 111.825 176.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.46 171.96 12.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 122.397 1.094 . . . . 45.33 110.987 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' THR . . . . . 0.401 HG22 ' HB3' ' B' ' 10' ' ' MET . 1.4 m -140.34 155.83 46.65 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 106.321 -1.733 . . . . 49.88 106.321 169.124 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -127.89 149.45 50.3 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.637 0.732 . . . . 38.76 109.885 -172.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 2.8 m -133.39 123.6 25.65 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.39 -1.337 . . . . 52.38 107.39 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -109.75 120.58 42.93 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.924 -0.769 . . . . 57.65 108.924 -176.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.79 114.01 36.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 106.667 -1.605 . . . . 36.14 106.667 172.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 57.2 mt -108.52 126.07 65.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 108.447 -0.946 . . . . 36.1 108.447 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -113.2 116.48 29.86 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 107.345 -1.354 . . . . 62.82 107.345 169.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' B' ' 2' ' ' ARG . 34.8 tt0 -125.44 117.89 24.64 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.494 -0.558 . . . . 39.78 109.494 -170.64 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -115.1 99.32 7.35 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.264 -1.384 . . . . 46.4 107.264 175.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.27 -109.49 2.76 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.173 -0.537 . . . . 40.2 112.312 -177.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -103.7 2.76 33.47 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.47 0.544 . . . . 50.87 112.47 177.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ASN . . . . . . . . . . . . . 11.5 m-20 -93.46 130.25 39.34 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.444 -0.576 . . . . 50.38 109.444 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -122.34 141.87 51.1 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.8 0.44 . . . . 43.74 110.237 -175.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -132.33 115.36 15.52 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.096 -1.075 . . . . 57.92 108.096 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 26.9 m -103.98 141.5 36.07 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 124.547 1.139 . . . . 50.07 111.152 -171.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 6.0 tttm -134.25 115.72 14.47 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 108.097 -1.075 . . . . 60.51 108.097 166.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -109.46 102.43 11.31 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.268 -1.012 . . . . 41.47 108.268 -178.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 20.7 p -95.65 141.87 28.64 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 122.909 0.484 . . . . 50.47 110.249 177.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.3 m -118.66 141.58 48.47 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 122.886 0.475 . . . . 49.9 110.536 179.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 10.5 m -140.61 161.15 38.43 Favored 'General case' 0 C--N 1.334 -0.094 0 N-CA-C 108.155 -1.054 . . . . 69.1 108.155 -176.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -82.41 158.02 23.46 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 118.224 -1.39 . . . . 37.75 110.666 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.9 mt -86.73 117.59 25.59 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.237 -0.892 . . . . 38.16 110.684 -173.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -58.63 116.76 3.91 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.376 -0.375 . . . . 53.53 111.196 174.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -81.85 120.19 24.86 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.706 -0.479 . . . . 63.12 109.706 177.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -107.97 136.51 47.55 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 122.787 0.435 . . . . 56.79 111.064 -176.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 27.3 m -139.78 121.4 15.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 108.168 -1.049 . . . . 58.41 108.168 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -119.77 127.13 52.52 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.926 -0.768 . . . . 71.56 108.926 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' PHE . . . . . 0.414 ' CD1' HG11 ' B' ' 86' ' ' VAL . 49.6 p90 -153.67 159.32 42.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.525 0.679 . . . . 58.12 109.22 -176.943 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' THR . . . . . 0.904 HG22 ' HA ' ' D' ' 48' ' ' ASN . 29.2 p -125.3 141.89 51.82 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.936 -1.029 . . . . 64.91 109.709 169.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.579 ' HA ' HG13 ' B' ' 86' ' ' VAL . 6.8 t -70.84 128.44 34.07 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-N 115.603 -0.726 . . . . 66.31 110.232 -172.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 106.38 -23.07 29.48 Favored Glycine 0 C--N 1.335 0.495 0 N-CA-C 116.397 1.319 . . . . 74.74 116.397 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 1.5 m -102.52 127.75 55.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 119.253 1.526 . . . . 66.62 108.993 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . . . -69.33 137.49 52.98 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.223 -0.658 . . . . 69.72 109.223 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -131.51 168.75 17.13 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.857 0.837 . . . . 66.97 109.852 -179.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -97.98 125.16 42.78 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.919 -1.037 . . . . 89.91 108.768 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -121.63 123.84 42.9 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.319 -0.993 . . . . 74.77 108.319 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . . . -97.98 101.18 12.6 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 103.184 -2.895 . . . . 54.86 103.184 170.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' THR . . . . . 0.509 HG23 ' H ' ' B' ' 80' ' ' ARG . 1.6 t -76.52 72.46 3.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 122.531 1.158 . . . . 62.14 108.984 -171.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' LYS . . . . . 0.765 ' O ' ' N ' ' B' ' 77' ' ' LEU . 32.5 mttt -63.92 -149.87 0.01 OUTLIER 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.791 -1.559 . . . . 70.39 106.791 172.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 83.5 p 58.96 -37.02 0.06 Allowed 'General case' 0 N--CA 1.465 0.319 0 O-C-N 121.441 -0.787 . . . . 61.29 111.484 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.765 ' N ' ' O ' ' B' ' 75' ' ' LYS . 14.6 mt -127.0 -104.4 0.33 Allowed 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.513 -0.551 . . . . 57.13 109.513 -171.092 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -92.44 -1.7 56.81 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 113.827 1.047 . . . . 55.49 113.827 -171.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ASN . . . . . 0.415 HD21 ' HG2' ' B' ' 75' ' ' LYS . 0.9 OUTLIER 46.69 54.6 8.7 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.728 0.775 . . . . 77.77 111.866 -178.641 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ARG . . . . . 0.509 ' H ' HG23 ' B' ' 74' ' ' THR . 17.0 mtt180 -107.5 160.04 15.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.567 0.698 . . . . 61.29 110.144 176.512 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . . . -96.56 125.29 40.93 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.589 -0.893 . . . . 65.33 108.589 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 28.6 m -134.38 151.55 32.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.65 0.738 . . . . 59.94 109.726 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 2.9 mtpt -98.65 113.08 25.0 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 106.147 -1.797 . . . . 70.06 106.147 171.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -110.26 141.28 43.46 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.934 0.397 . . . . 58.62 110.443 -171.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 11.7 tp -137.46 128.87 28.14 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.77 -0.826 . . . . 68.8 108.77 175.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.579 HG13 ' HA ' ' B' ' 66' ' ' VAL . 3.5 p -112.63 138.55 41.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.967 -1.123 . . . . 66.4 107.967 -178.685 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 3.1 p -132.82 157.61 44.56 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.779 0.799 . . . . 67.19 110.016 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -92.08 120.0 32.29 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 114.617 -1.174 . . . . 80.76 108.858 172.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.477 ' O ' HG22 ' B' ' 92' ' ' VAL . 2.7 mm-40 -115.27 93.37 4.26 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 104.97 -2.233 . . . . 90.97 104.97 169.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.8 -111.46 3.74 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 109.728 -1.349 . . . . 81.48 109.728 -173.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . . . -115.37 27.0 9.65 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.868 0.322 . . . . 77.27 111.868 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.477 HG22 ' O ' ' B' ' 89' ' ' GLU . 2.7 m -114.76 133.23 61.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 N-CA-C 108.764 -0.828 . . . . 68.48 108.764 179.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 12.8 mt -88.65 107.89 19.17 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 107.33 -1.359 . . . . 62.87 107.33 175.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.426 HG13 HG23 ' B' ' 92' ' ' VAL . 5.1 m -112.92 119.28 60.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 108.028 -1.101 . . . . 63.89 108.028 179.36 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 18.1 t -118.77 130.74 55.96 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.909 -0.775 . . . . 70.16 108.909 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.4 p -108.79 136.28 45.05 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 N-CA-C 107.963 -1.125 . . . . 56.11 107.963 173.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -113.93 94.81 5.0 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 107.548 -1.278 . . . . 62.47 107.548 -178.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . . . -74.01 134.92 43.09 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.832 -0.622 . . . . 64.68 110.548 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.05 -149.82 10.21 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.438 -0.801 . . . . 71.03 112.562 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -63.39 -39.63 95.05 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.642 -0.423 . . . . 71.92 111.538 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . . . -83.84 136.26 34.19 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.009 0.433 . . . . 72.97 110.676 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . . . -90.67 144.91 25.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.994 -0.548 . . . . 62.25 110.761 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 t30 60.56 44.02 12.16 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.681 -0.69 . . . . 72.8 111.777 176.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -105.16 130.47 53.32 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.735 -0.468 . . . . 61.58 109.735 -177.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.78 -161.72 29.02 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 119.818 -1.182 . . . . 47.96 111.648 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.552 ' HB3' HD23 ' B' ' 119' ' ' LEU . 51.9 p-90 -160.24 166.32 29.81 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.792 0.806 . . . . 56.28 110.475 175.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 11.9 mttt -132.43 140.68 48.53 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.566 -1.197 . . . . 74.45 109.892 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LYS . . . . . 0.547 ' HG3' HD13 ' B' ' 117' ' ' LEU . 11.6 mttt -131.86 131.39 42.74 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 123.533 0.733 . . . . 65.98 109.099 -178.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' TRP . . . . . . . . . . . . . 33.7 p90 -153.63 167.79 28.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.498 0.666 . . . . 74.5 109.936 175.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ILE . . . . . . . . . . . . . 19.6 mm -122.38 132.84 70.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 115.579 -0.737 . . . . 74.13 109.557 -171.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -125.64 106.45 9.75 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.787 -1.19 . . . . 74.66 107.787 171.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . 69.48 -105.09 1.42 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.219 -0.991 . . . . 84.81 111.754 179.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . . . -122.5 21.73 10.12 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.14 0.576 . . . . 80.66 111.15 176.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 2.1 mmtt -117.75 142.67 47.0 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.941 -0.392 . . . . 68.36 109.941 179.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.3 tt -106.82 137.31 45.1 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.077 -0.712 . . . . 56.06 109.077 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -120.44 126.83 51.42 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.551 -0.907 . . . . 70.89 108.551 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.547 HD13 ' HG3' ' B' ' 108' ' ' LYS . 39.2 tp -130.6 120.24 23.69 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.936 -0.764 . . . . 54.73 108.936 -176.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -112.36 111.07 21.67 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.965 -1.124 . . . . 71.6 107.965 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.552 HD23 ' HB3' ' B' ' 106' ' ' TRP . 17.8 mt -94.83 130.45 41.41 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.206 -0.664 . . . . 54.71 109.206 176.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' THR . . . . . 0.489 HG22 HG23 ' B' ' 125' ' ' VAL . 7.3 p -124.73 145.58 49.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.718 0.294 . . . . 57.49 110.5 -169.456 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' CYS . . . . . . . . . . . . . 15.4 t -166.92 120.41 1.01 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.394 -0.821 . . . . 64.99 110.211 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . 56.0 -111.89 2.83 Favored Glycine 0 C--N 1.334 0.47 0 N-CA-C 111.506 -0.638 . . . . 63.73 111.506 -169.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -105.45 -11.71 16.31 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.627 0.603 . . . . 79.55 112.627 173.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -86.19 113.46 22.24 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.874 -0.787 . . . . 63.39 108.874 -175.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' VAL . . . . . 0.489 HG23 HG22 ' B' ' 120' ' ' THR . 9.8 p -108.05 148.46 12.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 108.217 -1.031 . . . . 51.38 108.217 169.249 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' CYS . . . . . . . . . . . . . 5.2 t -125.18 123.65 40.07 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.266 -1.383 . . . . 49.17 107.266 178.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . . . -104.27 126.06 51.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.298 -0.63 . . . . 48.6 109.298 -176.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -127.18 140.59 52.14 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.769 -0.826 . . . . 57.19 108.769 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' VAL . . . . . . . . . . . . . 54.7 t -123.37 136.53 59.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 108.257 -1.016 . . . . 57.32 108.257 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' PHE . . . . . 0.527 ' HB3' ' HB3' ' D' ' 8' ' ' TRP . 49.5 m-85 -123.47 141.52 51.91 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.317 -0.623 . . . . 51.05 109.317 -177.508 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' LYS . . . . . . . . . . . . . . . -104.7 141.0 37.24 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.939 -0.763 . . . . 52.83 108.939 174.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . . . -78.61 133.63 37.27 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.093 -0.643 . . . . 57.51 109.366 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 10.8 tptt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.164 -0.471 . . . . 80.03 110.799 -177.078 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' THR . . . . . 0.619 HG22 ' H ' ' C' ' 2' ' ' ARG . 1.3 m . . . . . 0 CA--C 1.535 0.375 0 N-CA-C 109.605 -0.517 . . . . 78.17 109.605 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' ARG . . . . . 0.619 ' H ' HG22 ' C' ' 1' ' ' THR . . . -84.88 81.03 9.07 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 122.334 1.064 . . . . 81.07 109.7 -171.384 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . . . -163.91 100.15 0.88 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 114.936 -1.029 . . . . 69.42 109.253 169.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -97.35 12.4 33.23 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 113.769 1.026 . . . . 72.7 113.769 -178.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -64.38 137.79 58.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 118.483 0.583 . . . . 72.04 111.233 -175.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.38 -175.6 18.87 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-O 122.169 0.872 . . . . 67.68 112.265 171.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' THR . . . . . 0.468 HG23 HG22 ' C' ' 41' ' ' VAL . 26.8 m -103.57 127.29 51.01 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 114.829 -0.685 . . . . 65.33 109.796 179.51 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' TRP . . . . . 0.49 ' HB3' ' HB3' ' E' ' 130' ' ' PHE . 38.1 m95 -122.86 122.32 38.35 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.374 0.67 . . . . 67.66 109.619 -175.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' GLU . . . . . . . . . . . . . . . -104.06 131.03 51.74 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 122.89 0.476 . . . . 61.16 110.138 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' MET . . . . . . . . . . . . . 47.9 ttm -67.52 144.83 55.45 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.173 0.511 . . . . 55.91 112.063 -175.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -121.46 -21.05 6.39 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 114.488 1.292 . . . . 73.14 114.488 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 17.6 m -146.86 161.8 39.97 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 122.151 0.977 . . . . 61.26 110.624 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -156.54 91.99 1.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 103.886 -2.635 . . . . 64.62 103.886 -176.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -101.44 134.44 44.53 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.177 -0.675 . . . . 77.71 109.177 -175.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 50.12 46.3 24.79 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 122.017 0.913 . . . . 67.83 110.694 -175.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' PHE . . . . . 0.46 ' O ' ' HG3' ' C' ' 20' ' ' MET . 8.3 t80 -74.05 -39.89 63.2 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.433 -0.803 . . . . 69.79 111.039 171.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -71.37 -36.96 71.63 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 119.889 -0.724 . . . . 103.01 111.886 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' GLY . . . . . 0.489 ' C ' ' HG2' ' E' ' 124' ' ' GLN . . . -66.19 -37.54 93.06 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 119.728 -1.225 . . . . 71.95 112.356 174.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -59.05 -44.25 91.77 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 122.449 -0.442 . . . . 69.82 110.986 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' C' ' 16' ' ' PHE . 24.2 mtm -70.41 -31.5 68.73 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.814 -0.354 . . . . 83.19 111.416 177.249 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . . . -60.01 -42.22 93.85 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.797 -0.361 . . . . 72.97 110.776 173.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.83 -28.34 69.95 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.337 -0.545 . . . . 71.68 111.071 174.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' LEU . . . . . . . . . . . . . 28.7 mt -77.5 2.28 16.75 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 112.658 0.614 . . . . 70.27 112.658 175.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 54.06 46.27 25.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.827 0.822 . . . . 82.13 111.745 -177.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' ILE . . . . . 0.443 ' O ' ' HD3' ' C' ' 30' ' ' ARG . 7.4 mt -93.2 162.33 2.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 107.662 -1.236 . . . . 80.7 107.662 173.175 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -90.19 148.46 22.93 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.965 0.906 . . . . 78.7 110.476 -166.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -53.59 -34.67 59.22 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.372 -0.831 . . . . 76.02 111.469 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.1 -58.7 7.48 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.049 0.452 . . . . 81.77 110.988 176.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 1.6 m -71.9 -23.19 61.45 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.705 0.631 . . . . 77.6 112.705 -175.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' ARG . . . . . 0.443 ' HD3' ' O ' ' C' ' 25' ' ' ILE . 2.0 mtm180 -74.84 -41.78 59.21 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 119.747 -0.781 . . . . 79.01 111.775 174.333 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . . . -67.14 -30.83 70.93 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.201 -0.599 . . . . 84.06 111.04 175.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . . . -71.0 -49.37 49.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.508 -0.477 . . . . 82.67 110.647 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.31 -22.91 62.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.414 0.894 . . . . 78.31 113.414 -173.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' VAL . . . . . . . . . . . . . 1.4 p -72.14 -11.78 15.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 113.459 0.911 . . . . 79.95 113.459 -176.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' ARG . . . . . . . . . . . . . . . -104.04 41.41 1.3 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-N 118.35 0.523 . . . . 82.01 112.328 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 11.0 mp -130.34 173.08 11.16 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 121.345 -0.847 . . . . 76.72 109.553 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' THR . . . . . 0.548 HG22 ' O ' ' C' ' 57' ' ' PHE . 2.4 t -143.87 159.42 42.58 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.742 -0.836 . . . . 66.6 108.742 166.605 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -126.56 152.17 46.93 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.134 -0.939 . . . . 68.65 110.238 -169.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 9.0 m -133.76 123.2 24.49 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.141 -1.059 . . . . 70.19 108.141 174.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -109.95 120.37 42.26 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.939 -0.763 . . . . 75.61 108.939 -176.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' VAL . . . . . 0.468 HG22 HG23 ' C' ' 7' ' ' THR . 2.7 t -101.27 114.49 40.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 107.255 -1.387 . . . . 69.72 107.255 172.784 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' ILE . . . . . . . . . . . . . 61.6 mt -106.04 125.99 61.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 N-CA-C 108.074 -1.084 . . . . 74.41 108.074 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.64 117.91 33.6 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.605 -1.257 . . . . 89.92 107.605 171.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -124.27 116.84 23.3 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.711 -0.848 . . . . 72.68 108.711 -171.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -114.95 99.66 7.63 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 106.731 -1.581 . . . . 75.44 106.731 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.25 -108.95 2.42 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.823 -0.703 . . . . 73.94 111.366 -176.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' ASP . . . . . 0.524 ' HB3' HG12 ' E' ' 66' ' ' VAL . 70.7 m-20 -104.65 2.27 30.38 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.979 0.733 . . . . 79.36 112.979 177.8 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -94.41 131.44 40.07 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 122.939 0.495 . . . . 74.91 110.275 179.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -121.73 140.0 52.87 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 122.678 0.391 . . . . 66.81 110.268 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' LYS . . . . . . . . . . . . . . . -133.62 110.25 9.76 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 107.516 -1.29 . . . . 67.78 107.516 173.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' THR . . . . . . . . . . . . . . . -108.69 141.38 40.75 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.808 0.443 . . . . 81.58 109.978 -174.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' LYS . . . . . . . . . . . . . . . -133.3 118.23 18.28 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.038 -1.097 . . . . 79.33 108.038 171.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -107.0 104.81 14.58 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.155 -0.683 . . . . 84.47 109.155 -176.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' THR . . . . . . . . . . . . . 1.3 m -92.55 136.89 32.83 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.549 -0.537 . . . . 83.15 109.549 177.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' SER . . . . . . . . . . . . . 1.2 t -122.69 144.09 49.37 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.008 -0.542 . . . . 90.13 111.003 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' THR . . . . . 0.546 ' OG1' ' N ' ' C' ' 57' ' ' PHE . 1.4 p -135.6 -136.64 0.15 Allowed 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.013 -1.106 . . . . 78.9 108.013 -179.607 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' PHE . . . . . 0.548 ' O ' HG22 ' C' ' 37' ' ' THR . 4.4 m-85 -119.24 -167.73 1.45 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.646 0.736 . . . . 79.73 111.511 -175.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' LEU . . . . . . . . . . . . . . . -79.65 -28.09 40.86 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.474 0.916 . . . . 88.21 113.474 -167.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 56.58 79.06 0.19 Allowed 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.16 -0.681 . . . . 81.67 109.16 178.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' TYR . . . . . . . . . . . . . . . -80.67 120.37 24.5 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.679 0.276 . . . . 85.22 110.776 -177.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.53 140.8 41.37 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.749 0.82 . . . . 92.39 109.898 -177.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . . 2.7 t -133.99 122.7 42.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 108.497 -0.927 . . . . 91.03 108.497 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -119.31 125.45 49.1 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.709 -0.849 . . . . 97.32 108.709 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -156.72 161.98 39.8 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.516 0.674 . . . . 94.4 110.224 -176.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' THR . . . . . . . . . . . . . . . -120.93 135.97 55.07 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.564 -1.273 . . . . 86.08 107.564 165.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' VAL . . . . . 0.481 HG21 HD21 ' C' ' 93' ' ' LEU . 71.2 t -74.79 127.0 36.31 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 N-CA-C 109.502 -0.555 . . . . 97.48 109.502 -172.464 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.46 -21.04 42.45 Favored Glycine 0 N--CA 1.441 -0.989 0 CA-C-O 119.513 -0.604 . . . . 91.88 113.296 -173.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' VAL . . . . . . . . . . . . . 3.2 t -100.11 128.48 52.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 108.125 -1.065 . . . . 94.2 108.125 178.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' GLU . . . . . 0.438 ' HA ' HD12 ' C' ' 85' ' ' LEU . . . -69.49 136.76 51.89 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.289 0.566 . . . . 84.82 112.328 -179.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' PHE . . . . . . . . . . . . . . . -134.19 166.08 23.61 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.885 0.85 . . . . 87.51 109.838 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' ASP . . . . . . . . . . . . . . . -103.64 129.01 50.87 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 114.975 -1.012 . . . . 81.83 109.104 177.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' GLU . . . . . . . . . . . . . . . -118.71 122.0 41.44 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 109.053 -0.721 . . . . 74.9 109.053 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -104.49 103.46 13.16 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.189 -1.041 . . . . 77.34 108.189 172.925 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' THR . . . . . . . . . . . . . . . -80.79 66.07 6.17 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 122.272 1.034 . . . . 73.12 109.916 -175.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' LYS . . . . . . . . . . . . . . . -66.87 -32.67 74.09 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.236 -0.893 . . . . 80.34 111.173 177.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' SER . . . . . . . . . . . . . 36.1 t -49.66 -33.65 16.21 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 118.962 -0.542 . . . . 84.26 111.774 171.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -121.99 -97.01 0.46 Allowed 'General case' 0 C--N 1.35 0.601 0 C-N-CA 117.416 -1.713 . . . . 89.69 110.535 -172.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' ASP . . . . . 0.476 ' HA ' HD13 ' F' ' 25' ' ' ILE . 7.1 p-10 -87.09 2.1 50.84 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.801 0.84 . . . . 85.61 112.523 -171.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 48.99 51.97 15.18 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.562 0.745 . . . . 84.3 111.856 -177.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' ARG . . . . . 0.414 ' NH1' ' HD3' ' C' ' 101' ' ' LYS . 75.0 mtt180 -111.23 156.71 21.04 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.685 0.755 . . . . 95.31 111.398 175.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -100.69 123.51 44.99 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.195 -0.912 . . . . 77.35 109.278 173.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' VAL . . . . . 0.691 HG12 ' HA3' ' C' ' 99' ' ' GLY . 2.6 m -138.17 156.59 30.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 121.579 0.704 . . . . 77.49 109.342 176.255 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' LYS . . . . . . . . . . . . . . . -97.94 117.46 32.33 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.483 -0.781 . . . . 89.38 110.479 175.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' ALA . . . . . . . . . . . . . . . -111.81 155.83 22.94 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.91 1.284 . . . . 90.64 110.443 -173.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' LEU . . . . . 0.438 HD12 ' HA ' ' C' ' 69' ' ' GLU . 12.1 tp -130.21 -54.31 1.11 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 114.134 1.161 . . . . 87.62 114.134 177.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' VAL . . . . . . . . . . . . . . . 67.71 132.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 124.627 1.171 . . . . 94.99 110.095 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' THR . . . . . . . . . . . . . 1.6 m -136.93 159.91 40.48 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.985 0.914 . . . . 97.58 110.604 -176.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' TRP . . . . . . . . . . . . . 26.5 m95 -89.33 119.16 29.55 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.89 -1.05 . . . . 92.14 108.785 171.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' GLU . . . . . 0.427 ' O ' HG22 ' C' ' 92' ' ' VAL . . . -116.52 90.94 3.45 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.386 -2.079 . . . . 83.22 105.386 169.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.06 -110.89 3.52 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.7 -1.36 . . . . 82.37 109.7 -174.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -115.31 25.82 10.55 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 112.415 0.524 . . . . 88.04 112.415 172.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.427 HG22 ' O ' ' C' ' 89' ' ' GLU . 2.7 m -116.68 133.07 64.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 109.043 -0.725 . . . . 82.97 109.043 178.657 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' LEU . . . . . 0.481 HD21 HG21 ' C' ' 66' ' ' VAL . 13.2 mt -90.38 110.25 21.34 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.683 -0.858 . . . . 86.16 108.683 176.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 32.9 t -111.44 123.11 66.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 108.854 -0.795 . . . . 95.45 108.854 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' CYS . . . . . 0.502 ' O ' ' HA3' ' C' ' 105' ' ' GLY . 11.3 t -114.28 132.22 56.23 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.381 1.073 . . . . 96.35 109.645 -175.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -110.46 143.97 19.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 122.723 0.409 . . . . 96.17 110.391 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' GLN . . . . . . . . . . . . . . . -110.91 93.52 4.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 107.532 -1.285 . . . . 98.84 107.532 -179.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' LYS . . . . . . . . . . . . . . . -75.35 125.59 29.29 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.833 -1.173 . . . . 91.88 107.833 175.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' GLY . . . . . 0.691 ' HA3' HG12 ' C' ' 82' ' ' VAL . . . 169.71 -147.12 10.6 Favored Glycine 0 CA--C 1.509 -0.342 0 C-N-CA 119.822 -1.18 . . . . 92.01 110.573 -176.523 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' GLU . . . . . . . . . . . . . . . -60.76 -37.59 82.35 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.856 -0.737 . . . . 96.31 110.462 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' LYS . . . . . 0.488 ' HE3' ' HA ' ' C' ' 101' ' ' LYS . 13.7 mmmt -86.22 131.86 34.13 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 121.935 -0.478 . . . . 103.21 111.579 -179.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -94.36 142.75 27.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.759 -0.655 . . . . 108.97 110.129 178.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' ASN . . . . . . . . . . . . . 60.6 t30 56.8 40.54 28.97 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.639 0.733 . . . . 114.09 109.707 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' ARG . . . . . 0.796 ' HA ' ' HA ' ' C' ' 121' ' ' CYS . . . -104.9 131.03 52.91 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.605 0.762 . . . . 112.48 109.822 -173.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' GLY . . . . . 0.502 ' HA3' ' O ' ' C' ' 95' ' ' CYS . . . 177.27 -159.21 25.28 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 119.878 -1.153 . . . . 91.69 112.707 179.606 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' TRP . . . . . 0.458 ' HB3' HD23 ' C' ' 119' ' ' LEU . 30.7 p-90 -152.8 166.59 31.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.814 -1.193 . . . . 90.26 110.386 178.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' LYS . . . . . . . . . . . . . . . -132.2 140.03 48.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.314 -1.312 . . . . 89.0 109.155 177.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' LYS . . . . . . . . . . . . . 9.1 ttmt -131.28 126.98 36.79 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.852 -0.796 . . . . 82.66 108.852 -176.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' TRP . . . . . . . . . . . . . 18.7 p90 -157.88 163.02 38.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.608 0.718 . . . . 92.47 111.364 174.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' ILE . . . . . 0.642 HD13 ' CH2' ' F' ' 8' ' ' TRP . 1.7 mt -142.11 133.29 25.75 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.858 0 C-N-CA 126.714 2.006 . . . . 95.87 113.331 -170.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -122.75 111.7 17.03 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 126.798 2.039 . . . . 127.24 106.842 169.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' GLY . . . . . . . . . . . . . . . 77.45 -106.42 2.24 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 124.151 0.881 . . . . 94.89 114.966 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -126.63 16.81 7.53 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 114.269 1.211 . . . . 102.33 114.269 -178.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' LYS . . . . . . . . . . . . . . . -120.54 138.57 53.78 Favored 'General case' 0 C--O 1.212 -0.875 0 CA-C-O 123.239 1.495 . . . . 89.62 111.598 -175.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' LEU . . . . . 0.804 ' HB3' ' HB2' ' C' ' 130' ' ' PHE . 0.8 OUTLIER -102.86 135.45 44.5 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 119.146 -2.221 . . . . 86.28 110.257 -173.201 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -120.38 122.8 41.56 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.452 -0.944 . . . . 98.08 108.452 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' LEU . . . . . 0.502 HD22 ' NE2' ' C' ' 128' ' ' GLN . 5.5 tt -132.93 118.82 19.36 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.021 -1.474 . . . . 82.9 107.021 -176.347 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' GLU . . . . . . . . . . . . . . . -113.94 110.51 20.2 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.798 -0.816 . . . . 86.13 108.798 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' LEU . . . . . 0.458 HD23 ' HB3' ' C' ' 106' ' ' TRP . 45.2 mt -96.39 131.05 43.34 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 108.606 -0.887 . . . . 87.12 108.606 173.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' THR . . . . . 0.537 HG23 HG22 ' C' ' 125' ' ' VAL . 23.7 m -129.89 -58.26 1.09 Allowed 'General case' 0 C--O 1.239 0.524 0 C-N-CA 115.202 -2.599 . . . . 103.18 116.624 -171.016 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' CYS . . . . . 0.796 ' HA ' ' HA ' ' C' ' 104' ' ' ARG . 6.8 t 62.62 -113.41 0.45 Allowed 'General case' 0 C--O 1.243 0.74 0 N-CA-C 106.201 -1.777 . . . . 104.58 106.201 -179.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' GLY . . . . . 0.432 ' N ' ' SG ' ' C' ' 121' ' ' CYS . . . -86.68 -102.05 0.79 Allowed Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 119.888 1.222 . . . . 107.35 112.75 -173.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -92.65 178.86 5.67 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 123.965 0.906 . . . . 114.49 109.02 176.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' GLN . . . . . . . . . . . . . . . 44.32 115.38 0.0 OUTLIER 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.767 1.227 . . . . 98.4 112.587 -177.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' VAL . . . . . 0.537 HG22 HG23 ' C' ' 120' ' ' THR . 9.2 t -95.68 148.2 5.39 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-O 121.24 0.543 . . . . 96.88 109.705 177.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 126' ' ' CYS . . . . . 0.512 ' HG ' ' HD1' ' F' ' 16' ' ' PHE . 2.7 t -122.09 121.05 36.06 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 108.683 -0.858 . . . . 88.72 108.683 178.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 127' ' ' ARG . . . . . . . . . . . . . . . -106.86 127.62 53.57 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.264 1.026 . . . . 85.29 108.566 -178.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 128' ' ' GLN . . . . . 0.502 ' NE2' HD22 ' C' ' 117' ' ' LEU . 20.1 mt-30 -126.9 140.29 52.44 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.498 -0.927 . . . . 84.97 108.498 179.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 129' ' ' VAL . . . . . 0.507 ' HA ' ' O ' ' C' ' 115' ' ' LEU . 29.4 m -123.58 137.99 54.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 108.018 -1.104 . . . . 78.3 108.018 178.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 130' ' ' PHE . . . . . 0.804 ' HB2' ' HB3' ' C' ' 115' ' ' LEU . 49.5 m-85 -123.82 145.4 49.09 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.568 0.747 . . . . 79.21 109.896 -174.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 131' ' ' LYS . . . . . 0.429 ' N ' ' O ' ' F' ' 9' ' ' GLU . 1.1 mmtp -103.07 137.37 41.33 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.379 -0.6 . . . . 78.99 109.379 175.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -81.81 133.66 35.35 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.252 -1.018 . . . . 87.46 108.252 175.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 133' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.375 -0.375 . . . . 103.13 111.252 -176.655 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.918 0.389 . . . . 72.63 111.27 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' ARG . . . . . . . . . . . . . 52.2 mtt180 -94.47 12.65 26.53 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 112.694 0.627 . . . . 74.6 112.694 177.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -103.64 103.17 13.06 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.601 -0.518 . . . . 78.47 109.601 -171.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -96.2 11.17 35.36 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.586 0.588 . . . . 63.87 112.586 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' D' ' 44' ' ' GLN . 34.2 m-80 -66.0 139.48 58.22 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.033 0.444 . . . . 77.28 111.637 -175.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.85 -174.98 19.3 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-O 121.909 0.727 . . . . 57.35 112.354 170.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' THR . . . . . . . . . . . . . 92.8 m -102.72 127.81 49.7 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.044 -0.725 . . . . 61.46 109.044 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' TRP . . . . . 0.527 ' HB3' ' HB3' ' B' ' 130' ' ' PHE . 70.7 m95 -120.86 122.43 40.25 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.457 -0.571 . . . . 56.22 109.457 -174.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -103.06 129.39 49.85 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.917 -0.772 . . . . 59.09 108.917 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' MET . . . . . . . . . . . . . 45.8 ttm -68.15 141.65 55.97 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.368 0.604 . . . . 58.86 111.138 -174.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -123.77 -18.6 6.0 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 113.514 0.931 . . . . 68.77 113.514 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -141.42 157.3 45.35 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.995 0.816 . . . . 67.06 109.742 177.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -161.92 91.75 0.82 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 107.154 -1.425 . . . . 50.72 107.154 -176.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' GLU . . . . . . . . . . . . . . . -104.24 134.8 46.87 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.17 -0.468 . . . . 53.95 110.744 -175.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' ASN . . . . . . . . . . . . . 28.8 t30 49.64 47.51 22.68 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.874 0.87 . . . . 53.0 111.977 -178.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -73.39 -39.49 65.05 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 120.072 -0.651 . . . . 51.45 110.973 171.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -69.61 -38.4 77.26 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 120.48 -0.488 . . . . 68.63 111.202 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.89 -39.54 95.04 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.92 -1.133 . . . . 47.61 112.491 175.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -60.06 -43.74 95.21 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.339 -0.507 . . . . 51.42 111.072 175.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' MET . . . . . . . . . . . . . 60.7 mtm -69.26 -34.91 75.51 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.718 -0.793 . . . . 50.85 111.325 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -60.51 -42.69 96.9 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 122.049 -0.407 . . . . 57.84 111.168 174.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.31 -28.99 70.39 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.312 -0.555 . . . . 51.02 111.725 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' LEU . . . . . . . . . . . . . 24.8 mt -77.9 3.54 14.25 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.479 0.918 . . . . 55.1 113.479 177.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 55.47 51.4 12.9 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.926 0.869 . . . . 59.65 110.75 -177.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' ILE . . . . . . . . . . . . . 3.5 mm -87.68 158.79 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 108.333 -0.988 . . . . 48.41 108.333 176.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -96.53 144.33 26.71 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.551 -0.907 . . . . 53.52 108.551 -171.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -40.92 -45.93 2.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.089 -0.96 . . . . 46.82 113.242 -177.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' ALA . . . . . 0.5 ' O ' HG13 ' D' ' 32' ' ' ILE . . . -57.19 -59.83 4.51 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.782 -0.367 . . . . 40.14 111.456 -179.389 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' THR . . . . . . . . . . . . . 14.8 p -72.02 -18.83 61.93 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.906 -0.718 . . . . 42.8 112.403 -176.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' ARG . . . . . . . . . . . . . 43.7 mtm-85 -70.1 -42.31 72.86 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.867 -0.733 . . . . 42.93 110.403 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' LYS . . . . . 0.499 ' HB3' HG23 ' A' ' 29' ' ' THR . 11.6 mmtm -67.91 -29.45 68.54 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.657 -0.247 . . . . 52.93 111.606 176.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' ILE . . . . . 0.5 HG13 ' O ' ' D' ' 28' ' ' ALA . 63.8 mt -68.92 -51.39 45.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 119.784 -0.767 . . . . 44.42 110.265 176.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.59 -24.23 62.72 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.921 0.712 . . . . 43.63 112.921 -173.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' VAL . . . . . . . . . . . . . 1.4 p -73.24 -14.45 16.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 112.762 0.653 . . . . 45.79 112.762 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' ARG . . . . . . . . . . . . . 8.0 mtp85 -105.84 37.73 2.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 118.384 0.538 . . . . 42.27 111.807 176.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 82.1 mt -131.96 171.01 14.1 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 122.368 1.08 . . . . 45.08 111.015 -177.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' THR . . . . . . . . . . . . . 11.1 t -141.04 156.41 46.02 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 113.58 -1.645 . . . . 43.57 107.007 167.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -127.49 149.82 49.95 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.251 -0.886 . . . . 43.02 110.507 -170.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' THR . . . . . . . . . . . . . 58.1 p -133.45 125.11 28.3 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.156 -1.424 . . . . 51.92 107.156 172.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -108.37 122.78 47.69 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.177 -0.675 . . . . 58.99 109.177 -175.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' VAL . . . . . . . . . . . . . 41.0 t -98.33 112.43 30.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 106.608 -1.627 . . . . 51.05 106.608 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' ILE . . . . . 0.45 HD12 ' CD1' ' D' ' 8' ' ' TRP . 11.4 mt -108.89 125.83 65.9 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 N-CA-C 108.151 -1.055 . . . . 59.5 108.151 -177.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -113.03 116.11 29.41 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.531 -1.285 . . . . 83.3 107.531 170.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' GLN . . . . . 0.413 ' N ' ' OD1' ' D' ' 5' ' ' ASN . 29.7 tt0 -126.31 117.64 23.43 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.458 -0.571 . . . . 68.51 109.458 -170.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -115.68 99.91 7.66 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.147 -1.427 . . . . 76.97 107.147 174.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.33 -109.52 2.79 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 111.505 -0.638 . . . . 72.69 111.505 -177.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -104.14 3.68 33.28 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.691 0.626 . . . . 73.7 112.691 176.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' ASN . . . . . 0.904 ' HA ' HG22 ' B' ' 65' ' ' THR . 10.8 m-80 -91.99 127.95 37.65 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.04 -0.726 . . . . 73.0 109.04 177.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -122.8 138.92 54.5 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.568 0.347 . . . . 64.4 110.541 -176.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt -134.55 108.74 8.25 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.5 -1.296 . . . . 70.18 107.5 172.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' THR . . . . . . . . . . . . . 6.2 m -109.49 141.8 41.43 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.733 -0.469 . . . . 54.11 109.733 -175.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -132.06 117.55 18.5 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 108.593 -0.892 . . . . 68.47 108.593 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -107.46 104.45 14.03 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.326 -0.62 . . . . 45.55 109.326 -175.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' THR . . . . . . . . . . . . . 17.5 p -93.48 137.75 32.46 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.309 -0.626 . . . . 41.53 109.309 176.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' SER . . . . . . . . . . . . . 56.7 p -122.32 139.77 53.43 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.148 -0.478 . . . . 39.67 111.326 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t -143.36 -178.08 5.69 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 107.432 -1.322 . . . . 56.14 107.432 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -84.93 141.63 30.24 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 120.556 -0.457 . . . . 36.42 111.29 -173.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 pp -83.69 123.68 30.08 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.942 -0.762 . . . . 49.51 108.942 -174.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -56.94 145.55 29.71 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.567 0.699 . . . . 50.09 111.387 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -110.26 127.9 55.23 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.491 -0.777 . . . . 59.77 109.471 177.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -108.16 138.34 44.59 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.929 0.492 . . . . 61.04 110.98 -176.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 62' ' ' VAL . . . . . . . . . . . . . . . -137.15 117.81 17.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 106.711 -1.588 . . . . 54.45 106.711 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 63' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -121.41 128.32 52.06 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.011 -0.737 . . . . 63.11 109.011 -179.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 64' ' ' PHE . . . . . . . . . . . . . 55.6 p90 -153.44 163.0 40.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.488 0.661 . . . . 47.89 110.031 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 65' ' ' THR . . . . . . . . . . . . . 32.3 m -121.26 142.8 49.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.953 -1.021 . . . . 50.9 108.996 170.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 t -67.94 123.55 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 CA-C-N 115.294 -0.867 . . . . 44.68 108.883 -175.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.84 -17.22 57.65 Favored Glycine 0 N--CA 1.436 -1.359 0 O-C-N 121.461 -0.775 . . . . 47.21 114.662 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' VAL . . . . . . . . . . . . . 94.3 t -97.31 123.27 49.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 108.326 -0.99 . . . . 47.67 108.326 -178.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' GLU . . . . . . . . . . . . . 55.7 tt0 -73.03 134.41 44.62 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.576 -0.45 . . . . 57.09 109.961 176.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -135.52 168.7 18.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.494 0.664 . . . . 49.15 109.534 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -100.31 125.93 46.58 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.866 -0.79 . . . . 58.93 108.866 178.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 72' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -121.52 123.94 43.21 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 109.481 -0.563 . . . . 60.58 109.481 -177.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 73' ' ' TYR . . . . . 0.457 ' CZ ' ' HB2' ' D' ' 81' ' ' HIS . 24.9 m-85 -102.63 106.11 16.71 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.449 -1.315 . . . . 70.67 107.449 171.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' THR . . . . . . . . . . . . . 40.7 p -76.73 70.07 3.17 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 122.43 1.11 . . . . 50.21 110.054 -172.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -63.67 -28.46 69.92 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.919 -1.037 . . . . 66.91 111.228 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -52.63 -36.18 56.14 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.296 0.48 . . . . 54.27 112.296 173.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' LEU . . . . . . . . . . . . . 48.5 mt -124.09 -102.51 0.38 Allowed 'General case' 0 C--O 1.236 0.384 0 O-C-N 122.108 -0.37 . . . . 46.57 110.563 -166.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -89.56 1.25 56.21 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.362 0.875 . . . . 48.99 113.362 -171.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 48.95 52.82 13.59 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.815 0.817 . . . . 69.96 111.45 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' ARG . . . . . . . . . . . . . 33.0 mtt85 -109.12 157.58 18.61 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.676 -0.693 . . . . 52.64 110.145 175.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' HIS . . . . . 0.457 ' HB2' ' CZ ' ' D' ' 73' ' ' TYR . 13.8 t60 -97.27 124.62 41.43 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.498 -0.773 . . . . 63.95 108.965 175.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' VAL . . . . . 0.488 HG21 ' HB3' ' D' ' 97' ' ' GLN . 19.8 m -134.9 153.97 35.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 108.486 -0.931 . . . . 43.77 108.486 176.816 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -97.35 113.97 25.69 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.746 -1.575 . . . . 55.68 106.746 173.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' ALA . . . . . . . . . . . . . . . -109.6 140.87 42.9 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.048 0.451 . . . . 41.15 110.275 -171.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' LEU . . . . . . . . . . . . . 14.0 tp -137.93 132.62 32.67 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.069 -0.969 . . . . 42.7 109.044 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 t -113.24 138.37 43.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.853 -0.795 . . . . 41.74 108.853 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' THR . . . . . . . . . . . . . 15.9 p -132.43 157.8 43.65 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.701 0.8 . . . . 52.41 109.536 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -93.06 120.7 33.64 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.162 -0.926 . . . . 50.41 109.453 172.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -115.2 89.7 3.16 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 105.869 -1.9 . . . . 53.62 105.869 169.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' GLY . . . . . . . . . . . . . . . 70.42 -110.63 3.38 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.522 -0.847 . . . . 50.11 111.179 -174.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -112.89 27.85 9.28 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.288 0.635 . . . . 69.97 110.835 172.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' VAL . . . . . . . . . . . . . 96.4 t -114.57 130.63 68.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.012 -0.736 . . . . 45.39 109.012 -178.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' LEU . . . . . . . . . . . . . 34.1 mt -90.3 111.89 23.25 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 106.882 -1.525 . . . . 39.13 106.882 173.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -108.6 120.0 59.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 107.988 -1.116 . . . . 48.62 107.988 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' CYS . . . . . . . . . . . . . 36.1 t -117.06 127.98 54.7 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.647 -0.871 . . . . 34.67 108.647 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' VAL . . . . . . . . . . . . . 95.8 t -108.46 132.14 57.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.36 -1.348 . . . . 38.18 107.36 174.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' GLN . . . . . 0.604 ' HB2' ' HG2' ' D' ' 104' ' ' ARG . 46.2 mt-30 -115.54 93.2 4.18 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 106.994 -1.484 . . . . 39.98 106.994 -179.501 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' LYS . . . . . . . . . . . . . 27.4 mttp -74.88 133.7 41.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.259 -0.428 . . . . 57.58 110.065 179.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 99' ' ' GLY . . . . . . . . . . . . . . . 175.43 -151.47 12.05 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.95 -0.568 . . . . 46.86 112.894 -178.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 100' ' ' GLU . . . . . . . . . . . . . . . -65.0 -39.29 93.24 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.684 -0.407 . . . . 53.92 111.824 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -82.81 137.18 34.42 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.113 0.482 . . . . 53.49 111.637 -176.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -89.12 144.59 26.02 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.726 -0.67 . . . . 72.7 110.287 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 60.38 41.17 16.52 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.552 -0.749 . . . . 73.4 111.506 177.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' ARG . . . . . 0.604 ' HG2' ' HB2' ' D' ' 97' ' ' GLN . 12.0 ttt180 -104.93 127.79 52.92 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.289 -0.634 . . . . 42.39 109.289 -176.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' GLY . . . . . . . . . . . . . . . 174.62 -161.19 30.83 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 109.929 -1.269 . . . . 41.54 109.929 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' TRP . . . . . 0.426 ' HB3' HD23 ' D' ' 119' ' ' LEU . 38.4 p-90 -157.76 165.59 34.96 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 118.947 -1.101 . . . . 40.1 110.269 174.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -133.62 137.42 45.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.6 -1.182 . . . . 56.97 109.103 175.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' LYS . . . . . 0.497 ' HD3' HD13 ' D' ' 117' ' ' LEU . 4.3 ttpt -133.1 132.03 41.24 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.244 -0.435 . . . . 55.52 110.017 -176.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' TRP . . . . . . . . . . . . . 22.3 p90 -153.99 168.18 27.29 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.378 -0.601 . . . . 48.31 109.378 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' ILE . . . . . . . . . . . . . 84.3 mt -123.47 131.26 73.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 108.597 -0.89 . . . . 57.86 108.597 -175.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -126.7 116.94 21.74 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 109.046 -0.724 . . . . 87.91 109.046 172.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 112' ' ' GLY . . . . . . . . . . . . . . . 71.97 -106.87 2.03 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 110.697 -0.961 . . . . 66.15 110.697 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 113' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -123.52 17.82 9.66 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 122.764 -0.257 . . . . 70.56 111.24 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 19.2 mtpt -124.05 145.48 49.2 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.492 0.663 . . . . 62.6 111.335 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 115' ' ' LEU . . . . . . . . . . . . . 8.3 tt -102.69 137.51 40.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.028 -0.987 . . . . 50.18 109.73 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 116' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -119.37 127.91 53.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 123.667 0.787 . . . . 61.48 109.009 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 117' ' ' LEU . . . . . 0.497 HD13 ' HD3' ' D' ' 108' ' ' LYS . 44.6 tp -130.66 120.6 24.17 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.369 -0.975 . . . . 36.99 108.369 -177.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 118' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -111.69 111.01 21.69 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.167 -1.42 . . . . 60.42 107.167 177.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 119' ' ' LEU . . . . . 0.426 HD23 ' HB3' ' D' ' 106' ' ' TRP . 8.8 mt -95.06 129.01 42.32 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.818 -0.808 . . . . 41.41 108.818 175.978 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 120' ' ' THR . . . . . 0.528 HG23 HG22 ' D' ' 125' ' ' VAL . 9.5 m -129.46 146.58 51.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.011 0.434 . . . . 45.49 110.655 -170.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 121' ' ' CYS . . . . . . . . . . . . . 13.8 t -168.33 154.05 6.89 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 107.399 -1.334 . . . . 49.93 107.399 169.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 122' ' ' GLY . . . . . . . . . . . . . . . 33.27 -111.17 0.06 OUTLIER Glycine 0 C--N 1.335 0.481 0 CA-C-N 115.812 -0.631 . . . . 54.35 112.788 -164.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 123' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' D' ' 123' ' ' ASP . 9.9 p-10 -105.64 -10.81 16.61 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.455 0.909 . . . . 65.71 113.455 174.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 124' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -86.39 118.18 25.66 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.043 0.537 . . . . 50.14 110.618 -175.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 125' ' ' VAL . . . . . 0.528 HG22 HG23 ' D' ' 120' ' ' THR . 12.3 t -104.33 146.49 11.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 C-N-CA 124.28 1.032 . . . . 41.68 108.908 170.188 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 126' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -127.23 123.19 35.96 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 107.673 -1.232 . . . . 42.78 107.673 178.404 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 127' ' ' ARG . . . . . . . . . . . . . . . -106.05 124.89 50.29 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.169 -0.678 . . . . 40.29 109.169 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 128' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -129.69 140.09 51.2 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.211 -0.662 . . . . 41.71 109.211 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 129' ' ' VAL . . . . . 0.47 HG12 ' HB2' ' A' ' 12' ' ' SER . 2.4 p -126.75 138.54 54.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.375 -0.972 . . . . 44.93 108.375 176.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 130' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -121.42 145.6 47.76 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.455 1.102 . . . . 45.31 109.248 -176.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 131' ' ' LYS . . . . . 0.655 ' HD2' ' OE2' ' A' ' 11' ' ' GLU . 44.4 tttp -101.82 142.02 33.78 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.772 -0.649 . . . . 68.84 109.538 174.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 132' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -78.28 135.13 37.48 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.909 -0.587 . . . . 58.62 109.736 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 133' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.827 -0.624 . . . . 71.84 111.05 -177.308 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 1' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 CA--C 1.536 0.43 0 CA-C-O 121.924 0.868 . . . . 109.92 110.396 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 2' ' ' ARG . . . . . . . . . . . . . 13.2 ttt-85 -106.85 -7.18 17.23 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.943 -1.48 . . . . 99.67 113.373 -175.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 3' ' ' ASP . . . . . . . . . . . . . . . -99.87 104.3 15.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.566 0.621 . . . . 93.84 109.757 -169.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 4' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -95.89 12.33 30.64 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.008 0.744 . . . . 94.21 113.008 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 5' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 -63.02 137.35 58.24 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.22 0.533 . . . . 102.43 112.374 -172.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 6' ' ' GLY . . . . . . . . . . . . . . . 127.15 -177.41 17.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-O 122.181 0.878 . . . . 92.85 112.396 169.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 7' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' E' ' 40' ' ' ASP . 3.7 p -103.81 129.18 51.23 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.888 -0.656 . . . . 101.87 109.344 179.12 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 8' ' ' TRP . . . . . 0.504 ' O ' ' HA ' ' E' ' 39' ' ' THR . 30.2 m95 -119.38 124.84 47.57 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 123.763 0.825 . . . . 102.95 109.295 -173.69 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 9' ' ' GLU . . . . . 0.518 ' O ' ' N ' ' F' ' 131' ' ' LYS . . . -101.27 131.26 47.38 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.367 0.667 . . . . 84.29 109.748 -178.72 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 10' ' ' MET . . . . . 0.504 ' HA ' ' HA ' ' F' ' 130' ' ' PHE . 11.0 ttp -66.41 145.95 55.11 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.854 0.835 . . . . 89.09 112.761 -172.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 11' ' ' GLU . . . . . . . . . . . . . . . -122.66 -19.52 6.25 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 114.092 1.145 . . . . 90.0 114.092 174.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 12' ' ' SER . . . . . . . . . . . . . 4.5 t -144.19 159.03 43.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 119.134 0.879 . . . . 82.51 110.919 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 13' ' ' ASN . . . . . 0.596 ' OD1' ' HB2' ' E' ' 16' ' ' PHE . 38.1 t-20 -160.98 90.36 0.83 Allowed 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 107.522 -1.288 . . . . 83.53 107.522 179.215 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 14' ' ' GLU . . . . . . . . . . . . . . . -105.64 135.05 47.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.904 -0.589 . . . . 74.84 110.082 -177.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 15' ' ' ASN . . . . . . . . . . . . . . . 50.96 48.33 23.24 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.727 0.775 . . . . 83.5 112.434 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 16' ' ' PHE . . . . . 0.596 ' HB2' ' OD1' ' E' ' 13' ' ' ASN . 3.3 t80 -71.59 -37.22 71.01 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.913 -0.715 . . . . 79.57 110.344 169.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 17' ' ' GLU . . . . . . . . . . . . . . . -68.94 -37.67 79.0 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 116.48 -0.327 . . . . 92.96 111.424 -176.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.88 -39.51 95.04 Favored Glycine 0 C--N 1.335 0.487 0 C-N-CA 119.512 -1.328 . . . . 89.06 112.353 174.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 19' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -58.6 -46.56 86.74 Favored 'General case' 0 C--O 1.245 0.861 0 O-C-N 122.125 -0.633 . . . . 90.96 110.469 174.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 20' ' ' MET . . . . . . . . . . . . . 63.5 mtm -68.34 -35.67 78.11 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.456 -0.497 . . . . 88.43 111.438 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 21' ' ' LYS . . . . . . . . . . . . . . . -61.7 -43.88 98.01 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 122.156 -0.34 . . . . 91.8 111.216 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.09 -30.58 71.63 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.618 -0.833 . . . . 95.52 111.39 175.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 23' ' ' LEU . . . . . . . . . . . . . 2.8 mt -79.83 4.03 17.79 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.96 1.096 . . . . 92.69 113.96 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 24' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 56.34 50.27 13.55 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.901 0.773 . . . . 98.13 111.738 -177.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 25' ' ' ILE . . . . . . . . . . . . . 35.6 mt -92.24 161.37 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 122.001 0.905 . . . . 92.7 109.815 175.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 26' ' ' ASP . . . . . . . . . . . . . 16.4 p30 -76.32 170.75 15.75 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 125.603 1.561 . . . . 96.82 111.037 -169.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 27' ' ' PHE . . . . . . . . . . . . . . . -73.86 -38.63 64.41 Favored 'General case' 0 C--O 1.243 0.745 0 CA-C-N 115.519 -0.764 . . . . 89.89 110.632 174.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.75 -59.25 5.5 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 111.597 0.221 . . . . 91.86 111.597 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 29' ' ' THR . . . . . 0.722 ' HA ' HD12 ' E' ' 32' ' ' ILE . 6.6 m -73.56 -16.38 61.26 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 118.801 -1.16 . . . . 88.59 112.569 -177.828 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 30' ' ' ARG . . . . . . . . . . . . . . . -70.01 -45.6 66.9 Favored 'General case' 0 C--O 1.248 0.987 0 C-N-CA 118.446 -1.302 . . . . 85.4 110.68 171.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 31' ' ' LYS . . . . . . . . . . . . . . . -65.63 -29.79 70.41 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.875 -0.602 . . . . 86.87 110.731 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 32' ' ' ILE . . . . . 0.722 HD12 ' HA ' ' E' ' 29' ' ' THR . 31.9 mt -73.64 -48.94 38.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.604 0.716 . . . . 92.07 109.114 178.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 33' ' ' ALA . . . . . 0.442 ' HA ' ' CD1' ' E' ' 36' ' ' LEU . . . -70.8 -25.87 63.06 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.209 1.404 . . . . 87.86 114.551 -169.152 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 34' ' ' VAL . . . . . . . . . . . . . 10.1 m -74.89 -9.44 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 114.545 -2.862 . . . . 86.52 113.979 -178.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 35' ' ' ARG . . . . . . . . . . . . . . . -107.79 39.34 1.95 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.502 1.668 . . . . 95.26 115.502 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 36' ' ' LEU . . . . . 0.442 ' CD1' ' HA ' ' E' ' 33' ' ' ALA . 3.0 mp -134.61 176.33 8.73 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 120.515 -1.366 . . . . 92.94 110.727 -179.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 37' ' ' THR . . . . . . . . . . . . . 4.5 p -138.87 161.3 37.62 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 114.615 -1.175 . . . . 83.15 107.914 168.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 38' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -127.52 152.33 47.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.278 0.561 . . . . 88.11 110.413 -172.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 39' ' ' THR . . . . . 0.504 ' HA ' ' O ' ' E' ' 8' ' ' TRP . 43.4 m -131.38 123.92 29.23 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.268 -1.012 . . . . 84.69 108.268 175.747 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 40' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' E' ' 7' ' ' THR . 39.7 m-20 -111.42 126.37 54.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.173 -0.467 . . . . 92.26 111.159 -173.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 41' ' ' VAL . . . . . 0.654 ' HB ' ' HB2' ' E' ' 52' ' ' LYS . 21.7 t -94.77 115.04 32.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 124.907 1.283 . . . . 87.13 108.588 176.55 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 42' ' ' ILE . . . . . . . . . . . . . 2.1 mm -108.6 122.46 63.18 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 108.635 -0.876 . . . . 88.34 108.635 -177.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 43' ' ' ASP . . . . . . . . . . . . . . . -116.96 113.79 22.89 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 106.652 -1.611 . . . . 82.57 106.652 167.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 44' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -129.3 117.74 21.15 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.769 -0.456 . . . . 86.43 109.769 -173.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 45' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -116.74 103.03 9.93 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.62 -1.252 . . . . 86.08 107.62 173.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 46' ' ' GLY . . . . . . . . . . . . . . . 65.74 -111.49 4.21 Favored Glycine 0 C--N 1.331 0.28 0 N-CA-C 114.457 0.543 . . . . 89.33 114.457 -176.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 47' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -104.33 1.81 30.72 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 117.528 0.664 . . . . 82.03 112.694 177.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 48' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -93.55 130.31 39.46 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.882 -0.785 . . . . 80.81 108.882 177.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 49' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -120.52 139.13 53.36 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.413 -0.588 . . . . 77.06 109.413 -175.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -134.38 110.12 9.24 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.261 -1.014 . . . . 86.16 108.261 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 51' ' ' THR . . . . . 0.497 ' O ' ' HD3' ' E' ' 52' ' ' LYS . 6.3 p -108.26 147.07 31.94 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.416 1.086 . . . . 79.4 112.395 -171.042 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 52' ' ' LYS . . . . . 0.654 ' HB2' ' HB ' ' E' ' 41' ' ' VAL . 1.7 mppt? -130.21 115.87 17.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.055 -0.975 . . . . 85.76 108.935 172.04 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 53' ' ' ALA . . . . . . . . . . . . . . . -108.57 100.81 10.03 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.009 -0.737 . . . . 89.51 109.009 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 54' ' ' THR . . . . . . . . . . . . . 22.8 m -93.22 144.31 25.42 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.36 0.664 . . . . 99.72 109.269 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 55' ' ' SER . . . . . . . . . . . . . 6.4 t -111.96 140.56 46.52 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.337 -0.616 . . . . 88.39 109.337 -178.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -140.37 148.94 42.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.957 0.903 . . . . 90.29 109.734 -172.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 57' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -81.44 162.07 23.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 107.853 -1.165 . . . . 84.39 107.853 176.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 58' ' ' LEU . . . . . . . . . . . . . . . -80.35 167.84 19.74 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 116.797 -1.961 . . . . 100.81 110.569 -170.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 59' ' ' ASN . . . . . . . . . . . . . . . -105.73 115.72 30.72 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.764 -1.198 . . . . 98.5 107.764 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 60' ' ' TYR . . . . . . . . . . . . . . . -54.85 -59.23 5.02 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 123.458 0.474 . . . . 93.23 110.812 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 61' ' ' ASP . . . . . . . . . . . . . 7.5 t0 59.6 128.15 0.01 OUTLIER 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.589 1.556 . . . . 86.15 111.608 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 62' ' ' VAL . . . . . . . . . . . . . 41.0 t -141.58 121.98 12.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 107.765 -1.198 . . . . 77.64 107.765 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 63' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -119.63 125.95 49.98 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.597 -0.89 . . . . 75.24 108.597 177.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 64' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -155.05 162.06 41.15 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.499 0.666 . . . . 62.46 109.564 -176.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 65' ' ' THR . . . . . 0.464 ' O ' HG22 ' E' ' 68' ' ' VAL . 4.6 m -121.07 140.46 51.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.067 -0.97 . . . . 69.77 108.517 169.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 66' ' ' VAL . . . . . 0.524 HG12 ' HB3' ' C' ' 47' ' ' ASP . 13.8 p -71.96 127.36 33.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 C-N-CA 119.964 -0.694 . . . . 66.14 109.188 -174.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 67' ' ' GLY . . . . . . . . . . . . . . . 102.75 -21.03 41.93 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-O 119.264 -0.742 . . . . 75.61 114.449 -175.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 68' ' ' VAL . . . . . 0.464 HG22 ' O ' ' E' ' 65' ' ' THR . 2.8 m -99.85 126.89 53.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 118.187 0.994 . . . . 70.6 108.597 179.11 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 69' ' ' GLU . . . . . . . . . . . . . . . -71.9 137.19 47.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.95 -0.568 . . . . 75.68 109.975 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 70' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -131.92 167.28 19.89 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 122.045 0.926 . . . . 76.04 109.785 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.79 125.34 45.7 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 114.449 -1.251 . . . . 81.15 109.281 -179.114 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 72' ' ' GLU . . . . . 0.453 ' OE2' ' NE2' ' E' ' 97' ' ' GLN . 33.6 tt0 -122.21 122.92 40.28 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 110.029 -0.36 . . . . 74.49 110.029 -177.597 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 73' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -103.15 104.94 15.14 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 107.47 -1.308 . . . . 78.05 107.47 170.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 74' ' ' THR . . . . . . . . . . . . . 16.3 p -77.28 68.68 3.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 122.666 1.222 . . . . 79.11 108.781 -174.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 75' ' ' LYS . . . . . . . . . . . . . . . -65.47 -27.22 68.35 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 114.554 -1.203 . . . . 87.44 112.043 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 76' ' ' SER . . . . . . . . . . . . . 73.1 m -56.89 -34.86 68.3 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 112.303 0.483 . . . . 86.57 112.303 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 77' ' ' LEU . . . . . . . . . . . . . 37.0 mt -122.24 -100.9 0.41 Allowed 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.967 -0.458 . . . . 87.13 109.905 -165.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 78' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -90.37 0.04 57.44 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.679 1.192 . . . . 86.73 113.953 -170.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 79' ' ' ASN . . . . . . . . . . . . . 1.7 m120 45.66 54.93 7.23 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 124.113 0.965 . . . . 93.71 111.33 -176.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 80' ' ' ARG . . . . . 0.57 HH12 ' HE2' ' E' ' 101' ' ' LYS . 85.1 mtt180 -107.91 155.52 20.2 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.049 -1.093 . . . . 76.72 108.049 171.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 81' ' ' HIS . . . . . . . . . . . . . 13.1 t-160 -96.49 126.32 41.59 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 107.897 -1.149 . . . . 73.57 107.897 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 82' ' ' VAL . . . . . . . . . . . . . 22.1 m -133.43 151.95 34.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.764 0.792 . . . . 70.33 108.997 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 83' ' ' LYS . . . . . . . . . . . . . . . -98.43 112.07 24.21 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.001 -1.852 . . . . 67.66 106.001 171.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 84' ' ' ALA . . . . . . . . . . . . . . . -113.04 140.19 48.04 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.135 -0.321 . . . . 61.79 110.135 -173.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 85' ' ' LEU . . . . . . . . . . . . . 4.3 tt -139.46 139.53 37.05 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.958 -0.756 . . . . 66.35 108.958 173.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 86' ' ' VAL . . . . . . . . . . . . . 4.1 m -114.86 139.95 38.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 N-CA-C 109.094 -0.706 . . . . 65.21 109.094 -178.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 87' ' ' THR . . . . . . . . . . . . . 8.5 p -133.44 160.99 35.76 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.902 0.858 . . . . 59.09 109.634 176.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 88' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -87.86 122.25 31.27 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 114.439 -1.255 . . . . 63.2 109.593 176.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -113.66 88.03 2.75 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.959 -1.867 . . . . 58.22 105.959 172.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 90' ' ' GLY . . . . . . . . . . . . . . . 69.55 -110.99 3.61 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.205 -1.158 . . . . 62.76 110.205 -173.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 91' ' ' ASP . . . . . 0.427 ' N ' ' OD1' ' E' ' 91' ' ' ASP . 10.0 p-10 -114.39 27.27 9.59 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.21 0.604 . . . . 66.84 111.328 171.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 92' ' ' VAL . . . . . . . . . . . . . 41.5 t -115.88 132.91 63.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 108.804 -0.813 . . . . 57.35 108.804 -179.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 93' ' ' LEU . . . . . . . . . . . . . 5.2 tp -88.72 111.32 21.83 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.138 -1.06 . . . . 59.08 108.138 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -110.16 122.76 65.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 108.545 -0.909 . . . . 56.77 108.545 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 95' ' ' CYS . . . . . . . . . . . . . 48.2 t -116.3 129.74 56.42 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.271 0.628 . . . . 56.62 109.566 -177.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 96' ' ' VAL . . . . . . . . . . . . . 9.9 t -108.54 131.99 57.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 N-CA-C 107.863 -1.162 . . . . 60.57 107.863 174.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 97' ' ' GLN . . . . . 0.981 ' HB2' ' HG2' ' E' ' 104' ' ' ARG . 43.5 mt-30 -117.05 92.72 3.93 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.228 -1.026 . . . . 65.58 108.228 179.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 98' ' ' LYS . . . . . . . . . . . . . . . -76.59 134.42 39.37 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.525 -0.307 . . . . 68.26 110.329 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 99' ' ' GLY . . . . . . . . . . . . . . . 176.05 -150.87 11.02 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 121.394 -0.431 . . . . 71.46 113.637 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 100' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -63.46 -39.02 93.36 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.44 -0.504 . . . . 83.25 111.281 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 101' ' ' LYS . . . . . 0.57 ' HE2' HH12 ' E' ' 80' ' ' ARG . 20.2 mmtt -83.37 136.05 34.48 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 122.063 -0.398 . . . . 76.97 110.196 179.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 102' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -89.04 148.55 23.67 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.426 1.09 . . . . 90.5 108.819 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 103' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 60.19 42.98 14.57 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.228 1.196 . . . . 90.86 114.228 -176.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 104' ' ' ARG . . . . . 0.981 ' HG2' ' HB2' ' E' ' 97' ' ' GLN . 16.2 ttt180 -104.33 128.0 52.07 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 118.292 -1.363 . . . . 75.02 112.752 -176.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 105' ' ' GLY . . . . . . . . . . . . . . . 175.71 -164.01 34.0 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 119.545 -1.312 . . . . 57.14 112.352 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 106' ' ' TRP . . . . . 0.488 ' HB3' HD23 ' E' ' 119' ' ' LEU . 43.6 p-90 -158.62 166.84 31.12 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.838 0.828 . . . . 55.23 110.086 176.013 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 107' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -133.53 140.64 47.33 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 114.646 -1.161 . . . . 59.09 109.813 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 108' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -130.91 130.66 43.79 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.818 0.847 . . . . 55.57 109.517 -175.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 109' ' ' TRP . . . . . . . . . . . . . 30.2 p90 -155.58 168.19 27.95 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.445 -0.946 . . . . 61.09 108.445 174.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 110' ' ' ILE . . . . . . . . . . . . . 7.2 mt -122.78 132.6 70.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 N-CA-C 107.453 -1.314 . . . . 65.37 107.453 -175.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 111' ' ' GLU . . . . . . . . . . . . . . . -123.34 105.76 10.11 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 107.248 -1.39 . . . . 73.17 107.248 174.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.69 -106.37 1.94 Allowed Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 116.01 -0.541 . . . . 71.2 112.352 -177.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 113' ' ' ASP . . . . . . . . . . . . . . . -122.73 19.69 10.24 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 122.566 -0.373 . . . . 70.41 111.724 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 114' ' ' LYS . . . . . 0.689 ' HE3' ' HE3' ' E' ' 131' ' ' LYS . 13.7 mttp -121.35 146.48 46.81 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.527 0.731 . . . . 66.03 109.757 178.164 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 115' ' ' LEU . . . . . . . . . . . . . 5.0 tt -104.23 137.33 42.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.559 -0.746 . . . . 59.58 109.707 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 116' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -119.6 127.79 53.28 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 109.222 -0.659 . . . . 72.16 109.222 -178.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 117' ' ' LEU . . . . . . . . . . . . . 3.5 tt -130.46 119.29 22.42 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.925 -1.139 . . . . 53.7 107.925 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 118' ' ' GLU . . . . . . . . . . . . . . . -112.08 112.27 23.77 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.019 -1.104 . . . . 59.65 108.019 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 119' ' ' LEU . . . . . 0.488 HD23 ' HB3' ' E' ' 106' ' ' TRP . 14.8 mt -93.8 132.43 38.2 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 122.807 0.443 . . . . 56.5 109.854 176.475 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 120' ' ' THR . . . . . . . . . . . . . 18.1 m -127.0 144.45 51.02 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.568 -0.901 . . . . 63.15 108.568 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 121' ' ' CYS . . . . . . . . . . . . . 1.9 t -163.79 114.83 1.35 Allowed 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.702 -0.851 . . . . 74.55 108.702 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 122' ' ' GLY . . . . . . . . . . . . . . . 56.52 -109.29 1.5 Allowed Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 111.602 -0.599 . . . . 82.27 111.602 -170.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 123' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -103.43 -13.45 16.63 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.519 0.933 . . . . 83.6 113.519 176.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 124' ' ' GLN . . . . . 0.489 ' HG2' ' C ' ' C' ' 18' ' ' GLY . 1.9 tp-100 -87.86 118.82 27.65 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 118.469 0.577 . . . . 85.3 111.445 -174.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 125' ' ' VAL . . . . . . . . . . . . . 37.0 t -104.7 144.98 13.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 123.756 0.822 . . . . 58.43 109.745 170.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 126' ' ' CYS . . . . . . . . . . . . . 1.9 t -129.52 124.43 33.9 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.98 -1.118 . . . . 56.68 107.98 176.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 127' ' ' ARG . . . . . . . . . . . . . 63.9 mtp85 -105.6 126.64 52.38 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 110.095 -0.335 . . . . 73.02 110.095 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 128' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -128.94 140.57 51.6 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.031 0.532 . . . . 53.64 109.784 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 129' ' ' VAL . . . . . . . . . . . . . 3.6 t -126.79 139.83 50.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 109.433 -0.581 . . . . 50.62 109.433 178.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 130' ' ' PHE . . . . . 0.49 ' HB3' ' HB3' ' C' ' 8' ' ' TRP . 29.3 m-85 -123.08 146.29 47.82 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.188 0.995 . . . . 59.37 110.323 -175.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 131' ' ' LYS . . . . . 0.689 ' HE3' ' HE3' ' E' ' 114' ' ' LYS . 1.5 tttt -103.84 138.67 40.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.286 -0.415 . . . . 73.7 110.817 173.665 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 132' ' ' LYS . . . . . 0.406 ' HD3' ' CH2' ' C' ' 8' ' ' TRP . 8.4 tptm -75.41 149.23 38.64 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 128.443 2.697 . . . . 81.92 107.658 177.718 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 133' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt . . . . . 0 C--N 1.321 -0.637 0 C-N-CA 118.948 -1.101 . . . . 77.3 110.067 176.955 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.338 0 N-CA-C 110.223 -0.288 . . . . 94.93 110.223 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 4' ' ' PHE . . . . . 0.538 ' N ' ' OE1' ' F' ' 44' ' ' GLN . 11.1 m-85 -80.53 17.07 1.17 Allowed 'General case' 0 C--O 1.24 0.575 0 N-CA-C 112.606 0.595 . . . . 94.86 112.606 -175.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 5' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -57.86 138.47 55.66 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 120.371 -0.532 . . . . 104.61 111.798 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 6' ' ' GLY . . . . . . . . . . . . . . . 129.33 -174.02 19.39 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 118.556 -1.783 . . . . 91.92 112.054 168.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 7' ' ' THR . . . . . . . . . . . . . 1.6 p -102.77 127.0 50.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.68 -0.76 . . . . 86.63 109.426 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 8' ' ' TRP . . . . . 0.642 ' CH2' HD13 ' C' ' 110' ' ' ILE . 43.4 m95 -121.41 122.45 39.81 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.919 -0.771 . . . . 83.79 108.919 -176.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 9' ' ' GLU . . . . . 0.429 ' O ' ' N ' ' C' ' 131' ' ' LYS . . . -102.83 130.57 49.88 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 122.875 0.47 . . . . 77.44 109.825 -179.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 10' ' ' MET . . . . . . . . . . . . . 11.6 ttp -65.62 145.08 56.5 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.46 0.648 . . . . 82.93 110.856 -175.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 11' ' ' GLU . . . . . . . . . . . . . . . -122.77 -26.34 4.49 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 114.637 1.347 . . . . 81.5 114.637 175.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -149.24 162.95 39.01 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.216 0.916 . . . . 83.64 109.287 175.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 13' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -155.73 92.44 1.38 Allowed 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 106.792 -1.559 . . . . 85.94 106.792 -173.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 14' ' ' GLU . . . . . . . . . . . . . . . -102.48 133.13 47.95 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.798 -0.637 . . . . 88.29 110.08 -174.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 15' ' ' ASN . . . . . . . . . . . . . 37.2 t30 48.28 47.12 19.9 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 123.82 0.848 . . . . 87.78 111.315 -176.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 16' ' ' PHE . . . . . 0.512 ' HD1' ' HG ' ' C' ' 126' ' ' CYS . 5.4 t80 -72.34 -39.31 68.24 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.793 -0.763 . . . . 93.37 110.671 171.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 17' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -74.04 -31.37 62.86 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 120.011 -0.675 . . . . 108.93 111.75 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.36 -40.25 97.66 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 118.976 -1.583 . . . . 93.14 112.196 170.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 19' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -61.16 -42.51 98.69 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 122.057 -0.672 . . . . 93.57 111.356 174.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 20' ' ' MET . . . . . 0.731 ' HA ' HD12 ' F' ' 23' ' ' LEU . 56.0 mtm -67.97 -36.19 79.65 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.129 -0.629 . . . . 94.61 111.577 -179.326 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 21' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -62.17 -42.01 98.85 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.439 -0.504 . . . . 94.06 110.703 172.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.52 -25.37 67.99 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.159 0.429 . . . . 100.29 112.159 174.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 23' ' ' LEU . . . . . 0.731 HD12 ' HA ' ' F' ' 20' ' ' MET . 47.7 mt -72.94 1.04 9.56 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 112.542 0.571 . . . . 102.85 112.542 178.031 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 24' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 52.5 44.01 30.44 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.639 0.775 . . . . 118.88 111.502 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 25' ' ' ILE . . . . . 0.476 HD13 ' HA ' ' C' ' 78' ' ' ASP . 6.9 tp -93.5 155.77 3.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 105.869 -1.901 . . . . 112.31 105.869 170.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 26' ' ' ASP . . . . . . . . . . . . . . . -153.04 105.7 2.95 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 119.497 -0.881 . . . . 115.98 109.538 -168.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 27' ' ' PHE . . . . . . . . . . . . . . . -178.0 149.08 0.55 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 106.881 -1.526 . . . . 108.95 106.881 179.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.42 -52.86 63.08 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.875 0.845 . . . . 109.21 109.646 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 29' ' ' THR . . . . . . . . . . . . . 1.4 p -69.17 -19.93 64.01 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 125.236 1.415 . . . . 108.4 112.377 -174.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 30' ' ' ARG . . . . . . . . . . . . . . . -68.56 -43.34 76.82 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 124.11 0.881 . . . . 97.21 112.417 -173.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 31' ' ' LYS . . . . . . . . . . . . . . . -71.96 -40.55 68.58 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 117.706 -1.597 . . . . 97.74 110.933 176.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 32' ' ' ILE . . . . . 0.577 ' O ' ' N ' ' F' ' 34' ' ' VAL . . . -77.1 -160.81 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.258 0 C-N-CA 123.773 0.829 . . . . 89.91 110.105 174.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 33' ' ' ALA . . . . . . . . . . . . . . . 44.59 -29.33 0.0 OUTLIER 'General case' 0 C--O 1.237 0.411 0 N-CA-C 116.357 1.984 . . . . 76.76 116.357 -175.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 34' ' ' VAL . . . . . 0.577 ' N ' ' O ' ' F' ' 32' ' ' ILE . 2.5 t -74.03 -12.41 15.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 119.538 -0.865 . . . . 82.39 110.77 -179.702 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 35' ' ' ARG . . . . . . . . . . . . . . . -63.75 73.75 0.03 OUTLIER 'General case' 0 C--O 1.237 0.401 0 N-CA-C 108.278 -1.008 . . . . 78.59 108.278 174.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 36' ' ' LEU . . . . . 0.471 ' N ' ' O ' ' F' ' 34' ' ' VAL . . . -131.2 -162.59 1.23 Allowed 'General case' 0 C--O 1.237 0.445 0 N-CA-C 106.976 -1.49 . . . . 78.11 106.976 -176.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 37' ' ' THR . . . . . . . . . . . . . 1.1 t -136.12 156.75 48.25 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 121.57 -0.706 . . . . 84.06 110.102 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 38' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -128.14 150.27 50.06 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.089 -0.96 . . . . 82.08 110.275 -170.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 39' ' ' THR . . . . . . . . . . . . . 27.7 p -134.22 127.14 31.3 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 124.986 1.314 . . . . 84.24 108.56 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 40' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.29 124.56 50.52 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 122.632 0.373 . . . . 91.68 110.502 -174.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 t -98.02 111.85 28.72 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 107.005 -1.48 . . . . 84.84 107.005 173.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 42' ' ' ILE . . . . . . . . . . . . . 4.2 mt -110.44 128.2 66.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 123.523 0.729 . . . . 88.0 109.883 -176.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 43' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -111.61 119.12 37.63 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.221 -1.4 . . . . 110.9 107.221 166.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 44' ' ' GLN . . . . . 0.538 ' OE1' ' N ' ' F' ' 4' ' ' PHE . 35.3 tt0 -127.61 116.3 20.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.497 -0.557 . . . . 94.87 109.497 -177.499 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 45' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -116.46 99.66 7.33 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 106.638 -1.615 . . . . 100.89 106.638 174.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 46' ' ' GLY . . . . . . . . . . . . . . . 62.8 -109.31 2.59 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.396 -0.907 . . . . 94.41 111.049 -176.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 47' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -105.05 2.24 29.32 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 113.329 0.863 . . . . 110.68 113.329 177.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 48' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -94.34 127.77 40.43 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 118.85 0.75 . . . . 92.7 109.857 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 49' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -125.21 141.16 52.26 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.508 -0.314 . . . . 98.07 111.139 -175.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 3.8 mtmm -134.15 109.68 9.07 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 108.192 -1.04 . . . . 88.38 108.192 172.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 51' ' ' THR . . . . . . . . . . . . . 6.8 p -110.63 145.57 37.67 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 123.873 0.869 . . . . 80.6 111.16 -173.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 52' ' ' LYS . . . . . . . . . . . . . . . -130.91 119.67 22.49 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.371 -0.831 . . . . 78.75 108.904 173.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 53' ' ' ALA . . . . . . . . . . . . . . . -106.25 104.78 14.56 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 122.85 0.46 . . . . 78.68 110.024 -175.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 54' ' ' THR . . . . . . . . . . . . . 35.1 m -94.24 144.0 25.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.294 1.038 . . . . 82.33 110.623 177.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 55' ' ' SER . . . . . . . . . . . . . 2.7 m -117.74 142.38 47.33 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.846 -1.168 . . . . 83.91 107.846 175.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 56' ' ' THR . . . . . . . . . . . . . 2.0 p -135.93 9.64 3.31 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 116.181 1.919 . . . . 89.27 116.181 -168.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 57' ' ' PHE . . . . . . . . . . . . . 1.2 m-30 63.51 134.0 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.461 1.028 . . . . 85.72 112.603 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 58' ' ' LEU . . . . . . . . . . . . . 1.9 mt -82.67 114.18 20.86 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 122.857 0.463 . . . . 78.95 111.733 -168.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 59' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 -57.53 116.15 3.19 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 123.489 0.716 . . . . 94.43 111.334 172.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 60' ' ' TYR . . . . . . . . . . . . . . . -84.15 116.55 22.97 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.712 -0.847 . . . . 82.19 108.712 174.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 61' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -107.81 134.89 50.11 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 120.664 0.268 . . . . 85.4 110.774 -175.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 62' ' ' VAL . . . . . . . . . . . . . 2.1 p -139.06 119.1 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 N-CA-C 107.38 -1.341 . . . . 79.68 107.38 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 63' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -122.86 130.53 52.98 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.115 0.566 . . . . 82.11 109.568 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 64' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -150.82 163.17 39.27 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.524 0.678 . . . . 68.64 110.371 -173.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 65' ' ' THR . . . . . . . . . . . . . 1.4 p -120.14 140.28 51.33 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.084 -0.962 . . . . 69.53 108.483 168.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 66' ' ' VAL . . . . . . . . . . . . . 34.7 t -71.55 128.3 34.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 115.903 -0.59 . . . . 74.73 110.326 -171.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 67' ' ' GLY . . . . . . . . . . . . . . . 104.27 -20.69 39.51 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-O 118.961 -0.911 . . . . 71.54 115.321 -177.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -100.75 127.62 53.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 118.59 1.195 . . . . 77.62 109.484 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 69' ' ' GLU . . . . . . . . . . . . . . . -72.9 136.02 45.19 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.443 -0.577 . . . . 77.06 109.443 173.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 70' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -133.28 168.3 18.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.694 0.759 . . . . 79.79 109.756 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 71' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -99.27 125.33 44.86 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.314 -0.857 . . . . 75.31 108.796 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 72' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -121.7 125.52 46.8 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 110.137 -0.32 . . . . 77.95 110.137 -176.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 73' ' ' TYR . . . . . . . . . . . . . . . -100.81 105.27 16.56 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.688 -1.227 . . . . 81.0 107.688 171.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 74' ' ' THR . . . . . . . . . . . . . 67.8 p -76.07 70.64 2.77 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 122.637 1.208 . . . . 80.86 109.41 -173.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 75' ' ' LYS . . . . . 0.473 ' HA ' ' OD1' ' F' ' 79' ' ' ASN . . . -63.39 -25.68 68.4 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.994 -1.003 . . . . 82.49 113.356 -176.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 76' ' ' SER . . . . . . . . . . . . . 1.1 p -67.37 -31.33 71.51 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 112.793 0.664 . . . . 84.36 112.793 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 77' ' ' LEU . . . . . . . . . . . . . 84.3 mt -122.17 -101.21 0.41 Allowed 'General case' 0 C--O 1.237 0.432 0 N-CA-C 114.307 1.225 . . . . 90.7 114.307 -169.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 78' ' ' ASP . . . . . 0.506 ' OD2' ' NH1' ' F' ' 104' ' ' ARG . 15.6 p-10 -87.08 -3.27 59.06 Favored 'General case' 0 CA--C 1.502 -0.883 0 C-N-CA 122.539 0.336 . . . . 80.62 111.535 -171.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 79' ' ' ASN . . . . . 0.473 ' OD1' ' HA ' ' F' ' 75' ' ' LYS . 6.7 m-20 55.43 46.17 23.78 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-O 122.359 1.075 . . . . 91.13 110.37 172.779 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 80' ' ' ARG . . . . . . . . . . . . . . . -108.78 160.37 16.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.29 -1.323 . . . . 81.29 111.411 179.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 81' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -95.57 127.11 41.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.74 -1.118 . . . . 79.14 108.949 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 82' ' ' VAL . . . . . . . . . . . . . 30.2 m -132.33 151.43 34.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.618 0.723 . . . . 77.94 109.256 178.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 83' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -97.57 109.59 22.31 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 105.352 -2.092 . . . . 74.51 105.352 171.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 84' ' ' ALA . . . . . . . . . . . . . . . -112.09 140.14 47.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.969 0.414 . . . . 73.27 110.176 -171.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 85' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -137.99 135.7 36.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.388 -0.968 . . . . 73.28 108.388 175.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 86' ' ' VAL . . . . . . . . . . . . . 4.6 t -112.63 137.2 46.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 108.427 -0.953 . . . . 68.05 108.427 -177.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 87' ' ' THR . . . . . . . . . . . . . 47.4 p -132.81 159.14 40.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.013 0.911 . . . . 70.5 109.779 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 88' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -90.77 121.0 32.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.316 -1.311 . . . . 72.31 107.697 171.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 89' ' ' GLU . . . . . 0.697 ' O ' HG22 ' F' ' 92' ' ' VAL . 41.5 mt-10 -111.85 92.87 4.19 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 103.614 -2.736 . . . . 87.33 103.614 170.828 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 90' ' ' GLY . . . . . . . . . . . . . . . 71.94 -111.86 3.81 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 106.882 -2.487 . . . . 78.43 106.882 -170.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -116.95 28.89 8.25 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 119.131 -0.461 . . . . 86.16 111.647 171.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 92' ' ' VAL . . . . . 0.697 HG22 ' O ' ' F' ' 89' ' ' GLU . 3.3 m -115.48 137.16 49.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 105.44 -2.059 . . . . 73.91 105.44 -177.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 93' ' ' LEU . . . . . . . . . . . . . 2.4 mt -86.45 111.22 20.33 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.336 -0.545 . . . . 75.28 109.736 178.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 94' ' ' VAL . . . . . . . . . . . . . 4.6 t -110.47 122.46 65.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.351 -0.981 . . . . 68.93 108.351 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 95' ' ' CYS . . . . . . . . . . . . . 6.3 t -116.92 130.33 56.63 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.352 -0.61 . . . . 73.0 109.352 -178.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 96' ' ' VAL . . . . . . . . . . . . . 3.6 t -109.26 131.43 60.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 107.834 -1.173 . . . . 75.51 107.834 174.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 97' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -116.46 93.68 4.32 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 107.337 -1.357 . . . . 81.14 107.337 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 98' ' ' LYS . . . . . . . . . . . . . . . -75.05 135.35 41.25 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.202 0.525 . . . . 68.93 110.952 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 99' ' ' GLY . . . . . . . . . . . . . . . 175.6 -150.59 11.0 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.7 -0.682 . . . . 81.09 113.151 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 100' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.22 -38.08 89.77 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.488 -0.485 . . . . 82.92 111.299 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 101' ' ' LYS . . . . . . . . . . . . . . . -79.81 134.14 36.33 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.695 -0.854 . . . . 87.7 108.695 -179.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 102' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -88.22 148.14 24.51 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.101 -1.074 . . . . 96.82 108.101 -179.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 103' ' ' ASN . . . . . 0.611 ' ND2' ' O ' ' F' ' 122' ' ' GLY . 12.3 t-20 62.59 36.87 13.47 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 118.652 -1.219 . . . . 112.83 113.183 176.406 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 104' ' ' ARG . . . . . 0.506 ' NH1' ' OD2' ' F' ' 78' ' ' ASP . 31.9 ttt180 -105.13 128.6 53.45 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 118.868 0.758 . . . . 88.14 111.456 -173.209 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 105' ' ' GLY . . . . . . . . . . . . . . . 177.15 -163.39 32.08 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.329 -0.939 . . . . 81.88 110.998 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 106' ' ' TRP . . . . . . . . . . . . . 42.2 p-90 -158.68 167.15 30.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 122.033 0.92 . . . . 74.8 109.662 175.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 107' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt -130.27 138.22 50.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.182 -1.372 . . . . 73.71 108.492 176.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 108' ' ' LYS . . . . . 0.455 ' HG3' HD13 ' F' ' 117' ' ' LEU . 18.4 tttt -131.45 129.99 41.9 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.218 -1.401 . . . . 71.76 107.218 -177.223 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 109' ' ' TRP . . . . . 0.458 ' CB ' HG12 ' F' ' 92' ' ' VAL . 15.9 p90 -153.8 169.61 22.96 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 118.733 -1.187 . . . . 85.75 109.889 176.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 110' ' ' ILE . . . . . . . . . . . . . 3.2 tp -123.53 131.28 73.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 113.782 -1.553 . . . . 106.64 109.304 -166.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 111' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -127.41 105.47 8.54 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 106.38 -1.711 . . . . 114.52 106.38 171.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 112' ' ' GLY . . . . . . . . . . . . . . . 68.57 -106.93 1.89 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.83 -1.308 . . . . 111.92 109.83 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -126.76 30.16 5.55 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.924 0.889 . . . . 108.12 111.026 175.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 114' ' ' LYS . . . . . . . . . . . . . . . -114.08 144.62 42.83 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.029 -0.73 . . . . 109.54 109.029 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 115' ' ' LEU . . . . . . . . . . . . . . . -104.36 134.6 47.3 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.106 -0.701 . . . . 90.94 109.106 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 116' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -121.5 123.58 42.36 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.663 -1.236 . . . . 89.55 107.663 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 117' ' ' LEU . . . . . 0.455 HD13 ' HG3' ' F' ' 108' ' ' LYS . 56.2 tp -133.54 118.39 18.23 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.573 -0.529 . . . . 70.93 109.573 -175.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 118' ' ' GLU . . . . . . . . . . . . . . . -114.23 111.26 21.25 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.037 -1.097 . . . . 76.75 108.037 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 119' ' ' LEU . . . . . . . . . . . . . 1.2 mp -94.95 126.6 40.4 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.383 -0.969 . . . . 76.3 108.383 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 120' ' ' THR . . . . . 0.453 HG22 HG23 ' F' ' 125' ' ' VAL . 1.6 p -127.09 106.74 9.47 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 110.026 -0.361 . . . . 93.18 110.026 -166.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 121' ' ' CYS . . . . . . . . . . . . . 47.2 t -113.04 155.82 24.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.939 -0.763 . . . . 100.29 108.939 169.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 122' ' ' GLY . . . . . 0.611 ' O ' ' ND2' ' F' ' 103' ' ' ASN . . . 20.21 -97.6 0.01 OUTLIER Glycine 0 C--N 1.338 0.681 0 N-CA-C 115.628 1.011 . . . . 108.98 115.628 -172.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 123' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -97.98 -39.57 8.89 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.943 1.297 . . . . 113.12 112.976 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 124' ' ' GLN . . . . . . . . . . . . . . . -83.21 118.94 23.96 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.249 0.547 . . . . 104.14 111.744 -173.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 125' ' ' VAL . . . . . 0.453 HG23 HG22 ' F' ' 120' ' ' THR . 2.4 p -104.27 148.47 8.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.229 -1.026 . . . . 80.45 108.229 169.645 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 126' ' ' CYS . . . . . . . . . . . . . 6.7 t -123.84 124.05 41.79 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.057 1.343 . . . . 80.39 108.563 -177.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 127' ' ' ARG . . . . . . . . . . . . . . . -105.35 125.91 51.51 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.047 0.539 . . . . 79.49 109.768 -176.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 128' ' ' GLN . . . . . . . . . . . . . . . -129.37 141.1 51.15 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.537 0.735 . . . . 80.33 109.479 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 129' ' ' VAL . . . . . . . . . . . . . . . -124.75 138.03 55.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.414 -0.958 . . . . 83.82 108.414 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 130' ' ' PHE . . . . . 0.504 ' HA ' ' HA ' ' E' ' 10' ' ' MET . 5.0 m-85 -122.86 142.65 50.54 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.172 -0.677 . . . . 91.74 109.172 -177.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 131' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' E' ' 9' ' ' GLU . . . -105.15 140.16 38.74 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.446 -0.576 . . . . 96.26 109.446 174.123 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 132' ' ' LYS . . . . . . . . . . . . . 44.3 tttt -79.47 132.57 36.39 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.812 -0.81 . . . . 100.48 108.812 178.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 133' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 102.13 111.104 -176.736 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' GOL . . . . . 0.564 ' H2 ' ' HE2' ' A' ' 60' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.428 ' O ' ' NZ ' ' A' ' 31' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_