data_1bm7_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1bm7 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.2 p . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 121.376 0.608 . . . . 60.26 110.157 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -84.15 -4.05 10.32 Favored 'Trans proline' 0 C--O 1.208 -1.012 0 C-N-CA 125.248 3.965 . . . . 40.69 113.337 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 60.1 tp -133.86 113.91 12.75 Favored 'General case' 0 CA--C 1.514 -0.41 0 O-C-N 121.838 -0.539 . . . . 27.15 109.865 -179.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -124.98 141.82 51.88 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 124.172 0.92 . . . . 60.29 111.121 177.697 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.7 t -123.66 133.47 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 106.896 -1.52 . . . . 20.98 106.896 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.6 tttt -129.42 133.08 47.16 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 105.908 -1.886 . . . . 43.35 105.908 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.8 t -130.89 130.96 64.48 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 O-C-N 123.534 0.521 . . . . 18.46 110.085 -176.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 mt -119.65 154.77 33.52 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.984 0.897 . . . . 23.79 113.023 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -104.78 115.14 29.81 Favored 'General case' 0 CA--C 1.558 1.284 0 CA-C-N 114.52 -1.218 . . . . 22.74 109.465 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.6 -12.11 56.47 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 122.969 0.508 . . . . 18.84 112.162 -178.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.0 t -89.63 -36.65 8.85 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.921 0 O-C-N 122.297 -0.252 . . . . 20.38 111.506 178.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 mtp-105 -101.37 -14.94 17.39 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 113.696 0.998 . . . . 62.79 113.696 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.57 46.01 50.11 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.934 -0.866 . . . . 18.32 110.934 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 77.9 p -151.53 171.47 6.49 Favored Pre-proline 0 N--CA 1.425 -1.709 0 N-CA-C 108.45 -0.944 . . . . 28.34 108.45 -177.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -68.62 153.05 74.22 Favored 'Trans proline' 0 C--O 1.248 0.977 0 N-CA-C 104.792 -2.811 . . . . 21.02 104.792 178.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.5 105.5 17.55 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 101.585 -3.487 . . . . 18.44 101.585 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 45.0 mt -89.1 141.32 14.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 113.982 -1.463 . . . . 31.73 113.367 -176.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 m120 59.82 39.48 20.56 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 115.492 1.664 . . . . 54.54 115.492 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 91.4 t -90.26 129.81 40.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 104.035 -2.58 . . . . 19.43 104.035 178.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.73 140.0 43.81 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 106.931 -1.507 . . . . 19.46 106.931 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.0 t -132.66 127.29 55.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 N-CA-C 107.339 -1.356 . . . . 17.99 107.339 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HIS . . . . . 0.429 ' CD2' ' O ' ' A' ' 520' ' ' HOH . 67.7 m80 -119.78 132.92 55.74 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 105.954 -1.869 . . . . 24.9 105.954 178.087 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.3 t -114.98 134.2 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 N-CA-C 108.323 -0.991 . . . . 20.84 108.323 178.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -125.4 157.36 37.02 Favored 'General case' 0 CA--C 1.492 -1.283 0 N-CA-C 108.187 -1.042 . . . . 22.3 108.187 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 78.2 ttt-85 -126.14 137.16 53.56 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 107.414 -1.328 . . . . 47.7 107.414 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -74.07 127.77 33.79 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 117.339 -1.744 . . . . 54.67 110.572 -178.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.95 170.31 11.71 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.119 -0.946 . . . . 44.99 109.754 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.5 -36.28 61.56 Favored 'General case' 0 CA--C 1.503 -0.827 0 CA-C-N 114.957 -1.02 . . . . 58.98 113.046 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -86.63 19.85 2.73 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.254 -0.884 . . . . 79.25 111.618 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 57.25 38.63 28.8 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 113.267 0.84 . . . . 82.13 113.267 -179.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 24.1 p -115.67 155.04 28.42 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 106.045 -1.835 . . . . 54.79 106.045 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -88.41 115.24 25.78 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.033 0.92 . . . . 35.08 109.727 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -96.45 139.81 21.88 Favored Pre-proline 0 N--CA 1.432 -1.331 0 N-CA-C 107.204 -1.406 . . . . 77.04 107.204 177.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -60.18 134.66 57.26 Favored 'Trans proline' 0 CA--C 1.497 -1.364 0 C-N-CA 123.242 2.628 . . . . 30.14 106.859 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . 0.536 ' CZ ' ' CG2' ' A' ' 59' ' ' THR . 84.0 t80 -116.65 -45.97 2.77 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 113.3 0.852 . . . . 24.47 113.3 -177.574 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -168.07 160.4 11.89 Favored 'General case' 0 C--O 1.246 0.892 0 N-CA-C 105.781 -1.933 . . . . 22.0 105.781 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 97.1 p -154.73 161.17 41.64 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.897 -0.779 . . . . 21.89 108.897 177.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -176.39 -178.22 45.99 Favored Glycine 0 N--CA 1.438 -1.209 0 N-CA-C 109.449 -1.46 . . . . 19.18 109.449 -179.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -123.61 142.38 51.1 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 106.967 -1.494 . . . . 43.11 106.967 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.4 p -69.9 151.46 45.63 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 123.024 1.392 . . . . 24.14 109.984 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.3 p -83.83 -174.65 5.4 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.509 -1.223 . . . . 32.44 111.455 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -63.15 -16.87 61.48 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.625 -1.171 . . . . 79.27 109.103 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.8 p -99.15 9.82 42.69 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 118.644 -1.222 . . . . 37.37 109.913 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.36 18.99 78.58 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-O 118.963 -0.91 . . . . 17.1 112.445 178.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.8 mt-10 -112.39 151.42 29.83 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 116.377 1.991 . . . . 49.5 116.377 -179.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.5 tp -134.66 109.25 8.5 Favored 'General case' 0 C--O 1.197 -1.682 0 N-CA-C 107.708 -1.219 . . . . 19.12 107.708 177.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -114.93 177.4 4.66 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.068 -1.456 . . . . 52.9 107.068 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 64.66 28.31 73.11 Favored Glycine 0 N--CA 1.461 0.339 0 N-CA-C 118.423 2.129 . . . . 40.05 118.423 176.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 51.2 mt -73.76 -36.65 65.13 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.165 -0.68 . . . . 32.73 109.165 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . 0.536 ' CG2' ' CZ ' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -142.53 -175.47 4.48 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.172 1.175 . . . . 33.17 114.172 179.011 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.7 p -124.48 157.49 35.13 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 103.511 -2.774 . . . . 34.41 103.511 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -70.16 -18.78 63.22 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 118.055 -1.458 . . . . 69.66 109.914 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.78 -43.68 68.25 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 108.561 -0.903 . . . . 72.08 108.561 178.805 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -80.05 -25.94 39.92 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 113.752 1.019 . . . . 68.88 113.752 -178.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -82.74 76.36 9.59 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.034 -0.53 . . . . 25.88 110.209 -178.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.1 m -88.27 167.09 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 C-N-CA 123.581 0.753 . . . . 21.44 112.176 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -53.12 147.69 9.33 Favored 'General case' 0 CA--C 1.492 -1.25 0 N-CA-C 107.553 -1.277 . . . . 63.47 107.553 179.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 160.88 179.43 35.63 Favored Glycine 0 CA--C 1.494 -1.233 0 C-N-CA 118.924 -1.608 . . . . 21.96 109.425 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 95.6 mt -104.68 123.57 58.74 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 104.131 -2.544 . . . . 25.14 104.131 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -116.08 150.3 37.54 Favored 'General case' 0 CA--C 1.495 -1.155 0 CA-C-N 114.849 -1.069 . . . . 19.62 111.21 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -124.36 120.14 31.28 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 108.222 -1.029 . . . . 40.7 108.222 177.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 74.6 t -101.36 115.79 43.75 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 N-CA-C 106.118 -1.808 . . . . 18.37 106.118 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -108.27 126.58 52.99 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.494 0.664 . . . . 43.6 110.071 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 86.4 mt -111.33 121.18 63.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 107.146 -1.427 . . . . 16.04 107.146 -176.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -78.73 75.97 5.23 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 113.584 0.957 . . . . 53.69 113.584 -178.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 73.5 p -70.65 -31.92 69.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.893 -1.049 . . . . 18.98 112.667 -178.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -58.32 -51.84 68.09 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 112.643 0.608 . . . . 54.0 112.643 -179.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.9 m -59.11 -40.7 86.2 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.332 -0.547 . . . . 38.13 111.415 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -57.57 -48.94 78.0 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 123.906 0.754 . . . . 25.54 111.626 -179.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -71.98 -37.44 69.87 Favored 'General case' 0 CA--C 1.481 -1.674 0 C-N-CA 118.454 -1.298 . . . . 26.25 112.02 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.9 mmmt -55.7 -43.18 76.21 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.461 -0.57 . . . . 73.14 109.461 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.34 -21.65 65.46 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 119.139 -0.458 . . . . 43.31 111.959 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.0 mp -92.02 -1.98 56.95 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 123.651 0.594 . . . . 42.93 110.165 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.98 13.61 82.88 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-O 122.189 0.883 . . . . 38.61 112.874 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 54.7 mt -101.12 143.14 14.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 106.022 -1.844 . . . . 40.61 106.022 179.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.8 t -101.48 107.4 50.95 Favored Pre-proline 0 CA--C 1.555 1.146 0 N-CA-C 107.306 -1.368 . . . . 47.32 107.306 178.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -75.24 158.26 41.33 Favored 'Trans proline' 0 C--O 1.21 -0.922 1 C-N-CA 125.394 4.063 . . . . 31.24 115.291 -179.06 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -81.57 -45.74 15.44 Favored 'General case' 0 C--N 1.315 -0.931 0 O-C-N 121.679 -0.638 . . . . 20.17 112.419 178.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 59.9 m80 -84.27 147.99 26.93 Favored 'General case' 0 CA--C 1.494 -1.181 0 N-CA-C 115.952 1.834 . . . . 21.76 115.952 -175.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -70.85 -42.2 70.46 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 107.531 -1.285 . . . . 31.04 107.531 175.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -168.79 174.78 6.34 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 108.315 -0.994 . . . . 32.96 108.315 177.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -111.44 133.23 53.88 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 106.169 -1.789 . . . . 24.3 106.169 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -120.23 142.46 49.01 Favored 'General case' 0 CA--C 1.509 -0.599 0 O-C-N 121.931 -0.481 . . . . 72.15 110.011 179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 92.9 t -127.39 115.02 38.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 103.395 -2.817 . . . . 25.8 103.395 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -112.6 126.66 70.02 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 N-CA-C 109.037 -0.727 . . . . 18.47 109.037 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -152.11 153.99 35.01 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 113.438 0.903 . . . . 19.34 113.438 -178.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.2 m -87.27 135.88 33.14 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 103.705 -2.702 . . . . 23.38 103.705 174.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -123.86 155.65 37.66 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 121.309 0.576 . . . . 27.65 110.642 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 12.2 m120 48.89 22.06 0.52 Allowed 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 117.792 2.515 . . . . 43.83 117.792 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -60.28 -17.0 39.31 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 123.972 0.909 . . . . 70.99 110.263 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.8 m -129.19 40.85 3.56 Favored 'General case' 0 C--O 1.214 -0.815 0 N-CA-C 108.094 -1.076 . . . . 75.57 108.094 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.79 162.03 38.0 Favored Glycine 0 N--CA 1.436 -1.321 0 N-CA-C 107.838 -2.105 . . . . 59.14 107.838 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -54.85 132.86 54.47 Favored 'Trans proline' 0 C--N 1.328 -0.524 1 C-N-CA 128.614 6.209 . . . . 61.66 115.453 179.984 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -139.31 162.56 34.7 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 104.317 -2.475 . . . . 76.05 104.317 -178.061 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.49 128.16 46.63 Favored 'General case' 0 C--O 1.212 -0.906 0 N-CA-C 105.213 -2.144 . . . . 85.47 105.213 176.919 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -116.6 126.56 53.45 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.614 0.598 . . . . 28.29 112.614 -178.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.1 m -114.6 118.93 35.07 Favored 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 103.866 -2.642 . . . . 21.5 103.866 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 45.4 mm -107.1 117.48 52.98 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 0 N-CA-C 102.721 -3.066 . . . . 23.46 102.721 -177.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -113.63 147.25 38.43 Favored 'General case' 0 C--O 1.248 1.009 0 C-N-CA 120.702 -0.399 . . . . 21.05 111.836 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -136.56 139.72 42.4 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.707 -0.849 . . . . 15.71 108.707 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 35.9 tp -117.48 119.95 36.63 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 103.601 -2.74 . . . . 17.48 103.601 178.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 26.1 mt -106.23 141.61 37.29 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 119.887 3.292 . . . . 16.39 119.887 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 57.8 m -140.58 159.91 61.14 Favored Pre-proline 0 C--O 1.253 1.243 0 N-CA-C 101.986 -3.339 . . . . 21.87 101.986 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -54.58 -39.96 86.13 Favored 'Trans proline' 0 C--N 1.345 0.355 0 N-CA-C 116.285 1.609 . . . . 18.9 116.285 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -114.04 17.41 17.83 Favored 'General case' 0 CA--C 1.489 -1.366 0 N-CA-C 114.579 1.326 . . . . 36.76 114.579 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 29.3 t -159.47 150.66 19.84 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 118.369 -1.332 . . . . 23.42 111.323 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.8 p90 -147.16 152.57 38.63 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.842 -1.17 . . . . 29.0 107.842 172.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.5 m -123.62 143.98 49.89 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 104.818 -2.29 . . . . 26.59 104.818 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 12.0 t -138.35 141.94 39.69 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 108.23 -1.026 . . . . 17.65 108.23 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 t -138.31 159.31 42.39 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.896 -1.047 . . . . 21.68 109.021 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -125.89 136.46 53.08 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 108.088 -1.078 . . . . 17.42 108.088 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 75.4 t -114.97 121.11 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.535 0 N-CA-C 101.997 -3.335 . . . . 23.37 101.997 175.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 85.4 t -116.56 127.38 74.19 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 CA-C-N 115.506 -0.77 . . . . 26.36 109.252 -177.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 67.5 p . . . . . 0 N--CA 1.444 -0.771 0 CA-C-O 116.098 -1.906 . . . . 46.23 110.417 -179.606 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 28.8 p . . . . . 0 N--CA 1.501 2.105 0 N-CA-C 109.37 -0.604 . . . . 63.11 109.37 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -81.86 -4.22 11.99 Favored 'Trans proline' 0 C--O 1.222 -0.296 0 C-N-CA 124.432 3.421 . . . . 40.29 114.394 -179.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 49.8 tp -135.35 118.68 16.72 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.063 0.459 . . . . 30.98 110.367 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -128.4 145.3 51.13 Favored 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 121.518 0.675 . . . . 60.28 109.921 177.706 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 80.3 t -122.75 136.56 59.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 N-CA-C 106.84 -1.541 . . . . 23.61 106.84 -179.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 50.2 tttt -129.67 133.17 46.94 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 105.68 -1.971 . . . . 45.16 105.68 178.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.3 t -129.95 129.93 66.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 N-CA-C 108.481 -0.933 . . . . 20.31 108.481 -177.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 19.6 mt -118.55 155.59 30.63 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 109.871 -0.418 . . . . 23.92 109.871 -178.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -106.86 116.39 31.84 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 105.689 -1.967 . . . . 19.14 105.689 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.01 -14.21 58.74 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.09 1.144 . . . . 21.13 114.09 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 70.9 t -88.14 -37.43 10.52 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.099 0 O-C-N 123.835 0.709 . . . . 20.71 110.628 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -101.59 -14.64 17.36 Favored 'General case' 0 C--N 1.312 -1.024 0 O-C-N 120.832 -1.167 . . . . 64.75 112.634 -178.974 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.35 42.46 49.36 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 119.481 -1.342 . . . . 23.06 110.11 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.5 p -146.11 170.95 7.06 Favored Pre-proline 0 CA--C 1.508 -0.646 0 CA-C-O 122.071 0.939 . . . . 28.28 111.67 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -69.78 153.8 68.41 Favored 'Trans proline' 0 C--O 1.251 1.132 0 N-CA-C 104.371 -2.973 . . . . 21.8 104.371 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.46 105.5 17.81 Favored 'General case' 0 CA--C 1.561 1.392 0 N-CA-C 104.021 -2.585 . . . . 24.71 104.021 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 59.0 mt -91.88 139.8 17.23 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.184 0 CA-C-N 115.141 -0.936 . . . . 32.98 112.537 -176.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.8 35.95 10.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 116.71 2.115 . . . . 56.29 116.71 178.943 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 90.6 t -89.0 131.93 35.09 Favored 'Isoleucine or valine' 0 C--O 1.245 0.825 0 N-CA-C 104.043 -2.577 . . . . 24.29 104.043 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.72 134.76 39.11 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 107.662 -1.236 . . . . 20.95 107.662 179.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 86.4 t -128.19 129.07 69.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 107.114 -1.439 . . . . 26.67 107.114 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -118.72 128.97 55.0 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.733 -0.839 . . . . 27.74 108.733 176.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -111.53 134.22 54.63 Favored 'Isoleucine or valine' 0 C--O 1.246 0.894 0 N-CA-C 107.278 -1.379 . . . . 24.43 107.278 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -125.1 159.51 31.26 Favored 'General case' 0 C--O 1.244 0.788 0 N-CA-C 108.792 -0.818 . . . . 26.78 108.792 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -126.98 135.58 51.06 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 107.729 -1.211 . . . . 53.68 107.729 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -73.05 125.19 27.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 118.8 -1.16 . . . . 56.5 110.481 -179.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.93 164.85 17.2 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.782 -1.099 . . . . 45.6 109.546 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.19 -38.35 39.46 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.029 -0.987 . . . . 59.25 113.334 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -85.2 19.64 2.18 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 114.629 -1.169 . . . . 80.78 111.436 -179.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 58.15 40.4 25.06 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 114.801 1.408 . . . . 84.42 114.801 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 33.9 p -117.8 156.83 27.66 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 106.433 -1.691 . . . . 55.77 106.433 176.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -89.78 111.3 22.26 Favored 'General case' 0 CA--C 1.48 -1.732 0 CA-C-N 115.222 -0.899 . . . . 37.41 110.844 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -92.13 139.5 24.33 Favored Pre-proline 0 C--N 1.307 -1.282 0 N-CA-C 107.634 -1.246 . . . . 78.39 107.634 178.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -60.83 137.61 73.76 Favored 'Trans proline' 0 CA--C 1.509 -0.75 0 C-N-CA 124.045 3.163 . . . . 34.15 104.875 179.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' PHE . . . . . 0.49 ' CZ ' ' CG2' ' B' ' 59' ' ' THR . 86.9 t80 -122.7 -49.43 2.0 Allowed 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.888 0.699 . . . . 27.68 112.888 -176.246 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -163.16 158.48 21.82 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 105.257 -2.127 . . . . 25.12 105.257 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 71.7 p -153.63 165.31 36.32 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.747 0.654 . . . . 24.75 110.398 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.95 -173.11 45.72 Favored Glycine 0 N--CA 1.442 -0.939 0 N-CA-C 107.993 -2.043 . . . . 22.85 107.993 178.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 42.7 mttm -128.2 139.51 52.43 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 124.087 0.955 . . . . 45.29 108.431 178.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 77.2 p -66.36 146.45 54.56 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 119.034 -1.066 . . . . 24.47 111.034 179.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 82.8 p -76.57 -173.04 2.4 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.117 -0.947 . . . . 33.73 112.581 179.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -66.57 -12.37 57.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.47 -0.786 . . . . 78.76 110.046 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 84.2 p -103.95 10.63 36.16 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 120.205 -0.598 . . . . 40.44 111.367 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 71.93 16.17 76.42 Favored Glycine 0 C--O 1.221 -0.704 0 O-C-N 123.512 0.508 . . . . 21.09 112.994 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -112.7 151.66 29.96 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 116.778 2.14 . . . . 46.8 116.778 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 15.5 tp -136.58 108.74 7.23 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 107.859 -1.163 . . . . 25.15 107.859 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -113.87 177.32 4.68 Favored 'General case' 0 C--O 1.251 1.162 0 N-CA-C 107.497 -1.297 . . . . 52.75 107.497 -178.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.02 34.16 86.82 Favored Glycine 0 CA--C 1.502 -0.74 0 CA-C-N 113.713 -1.585 . . . . 40.68 114.907 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.58 -32.2 60.28 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 117.264 0.532 . . . . 35.03 110.576 177.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' THR . . . . . 0.49 ' CG2' ' CZ ' ' B' ' 44' ' ' PHE . 0.0 OUTLIER -147.99 -175.39 4.87 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 122.658 1.218 . . . . 37.05 113.397 179.743 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 77.1 p -125.94 157.62 37.3 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 101.464 -3.532 . . . . 36.16 101.464 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -70.37 -19.28 63.04 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 118.413 -1.315 . . . . 73.94 110.543 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.83 -44.62 69.58 Favored 'General case' 0 CA--C 1.505 -0.783 0 O-C-N 121.282 -0.886 . . . . 71.7 109.123 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -78.93 -23.85 44.41 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.483 -1.235 . . . . 72.8 112.068 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -86.61 81.29 8.3 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 121.371 -0.831 . . . . 33.31 110.5 -177.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -93.43 171.93 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.95 0.881 . . . . 25.84 113.347 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -57.29 146.63 28.06 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 108.033 -1.099 . . . . 60.22 108.033 178.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.91 -178.25 36.07 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 109.307 -1.517 . . . . 26.18 109.307 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 97.8 mt -106.54 124.38 62.01 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.585 0 N-CA-C 104.684 -2.339 . . . . 28.8 104.684 178.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -117.04 149.27 40.55 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.201 -1.363 . . . . 28.69 111.791 -178.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -125.01 122.42 37.23 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 107.649 -1.241 . . . . 40.51 107.649 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 73.3 t -104.48 119.3 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.107 0 N-CA-C 103.991 -2.596 . . . . 22.14 103.991 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -111.3 125.11 53.48 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-O 121.888 0.851 . . . . 49.93 110.786 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 66.1 mt -107.6 120.35 58.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 CA-C-N 115.363 -0.835 . . . . 21.08 110.195 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 42.0 t0 -77.28 75.83 3.84 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 114.281 1.215 . . . . 51.17 114.281 -179.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 76.4 p -71.09 -35.24 71.77 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.033 -0.985 . . . . 20.53 112.229 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 36.8 tttp -56.73 -46.3 81.4 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 113.208 0.818 . . . . 56.56 113.208 -176.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 67.1 m -63.84 -39.64 94.69 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 116.043 -0.526 . . . . 42.51 110.477 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -58.16 -48.6 79.78 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.491 1.119 . . . . 22.64 111.343 179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -71.75 -35.25 70.04 Favored 'General case' 0 C--O 1.208 -1.09 0 C-N-CA 118.489 -1.284 . . . . 22.31 113.148 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 24.6 mmmt -60.55 -39.89 89.58 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 107.325 -1.361 . . . . 70.64 107.325 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.66 -20.69 66.44 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 118.656 -1.217 . . . . 43.02 112.468 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.8 mp -93.8 0.93 56.53 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.168 -0.678 . . . . 43.42 109.168 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.41 14.14 82.48 Favored Glycine 0 C--O 1.251 1.193 0 C-N-CA 120.373 -0.918 . . . . 40.45 113.451 -179.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 42.5 mt -104.65 138.64 28.49 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 108.929 -0.767 . . . . 41.63 108.929 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.5 t -91.69 114.43 61.88 Favored Pre-proline 0 C--O 1.24 0.563 0 C-N-CA 119.192 -1.003 . . . . 50.16 108.382 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -86.07 160.45 10.12 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.812 1.675 . . . . 30.07 114.24 -179.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -83.33 -45.24 13.99 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 114.007 1.114 . . . . 20.92 114.007 177.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 58.9 m80 -84.17 147.09 27.5 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 114.7 1.371 . . . . 23.78 114.7 -175.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -69.37 -39.64 77.93 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 106.683 -1.599 . . . . 31.21 106.683 173.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -175.38 175.84 2.1 Favored 'General case' 0 C--O 1.207 -1.148 0 N-CA-C 106.892 -1.522 . . . . 33.91 106.892 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.59 135.34 50.73 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.791 -1.188 . . . . 24.86 107.791 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -125.04 142.2 51.64 Favored 'General case' 0 C--O 1.217 -0.653 0 O-C-N 121.688 -0.632 . . . . 72.47 109.376 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 58.2 t -126.21 119.74 54.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 N-CA-C 101.437 -3.542 . . . . 23.85 101.437 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 48.1 t -116.99 125.37 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 107.711 -1.218 . . . . 19.07 107.711 179.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -152.63 153.9 34.27 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 113.09 0.774 . . . . 21.07 113.09 -176.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 89.6 m -90.14 132.63 35.34 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 104.351 -2.463 . . . . 25.89 104.351 176.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' B' ' 99' ' ' ASP . . . -112.4 162.76 15.22 Favored 'General case' 0 N--CA 1.423 -1.797 0 C-N-CA 120.011 -0.675 . . . . 33.76 111.483 -178.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 15.9 m120 36.64 21.69 0.0 OUTLIER 'General case' 0 C--O 1.256 1.408 0 N-CA-C 116.809 2.152 . . . . 55.73 116.809 175.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASP . . . . . 0.468 ' N ' ' O ' ' B' ' 97' ' ' ALA . 14.1 p-10 -53.87 -18.58 3.46 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-N 115.429 -0.805 . . . . 73.08 109.613 -179.404 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 6.6 m -128.77 46.47 2.61 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.779 -0.823 . . . . 79.7 108.779 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 84.47 161.34 33.02 Favored Glycine 0 C--O 1.253 1.295 0 N-CA-C 108.344 -1.902 . . . . 63.61 108.344 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -55.02 132.86 54.84 Favored 'Trans proline' 0 C--N 1.359 1.089 1 C-N-CA 128.169 5.913 . . . . 66.48 114.66 179.749 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.85 163.97 29.4 Favored 'General case' 0 C--O 1.254 1.309 0 N-CA-C 104.81 -2.293 . . . . 76.38 104.81 -177.898 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.54 123.67 44.02 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.051 -1.092 . . . . 85.41 108.051 174.019 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -114.06 127.24 55.85 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 115.571 -0.741 . . . . 33.91 112.27 -177.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 54.2 m -114.74 122.82 47.58 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 103.129 -2.915 . . . . 22.88 103.129 173.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 32.5 mm -108.68 118.18 55.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 102.604 -3.11 . . . . 21.39 102.604 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -114.54 149.54 36.3 Favored 'General case' 0 CA--C 1.503 -0.838 0 C-N-CA 118.95 -1.1 . . . . 20.33 109.298 179.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -137.53 138.28 39.48 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 124.185 0.928 . . . . 16.95 109.217 178.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 55.0 tp -118.23 120.12 36.74 Favored 'General case' 0 C--O 1.214 -0.776 0 N-CA-C 102.666 -3.087 . . . . 17.4 102.666 -179.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 12.0 mt -107.26 141.07 39.16 Favored 'General case' 0 C--O 1.25 1.104 0 N-CA-C 118.901 2.926 . . . . 17.14 118.901 -175.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 35.4 m -136.92 158.56 72.66 Favored Pre-proline 0 C--O 1.247 0.944 0 N-CA-C 104.376 -2.453 . . . . 23.9 104.376 175.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -52.02 -45.67 37.36 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 116.913 -1.591 . . . . 17.38 116.094 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -107.74 15.6 24.44 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 115.077 1.51 . . . . 31.38 115.077 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 28.9 t -157.45 152.82 26.21 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 116.991 -1.884 . . . . 22.98 112.266 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -149.32 148.86 30.03 Favored 'General case' 0 CA--C 1.502 -0.901 0 C-N-CA 118.929 -1.108 . . . . 29.73 110.202 171.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 73.1 m -121.79 143.1 49.59 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 104.004 -2.591 . . . . 25.29 104.004 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 12.1 t -138.64 140.18 38.8 Favored 'General case' 0 N--CA 1.433 -1.293 0 C-N-CA 119.086 -1.046 . . . . 20.32 108.458 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 7.5 t -134.63 159.32 41.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 21.35 109.905 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -121.19 135.84 55.08 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.032 -1.099 . . . . 24.0 108.032 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 97.6 t -115.16 115.38 49.25 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 102.119 -3.289 . . . . 27.72 102.119 174.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 70.9 t -112.45 131.29 64.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.758 0 C-N-CA 118.898 -1.121 . . . . 31.0 109.281 -177.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 82.1 p . . . . . 0 C--O 1.27 2.132 0 N-CA-C 113.694 0.998 . . . . 54.6 113.694 179.961 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' FLF . . . . . 0.415 ' O2 ' ' N ' ' A' ' 501' ' ' FLF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 502' ' ' FLF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . 0.429 ' O ' ' CD2' ' A' ' 31' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' CYS . . . . . 0.695 ' HB2' ' O ' ' A' ' 504' ' ' HOH . 17.2 p . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 121.376 0.608 . . . . 60.26 110.157 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -84.15 -4.05 10.32 Favored 'Trans proline' 0 C--O 1.208 -1.012 0 C-N-CA 125.248 3.965 . . . . 40.69 113.337 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 60.1 tp -133.86 113.91 12.75 Favored 'General case' 0 CA--C 1.514 -0.41 0 O-C-N 121.838 -0.539 . . . . 27.15 109.865 -179.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . 0.407 ' HE1' ' HG2' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -124.98 141.82 51.88 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 124.172 0.92 . . . . 60.29 111.121 177.697 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.7 t -123.66 133.47 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 106.896 -1.52 . . . . 20.98 106.896 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.6 tttt -129.42 133.08 47.16 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 105.908 -1.886 . . . . 43.35 105.908 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.8 t -130.89 130.96 64.48 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 O-C-N 123.534 0.521 . . . . 18.46 110.085 -176.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 mt -119.65 154.77 33.52 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.984 0.897 . . . . 23.79 113.023 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . 0.467 ' OD2' ' HD3' ' A' ' 21' ' ' ARG . 27.5 t0 -104.78 115.14 29.81 Favored 'General case' 0 CA--C 1.558 1.284 0 CA-C-N 114.52 -1.218 . . . . 22.74 109.465 178.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.6 -12.11 56.47 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 122.969 0.508 . . . . 18.84 112.162 -178.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.0 t -89.63 -36.65 8.85 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.921 0 O-C-N 122.297 -0.252 . . . . 20.38 111.506 178.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . 0.467 ' HD3' ' OD2' ' A' ' 18' ' ' ASP . 1.2 mtp-105 -101.37 -14.94 17.39 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 113.696 0.998 . . . . 62.79 113.696 -179.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.57 46.01 50.11 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.934 -0.866 . . . . 18.32 110.934 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 77.9 p -151.53 171.47 6.49 Favored Pre-proline 0 N--CA 1.425 -1.709 0 N-CA-C 108.45 -0.944 . . . . 28.34 108.45 -177.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -68.62 153.05 74.22 Favored 'Trans proline' 0 C--O 1.248 0.977 0 N-CA-C 104.792 -2.811 . . . . 21.02 104.792 178.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.5 105.5 17.55 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 101.585 -3.487 . . . . 18.44 101.585 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 45.0 mt -89.1 141.32 14.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 113.982 -1.463 . . . . 31.73 113.367 -176.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 m120 59.82 39.48 20.56 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 115.492 1.664 . . . . 54.54 115.492 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 91.4 t -90.26 129.81 40.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 104.035 -2.58 . . . . 19.43 104.035 178.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.73 140.0 43.81 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 106.931 -1.507 . . . . 19.46 106.931 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.0 t -132.66 127.29 55.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 N-CA-C 107.339 -1.356 . . . . 17.99 107.339 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 67.8 m-70 -119.78 132.92 55.74 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 105.954 -1.869 . . . . 24.9 105.954 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.3 t -114.98 134.2 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 N-CA-C 108.323 -0.991 . . . . 20.84 108.323 178.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -125.4 157.36 37.02 Favored 'General case' 0 CA--C 1.492 -1.283 0 N-CA-C 108.187 -1.042 . . . . 22.3 108.187 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 78.2 ttt-85 -126.14 137.16 53.56 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 107.414 -1.328 . . . . 47.7 107.414 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -74.07 127.77 33.79 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 117.339 -1.744 . . . . 54.67 110.572 -178.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.95 170.31 11.71 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.119 -0.946 . . . . 44.99 109.754 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.5 -36.28 61.56 Favored 'General case' 0 CA--C 1.503 -0.827 0 CA-C-N 114.957 -1.02 . . . . 58.98 113.046 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -86.63 19.85 2.73 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.254 -0.884 . . . . 79.25 111.618 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 57.25 38.63 28.8 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 113.267 0.84 . . . . 82.13 113.267 -179.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 24.1 p -115.67 155.04 28.42 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 106.045 -1.835 . . . . 54.79 106.045 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -88.41 115.24 25.78 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.033 0.92 . . . . 35.08 109.727 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -96.45 139.81 21.88 Favored Pre-proline 0 N--CA 1.432 -1.331 0 N-CA-C 107.204 -1.406 . . . . 77.04 107.204 177.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -60.18 134.66 57.26 Favored 'Trans proline' 0 CA--C 1.497 -1.364 0 C-N-CA 123.242 2.628 . . . . 30.14 106.859 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . 0.632 ' CZ ' HG21 ' A' ' 59' ' ' THR . 84.0 t80 -116.65 -45.97 2.77 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 113.3 0.852 . . . . 24.47 113.3 -177.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -168.07 160.4 11.89 Favored 'General case' 0 C--O 1.246 0.892 0 N-CA-C 105.781 -1.933 . . . . 22.0 105.781 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 97.1 p -154.73 161.17 41.64 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.897 -0.779 . . . . 21.89 108.897 177.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -176.39 -178.22 45.99 Favored Glycine 0 N--CA 1.438 -1.209 0 N-CA-C 109.449 -1.46 . . . . 19.18 109.449 -179.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -123.61 142.38 51.1 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 106.967 -1.494 . . . . 43.11 106.967 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.4 p -69.9 151.46 45.63 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 123.024 1.392 . . . . 24.14 109.984 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.3 p -83.83 -174.65 5.4 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.509 -1.223 . . . . 32.44 111.455 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -63.15 -16.87 61.48 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.625 -1.171 . . . . 79.27 109.103 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.8 p -99.15 9.82 42.69 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 118.644 -1.222 . . . . 37.37 109.913 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.36 18.99 78.58 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-O 118.963 -0.91 . . . . 17.1 112.445 178.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . 0.407 ' HG2' ' HE1' ' A' ' 13' ' ' MET . 71.8 mt-10 -112.39 151.42 29.83 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 116.377 1.991 . . . . 49.5 116.377 -179.053 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.5 tp -134.66 109.25 8.5 Favored 'General case' 0 C--O 1.197 -1.682 0 N-CA-C 107.708 -1.219 . . . . 19.12 107.708 177.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -114.93 177.4 4.66 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.068 -1.456 . . . . 52.9 107.068 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 64.66 28.31 73.11 Favored Glycine 0 N--CA 1.461 0.339 0 N-CA-C 118.423 2.129 . . . . 40.05 118.423 176.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 51.2 mt -73.76 -36.65 65.13 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.165 -0.68 . . . . 32.73 109.165 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . 0.632 HG21 ' CZ ' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -142.53 -175.47 4.48 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.172 1.175 . . . . 33.17 114.172 179.011 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.7 p -124.48 157.49 35.13 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 103.511 -2.774 . . . . 34.41 103.511 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -70.16 -18.78 63.22 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 118.055 -1.458 . . . . 69.66 109.914 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.78 -43.68 68.25 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 108.561 -0.903 . . . . 72.08 108.561 178.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . 0.448 ' CD ' HG22 ' A' ' 59' ' ' THR . 12.8 tt0 -80.05 -25.94 39.92 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 113.752 1.019 . . . . 68.88 113.752 -178.049 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -82.74 76.36 9.59 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.034 -0.53 . . . . 25.88 110.209 -178.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.1 m -88.27 167.09 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 C-N-CA 123.581 0.753 . . . . 21.44 112.176 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . 0.725 ' HG2' ' O ' ' A' ' 98' ' ' ASN . 94.5 mt-10 -53.12 147.69 9.33 Favored 'General case' 0 CA--C 1.492 -1.25 0 N-CA-C 107.553 -1.277 . . . . 63.47 107.553 179.685 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 160.88 179.43 35.63 Favored Glycine 0 CA--C 1.494 -1.233 0 C-N-CA 118.924 -1.608 . . . . 21.96 109.425 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 95.6 mt -104.68 123.57 58.74 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 104.131 -2.544 . . . . 25.14 104.131 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -116.08 150.3 37.54 Favored 'General case' 0 CA--C 1.495 -1.155 0 CA-C-N 114.849 -1.069 . . . . 19.62 111.21 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -124.36 120.14 31.28 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 108.222 -1.029 . . . . 40.7 108.222 177.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 74.6 t -101.36 115.79 43.75 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 N-CA-C 106.118 -1.808 . . . . 18.37 106.118 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -108.27 126.58 52.99 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.494 0.664 . . . . 43.6 110.071 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 86.4 mt -111.33 121.18 63.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 107.146 -1.427 . . . . 16.04 107.146 -176.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -78.73 75.97 5.23 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 113.584 0.957 . . . . 53.69 113.584 -178.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 73.5 p -70.65 -31.92 69.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.893 -1.049 . . . . 18.98 112.667 -178.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -58.32 -51.84 68.09 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 112.643 0.608 . . . . 54.0 112.643 -179.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.9 m -59.11 -40.7 86.2 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.332 -0.547 . . . . 38.13 111.415 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' TYR . . . . . 0.497 ' O ' HD13 ' A' ' 82' ' ' LEU . 92.3 t80 -57.57 -48.94 78.0 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 123.906 0.754 . . . . 25.54 111.626 -179.016 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -71.98 -37.44 69.87 Favored 'General case' 0 CA--C 1.481 -1.674 0 C-N-CA 118.454 -1.298 . . . . 26.25 112.02 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.9 mmmt -55.7 -43.18 76.21 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.461 -0.57 . . . . 73.14 109.461 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.34 -21.65 65.46 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 119.139 -0.458 . . . . 43.31 111.959 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . 0.497 HD13 ' O ' ' A' ' 78' ' ' TYR . 11.0 mp -92.02 -1.98 56.95 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 123.651 0.594 . . . . 42.93 110.165 178.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.98 13.61 82.88 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-O 122.189 0.883 . . . . 38.61 112.874 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 54.7 mt -101.12 143.14 14.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 106.022 -1.844 . . . . 40.61 106.022 179.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.8 t -101.48 107.4 50.95 Favored Pre-proline 0 CA--C 1.555 1.146 0 N-CA-C 107.306 -1.368 . . . . 47.32 107.306 178.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -75.24 158.26 41.33 Favored 'Trans proline' 0 C--O 1.21 -0.922 1 C-N-CA 125.394 4.063 . . . . 31.24 115.291 -179.06 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -81.57 -45.74 15.44 Favored 'General case' 0 C--N 1.315 -0.931 0 O-C-N 121.679 -0.638 . . . . 20.17 112.419 178.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 59.9 m80 -84.27 147.99 26.93 Favored 'General case' 0 CA--C 1.494 -1.181 0 N-CA-C 115.952 1.834 . . . . 21.76 115.952 -175.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -70.85 -42.2 70.46 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 107.531 -1.285 . . . . 31.04 107.531 175.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -168.79 174.78 6.34 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 108.315 -0.994 . . . . 32.96 108.315 177.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -111.44 133.23 53.88 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 106.169 -1.789 . . . . 24.3 106.169 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -120.23 142.46 49.01 Favored 'General case' 0 CA--C 1.509 -0.599 0 O-C-N 121.931 -0.481 . . . . 72.15 110.011 179.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 92.9 t -127.39 115.02 38.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 103.395 -2.817 . . . . 25.8 103.395 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -112.6 126.66 70.02 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 N-CA-C 109.037 -0.727 . . . . 18.47 109.037 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -152.11 153.99 35.01 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 113.438 0.903 . . . . 19.34 113.438 -178.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.2 m -87.27 135.88 33.14 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 103.705 -2.702 . . . . 23.38 103.705 174.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -123.86 155.65 37.66 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 121.309 0.576 . . . . 27.65 110.642 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . 0.725 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 24.5 m-20 48.89 22.06 0.52 Allowed 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 117.792 2.515 . . . . 43.83 117.792 179.468 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -60.28 -17.0 39.31 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 123.972 0.909 . . . . 70.99 110.263 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.8 m -129.19 40.85 3.56 Favored 'General case' 0 C--O 1.214 -0.815 0 N-CA-C 108.094 -1.076 . . . . 75.57 108.094 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.79 162.03 38.0 Favored Glycine 0 N--CA 1.436 -1.321 0 N-CA-C 107.838 -2.105 . . . . 59.14 107.838 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PRO . . . . . 0.421 ' HA ' ' OD1' ' A' ' 98' ' ' ASN . 23.9 Cg_endo -54.85 132.86 54.47 Favored 'Trans proline' 0 C--N 1.328 -0.524 1 C-N-CA 128.614 6.209 . . . . 61.66 115.453 179.984 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . 0.43 ' HG2' ' CG1' ' A' ' 122' ' ' VAL . 0.8 OUTLIER -139.31 162.56 34.7 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 104.317 -2.475 . . . . 76.05 104.317 -178.061 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.49 128.16 46.63 Favored 'General case' 0 C--O 1.212 -0.906 0 N-CA-C 105.213 -2.144 . . . . 85.47 105.213 176.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -116.6 126.56 53.45 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.614 0.598 . . . . 28.29 112.614 -178.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.1 m -114.6 118.93 35.07 Favored 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 103.866 -2.642 . . . . 21.5 103.866 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 45.4 mm -107.1 117.48 52.98 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 0 N-CA-C 102.721 -3.066 . . . . 23.46 102.721 -177.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . 0.432 ' CB ' " H6'" ' A' ' 501' ' ' FLF . . . -113.63 147.25 38.43 Favored 'General case' 0 C--O 1.248 1.009 0 C-N-CA 120.702 -0.399 . . . . 21.05 111.836 179.173 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -136.56 139.72 42.4 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.707 -0.849 . . . . 15.71 108.707 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 35.9 tp -117.48 119.95 36.63 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 103.601 -2.74 . . . . 17.48 103.601 178.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 26.1 mt -106.23 141.61 37.29 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 119.887 3.292 . . . . 16.39 119.887 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 57.8 m -140.58 159.91 61.14 Favored Pre-proline 0 C--O 1.253 1.243 0 N-CA-C 101.986 -3.339 . . . . 21.87 101.986 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -54.58 -39.96 86.13 Favored 'Trans proline' 0 C--N 1.345 0.355 0 N-CA-C 116.285 1.609 . . . . 18.9 116.285 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -114.04 17.41 17.83 Favored 'General case' 0 CA--C 1.489 -1.366 0 N-CA-C 114.579 1.326 . . . . 36.76 114.579 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 29.3 t -159.47 150.66 19.84 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 118.369 -1.332 . . . . 23.42 111.323 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.8 p90 -147.16 152.57 38.63 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.842 -1.17 . . . . 29.0 107.842 172.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.5 m -123.62 143.98 49.89 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 104.818 -2.29 . . . . 26.59 104.818 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 12.0 t -138.35 141.94 39.69 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 108.23 -1.026 . . . . 17.65 108.23 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 t -138.31 159.31 42.39 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.896 -1.047 . . . . 21.68 109.021 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -125.89 136.46 53.08 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 108.088 -1.078 . . . . 17.42 108.088 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 75.4 t -114.97 121.11 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.535 0 N-CA-C 101.997 -3.335 . . . . 23.37 101.997 175.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . 0.43 ' CG1' ' HG2' ' A' ' 103' ' ' ARG . 85.4 t -116.56 127.38 74.19 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 CA-C-N 115.506 -0.77 . . . . 26.36 109.252 -177.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 67.5 p . . . . . 0 N--CA 1.444 -0.771 0 CA-C-O 116.098 -1.906 . . . . 46.23 110.417 -179.606 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 10' ' ' CYS . . . . . 0.785 ' HB2' ' O ' ' B' ' 518' ' ' HOH . 28.8 p . . . . . 0 N--CA 1.501 2.105 0 N-CA-C 109.37 -0.604 . . . . 63.11 109.37 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -81.86 -4.22 11.99 Favored 'Trans proline' 0 C--O 1.222 -0.296 0 C-N-CA 124.432 3.421 . . . . 40.29 114.394 -179.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 49.8 tp -135.35 118.68 16.72 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.063 0.459 . . . . 30.98 110.367 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' MET . . . . . 0.413 ' HG3' ' CD2' ' B' ' 56' ' ' HIS . 0.1 OUTLIER -128.4 145.3 51.13 Favored 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 121.518 0.675 . . . . 60.28 109.921 177.706 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 80.3 t -122.75 136.56 59.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 N-CA-C 106.84 -1.541 . . . . 23.61 106.84 -179.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 50.2 tttt -129.67 133.17 46.94 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 105.68 -1.971 . . . . 45.16 105.68 178.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.3 t -129.95 129.93 66.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 N-CA-C 108.481 -0.933 . . . . 20.31 108.481 -177.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 19.6 mt -118.55 155.59 30.63 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 109.871 -0.418 . . . . 23.92 109.871 -178.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ASP . . . . . 0.488 ' OD2' ' HD3' ' B' ' 21' ' ' ARG . 33.9 t0 -106.86 116.39 31.84 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 105.689 -1.967 . . . . 19.14 105.689 -179.505 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.01 -14.21 58.74 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.09 1.144 . . . . 21.13 114.09 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 70.9 t -88.14 -37.43 10.52 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.099 0 O-C-N 123.835 0.709 . . . . 20.71 110.628 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ARG . . . . . 0.488 ' HD3' ' OD2' ' B' ' 18' ' ' ASP . 0.2 OUTLIER -101.59 -14.64 17.36 Favored 'General case' 0 C--N 1.312 -1.024 0 O-C-N 120.832 -1.167 . . . . 64.75 112.634 -178.974 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.35 42.46 49.36 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 119.481 -1.342 . . . . 23.06 110.11 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.5 p -146.11 170.95 7.06 Favored Pre-proline 0 CA--C 1.508 -0.646 0 CA-C-O 122.071 0.939 . . . . 28.28 111.67 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -69.78 153.8 68.41 Favored 'Trans proline' 0 C--O 1.251 1.132 0 N-CA-C 104.371 -2.973 . . . . 21.8 104.371 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.46 105.5 17.81 Favored 'General case' 0 CA--C 1.561 1.392 0 N-CA-C 104.021 -2.585 . . . . 24.71 104.021 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 59.0 mt -91.88 139.8 17.23 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.184 0 CA-C-N 115.141 -0.936 . . . . 32.98 112.537 -176.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.8 35.95 10.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 116.71 2.115 . . . . 56.29 116.71 178.943 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' B' ' 48' ' ' LYS . 90.6 t -89.0 131.93 35.09 Favored 'Isoleucine or valine' 0 C--O 1.245 0.825 0 N-CA-C 104.043 -2.577 . . . . 24.29 104.043 178.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.72 134.76 39.11 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 107.662 -1.236 . . . . 20.95 107.662 179.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 86.4 t -128.19 129.07 69.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 107.114 -1.439 . . . . 26.67 107.114 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -118.72 128.97 55.0 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.733 -0.839 . . . . 27.74 108.733 176.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -111.53 134.22 54.63 Favored 'Isoleucine or valine' 0 C--O 1.246 0.894 0 N-CA-C 107.278 -1.379 . . . . 24.43 107.278 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -125.1 159.51 31.26 Favored 'General case' 0 C--O 1.244 0.788 0 N-CA-C 108.792 -0.818 . . . . 26.78 108.792 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -126.98 135.58 51.06 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 107.729 -1.211 . . . . 53.68 107.729 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -73.05 125.19 27.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 118.8 -1.16 . . . . 56.5 110.481 -179.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.93 164.85 17.2 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.782 -1.099 . . . . 45.6 109.546 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.19 -38.35 39.46 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.029 -0.987 . . . . 59.25 113.334 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -85.2 19.64 2.18 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 114.629 -1.169 . . . . 80.78 111.436 -179.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 58.15 40.4 25.06 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 114.801 1.408 . . . . 84.42 114.801 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 33.9 p -117.8 156.83 27.66 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 106.433 -1.691 . . . . 55.77 106.433 176.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -89.78 111.3 22.26 Favored 'General case' 0 CA--C 1.48 -1.732 0 CA-C-N 115.222 -0.899 . . . . 37.41 110.844 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -92.13 139.5 24.33 Favored Pre-proline 0 C--N 1.307 -1.282 0 N-CA-C 107.634 -1.246 . . . . 78.39 107.634 178.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -60.83 137.61 73.76 Favored 'Trans proline' 0 CA--C 1.509 -0.75 0 C-N-CA 124.045 3.163 . . . . 34.15 104.875 179.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' PHE . . . . . 0.58 ' CZ ' HG21 ' B' ' 59' ' ' THR . 86.9 t80 -122.7 -49.43 2.0 Allowed 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.888 0.699 . . . . 27.68 112.888 -176.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -163.16 158.48 21.82 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 105.257 -2.127 . . . . 25.12 105.257 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 71.7 p -153.63 165.31 36.32 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.747 0.654 . . . . 24.75 110.398 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.95 -173.11 45.72 Favored Glycine 0 N--CA 1.442 -0.939 0 N-CA-C 107.993 -2.043 . . . . 22.85 107.993 178.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 28' ' ' VAL . 42.7 mttm -128.2 139.51 52.43 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 124.087 0.955 . . . . 45.29 108.431 178.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 77.2 p -66.36 146.45 54.56 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 119.034 -1.066 . . . . 24.47 111.034 179.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 82.8 p -76.57 -173.04 2.4 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.117 -0.947 . . . . 33.73 112.581 179.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -66.57 -12.37 57.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.47 -0.786 . . . . 78.76 110.046 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 84.2 p -103.95 10.63 36.16 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 120.205 -0.598 . . . . 40.44 111.367 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 71.93 16.17 76.42 Favored Glycine 0 C--O 1.221 -0.704 0 O-C-N 123.512 0.508 . . . . 21.09 112.994 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -112.7 151.66 29.96 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 116.778 2.14 . . . . 46.8 116.778 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 15.5 tp -136.58 108.74 7.23 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 107.859 -1.163 . . . . 25.15 107.859 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' HIS . . . . . 0.413 ' CD2' ' HG3' ' B' ' 13' ' ' MET . 14.5 m80 -113.87 177.32 4.68 Favored 'General case' 0 C--O 1.251 1.162 0 N-CA-C 107.497 -1.297 . . . . 52.75 107.497 -178.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.02 34.16 86.82 Favored Glycine 0 CA--C 1.502 -0.74 0 CA-C-N 113.713 -1.585 . . . . 40.68 114.907 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.58 -32.2 60.28 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 117.264 0.532 . . . . 35.03 110.576 177.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' THR . . . . . 0.58 HG21 ' CZ ' ' B' ' 44' ' ' PHE . 0.0 OUTLIER -147.99 -175.39 4.87 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 122.658 1.218 . . . . 37.05 113.397 179.743 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 77.1 p -125.94 157.62 37.3 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 101.464 -3.532 . . . . 36.16 101.464 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -70.37 -19.28 63.04 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 118.413 -1.315 . . . . 73.94 110.543 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.83 -44.62 69.58 Favored 'General case' 0 CA--C 1.505 -0.783 0 O-C-N 121.282 -0.886 . . . . 71.7 109.123 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLU . . . . . 0.423 ' CD ' HG22 ' B' ' 59' ' ' THR . 21.4 tt0 -78.93 -23.85 44.41 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.483 -1.235 . . . . 72.8 112.068 -178.553 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -86.61 81.29 8.3 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 121.371 -0.831 . . . . 33.31 110.5 -177.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -93.43 171.93 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.95 0.881 . . . . 25.84 113.347 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' GLU . . . . . 0.747 ' HG2' ' O ' ' B' ' 98' ' ' ASN . 95.3 mt-10 -57.29 146.63 28.06 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 108.033 -1.099 . . . . 60.22 108.033 178.885 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.91 -178.25 36.07 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 109.307 -1.517 . . . . 26.18 109.307 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 97.8 mt -106.54 124.38 62.01 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.585 0 N-CA-C 104.684 -2.339 . . . . 28.8 104.684 178.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -117.04 149.27 40.55 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.201 -1.363 . . . . 28.69 111.791 -178.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -125.01 122.42 37.23 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 107.649 -1.241 . . . . 40.51 107.649 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 73.3 t -104.48 119.3 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.107 0 N-CA-C 103.991 -2.596 . . . . 22.14 103.991 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -111.3 125.11 53.48 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-O 121.888 0.851 . . . . 49.93 110.786 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 66.1 mt -107.6 120.35 58.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 CA-C-N 115.363 -0.835 . . . . 21.08 110.195 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 42.0 t0 -77.28 75.83 3.84 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 114.281 1.215 . . . . 51.17 114.281 -179.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 76.4 p -71.09 -35.24 71.77 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.033 -0.985 . . . . 20.53 112.229 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 36.8 tttp -56.73 -46.3 81.4 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 113.208 0.818 . . . . 56.56 113.208 -176.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 67.1 m -63.84 -39.64 94.69 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 116.043 -0.526 . . . . 42.51 110.477 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' TYR . . . . . 0.588 ' O ' HD13 ' B' ' 82' ' ' LEU . 91.5 t80 -58.16 -48.6 79.78 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.491 1.119 . . . . 22.64 111.343 179.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -71.75 -35.25 70.04 Favored 'General case' 0 C--O 1.208 -1.09 0 C-N-CA 118.489 -1.284 . . . . 22.31 113.148 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 24.6 mmmt -60.55 -39.89 89.58 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 107.325 -1.361 . . . . 70.64 107.325 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.66 -20.69 66.44 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 118.656 -1.217 . . . . 43.02 112.468 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LEU . . . . . 0.588 HD13 ' O ' ' B' ' 78' ' ' TYR . 9.8 mp -93.8 0.93 56.53 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.168 -0.678 . . . . 43.42 109.168 179.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.41 14.14 82.48 Favored Glycine 0 C--O 1.251 1.193 0 C-N-CA 120.373 -0.918 . . . . 40.45 113.451 -179.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 42.5 mt -104.65 138.64 28.49 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 108.929 -0.767 . . . . 41.63 108.929 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.5 t -91.69 114.43 61.88 Favored Pre-proline 0 C--O 1.24 0.563 0 C-N-CA 119.192 -1.003 . . . . 50.16 108.382 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -86.07 160.45 10.12 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.812 1.675 . . . . 30.07 114.24 -179.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' PHE . . . . . 0.431 ' HB2' ' CD2' ' B' ' 114' ' ' TYR . 92.0 t80 -83.33 -45.24 13.99 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 114.007 1.114 . . . . 20.92 114.007 177.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 58.9 m80 -84.17 147.09 27.5 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 114.7 1.371 . . . . 23.78 114.7 -175.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -69.37 -39.64 77.93 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 106.683 -1.599 . . . . 31.21 106.683 173.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -175.38 175.84 2.1 Favored 'General case' 0 C--O 1.207 -1.148 0 N-CA-C 106.892 -1.522 . . . . 33.91 106.892 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.59 135.34 50.73 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.791 -1.188 . . . . 24.86 107.791 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -125.04 142.2 51.64 Favored 'General case' 0 C--O 1.217 -0.653 0 O-C-N 121.688 -0.632 . . . . 72.47 109.376 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 58.2 t -126.21 119.74 54.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 N-CA-C 101.437 -3.542 . . . . 23.85 101.437 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 48.1 t -116.99 125.37 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 107.711 -1.218 . . . . 19.07 107.711 179.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -152.63 153.9 34.27 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 113.09 0.774 . . . . 21.07 113.09 -176.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 89.6 m -90.14 132.63 35.34 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 104.351 -2.463 . . . . 25.89 104.351 176.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' B' ' 99' ' ' ASP . . . -112.4 162.76 15.22 Favored 'General case' 0 N--CA 1.423 -1.797 0 C-N-CA 120.011 -0.675 . . . . 33.76 111.483 -178.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . 0.747 ' O ' ' HG2' ' B' ' 66' ' ' GLU . 53.5 m-20 36.64 21.69 0.0 OUTLIER 'General case' 0 C--O 1.256 1.408 0 N-CA-C 116.809 2.152 . . . . 55.73 116.809 175.505 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASP . . . . . 0.468 ' N ' ' O ' ' B' ' 97' ' ' ALA . 14.1 p-10 -53.87 -18.58 3.46 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-N 115.429 -0.805 . . . . 73.08 109.613 -179.404 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 6.6 m -128.77 46.47 2.61 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.779 -0.823 . . . . 79.7 108.779 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 84.47 161.34 33.02 Favored Glycine 0 C--O 1.253 1.295 0 N-CA-C 108.344 -1.902 . . . . 63.61 108.344 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' PRO . . . . . 0.516 ' HA ' ' OD1' ' B' ' 98' ' ' ASN . 13.0 Cg_endo -55.02 132.86 54.84 Favored 'Trans proline' 0 C--N 1.359 1.089 1 C-N-CA 128.169 5.913 . . . . 66.48 114.66 179.749 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ARG . . . . . 0.413 ' HG2' ' CG1' ' B' ' 122' ' ' VAL . 0.5 OUTLIER -136.85 163.97 29.4 Favored 'General case' 0 C--O 1.254 1.309 0 N-CA-C 104.81 -2.293 . . . . 76.38 104.81 -177.898 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ARG . . . . . 0.516 ' HD2' ' N ' ' B' ' 104' ' ' ARG . 0.0 OUTLIER -99.54 123.67 44.02 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.051 -1.092 . . . . 85.41 108.051 174.019 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -114.06 127.24 55.85 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 115.571 -0.741 . . . . 33.91 112.27 -177.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 54.2 m -114.74 122.82 47.58 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 103.129 -2.915 . . . . 22.88 103.129 173.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 32.5 mm -108.68 118.18 55.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 102.604 -3.11 . . . . 21.39 102.604 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ALA . . . . . 0.424 ' CB ' " H6'" ' B' ' 502' ' ' FLF . . . -114.54 149.54 36.3 Favored 'General case' 0 CA--C 1.503 -0.838 0 C-N-CA 118.95 -1.1 . . . . 20.33 109.298 179.066 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -137.53 138.28 39.48 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 124.185 0.928 . . . . 16.95 109.217 178.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 55.0 tp -118.23 120.12 36.74 Favored 'General case' 0 C--O 1.214 -0.776 0 N-CA-C 102.666 -3.087 . . . . 17.4 102.666 -179.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 12.0 mt -107.26 141.07 39.16 Favored 'General case' 0 C--O 1.25 1.104 0 N-CA-C 118.901 2.926 . . . . 17.14 118.901 -175.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 35.4 m -136.92 158.56 72.66 Favored Pre-proline 0 C--O 1.247 0.944 0 N-CA-C 104.376 -2.453 . . . . 23.9 104.376 175.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -52.02 -45.67 37.36 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 116.913 -1.591 . . . . 17.38 116.094 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' TYR . . . . . 0.431 ' CD2' ' HB2' ' B' ' 87' ' ' PHE . 36.3 m-85 -107.74 15.6 24.44 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 115.077 1.51 . . . . 31.38 115.077 -179.928 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 28.9 t -157.45 152.82 26.21 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 116.991 -1.884 . . . . 22.98 112.266 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -149.32 148.86 30.03 Favored 'General case' 0 CA--C 1.502 -0.901 0 C-N-CA 118.929 -1.108 . . . . 29.73 110.202 171.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 73.1 m -121.79 143.1 49.59 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 104.004 -2.591 . . . . 25.29 104.004 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 12.1 t -138.64 140.18 38.8 Favored 'General case' 0 N--CA 1.433 -1.293 0 C-N-CA 119.086 -1.046 . . . . 20.32 108.458 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 7.5 t -134.63 159.32 41.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 21.35 109.905 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -121.19 135.84 55.08 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.032 -1.099 . . . . 24.0 108.032 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' VAL . . . . . 0.436 HG23 ' H4 ' ' B' ' 502' ' ' FLF . 97.6 t -115.16 115.38 49.25 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 102.119 -3.289 . . . . 27.72 102.119 174.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 122' ' ' VAL . . . . . 0.413 ' CG1' ' HG2' ' B' ' 103' ' ' ARG . 70.9 t -112.45 131.29 64.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.758 0 C-N-CA 118.898 -1.121 . . . . 31.0 109.281 -177.389 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 82.1 p . . . . . 0 C--O 1.27 2.132 0 N-CA-C 113.694 0.998 . . . . 54.6 113.694 179.961 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 501' ' ' FLF . . . . . 0.432 " H6'" ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 502' ' ' FLF . . . . . 0.436 ' H4 ' HG23 ' B' ' 121' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . 0.695 ' O ' ' HB2' ' A' ' 10' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 518' ' ' HOH . . . . . 0.785 ' O ' ' HB2' ' B' ' 10' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.695 ' HB2' ' O ' ' A' ' 504' ' ' HOH . 17.2 p . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 121.376 0.608 . . . . 60.26 110.157 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -84.15 -4.05 10.32 Favored 'Trans proline' 0 C--O 1.208 -1.012 0 C-N-CA 125.248 3.965 . . . . 40.69 113.337 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 60.1 tp -133.86 113.91 12.75 Favored 'General case' 0 CA--C 1.514 -0.41 0 O-C-N 121.838 -0.539 . . . . 27.15 109.865 -179.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . 0.407 ' HE1' ' HG2' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -124.98 141.82 51.88 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 124.172 0.92 . . . . 60.29 111.121 177.697 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.7 t -123.66 133.47 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 106.896 -1.52 . . . . 20.98 106.896 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.6 tttt -129.42 133.08 47.16 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 105.908 -1.886 . . . . 43.35 105.908 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.8 t -130.89 130.96 64.48 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 O-C-N 123.534 0.521 . . . . 18.46 110.085 -176.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 mt -119.65 154.77 33.52 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.984 0.897 . . . . 23.79 113.023 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.467 ' OD2' ' HD3' ' A' ' 21' ' ' ARG . 27.5 t0 -104.78 115.14 29.81 Favored 'General case' 0 CA--C 1.558 1.284 0 CA-C-N 114.52 -1.218 . . . . 22.74 109.465 178.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.6 -12.11 56.47 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 122.969 0.508 . . . . 18.84 112.162 -178.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.0 t -89.63 -36.65 8.85 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.921 0 O-C-N 122.297 -0.252 . . . . 20.38 111.506 178.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.467 ' HD3' ' OD2' ' A' ' 18' ' ' ASP . 1.2 mtp-105 -101.37 -14.94 17.39 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 113.696 0.998 . . . . 62.79 113.696 -179.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.57 46.01 50.11 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.934 -0.866 . . . . 18.32 110.934 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 77.9 p -151.53 171.47 6.49 Favored Pre-proline 0 N--CA 1.425 -1.709 0 N-CA-C 108.45 -0.944 . . . . 28.34 108.45 -177.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -68.62 153.05 74.22 Favored 'Trans proline' 0 C--O 1.248 0.977 0 N-CA-C 104.792 -2.811 . . . . 21.02 104.792 178.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.5 105.5 17.55 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 101.585 -3.487 . . . . 18.44 101.585 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 45.0 mt -89.1 141.32 14.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 113.982 -1.463 . . . . 31.73 113.367 -176.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 m120 59.82 39.48 20.56 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 115.492 1.664 . . . . 54.54 115.492 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 91.4 t -90.26 129.81 40.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 104.035 -2.58 . . . . 19.43 104.035 178.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.73 140.0 43.81 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 106.931 -1.507 . . . . 19.46 106.931 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.0 t -132.66 127.29 55.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 N-CA-C 107.339 -1.356 . . . . 17.99 107.339 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.596 ' HD2' ' O ' ' A' ' 520' ' ' HOH . 67.7 m80 -119.78 132.92 55.74 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 105.954 -1.869 . . . . 24.9 105.954 178.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.3 t -114.98 134.2 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 N-CA-C 108.323 -0.991 . . . . 20.84 108.323 178.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -125.4 157.36 37.02 Favored 'General case' 0 CA--C 1.492 -1.283 0 N-CA-C 108.187 -1.042 . . . . 22.3 108.187 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 78.2 ttt-85 -126.14 137.16 53.56 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 107.414 -1.328 . . . . 47.7 107.414 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.5 tttt -74.07 127.77 33.79 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 117.339 -1.744 . . . . 54.67 110.572 -178.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.95 170.31 11.71 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.119 -0.946 . . . . 44.99 109.754 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.5 -36.28 61.56 Favored 'General case' 0 CA--C 1.503 -0.827 0 CA-C-N 114.957 -1.02 . . . . 58.98 113.046 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -86.63 19.85 2.73 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.254 -0.884 . . . . 79.25 111.618 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 57.25 38.63 28.8 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 113.267 0.84 . . . . 82.13 113.267 -179.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 24.1 p -115.67 155.04 28.42 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 106.045 -1.835 . . . . 54.79 106.045 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -88.41 115.24 25.78 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.033 0.92 . . . . 35.08 109.727 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -96.45 139.81 21.88 Favored Pre-proline 0 N--CA 1.432 -1.331 0 N-CA-C 107.204 -1.406 . . . . 77.04 107.204 177.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -60.18 134.66 57.26 Favored 'Trans proline' 0 CA--C 1.497 -1.364 0 C-N-CA 123.242 2.628 . . . . 30.14 106.859 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.632 ' CZ ' HG21 ' A' ' 59' ' ' THR . 84.0 t80 -116.65 -45.97 2.77 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 113.3 0.852 . . . . 24.47 113.3 -177.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -168.07 160.4 11.89 Favored 'General case' 0 C--O 1.246 0.892 0 N-CA-C 105.781 -1.933 . . . . 22.0 105.781 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 97.1 p -154.73 161.17 41.64 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.897 -0.779 . . . . 21.89 108.897 177.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -176.39 -178.22 45.99 Favored Glycine 0 N--CA 1.438 -1.209 0 N-CA-C 109.449 -1.46 . . . . 19.18 109.449 -179.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -123.61 142.38 51.1 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 106.967 -1.494 . . . . 43.11 106.967 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.4 p -69.9 151.46 45.63 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 123.024 1.392 . . . . 24.14 109.984 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.3 p -83.83 -174.65 5.4 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.509 -1.223 . . . . 32.44 111.455 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -63.15 -16.87 61.48 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.625 -1.171 . . . . 79.27 109.103 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.8 p -99.15 9.82 42.69 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 118.644 -1.222 . . . . 37.37 109.913 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.36 18.99 78.58 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-O 118.963 -0.91 . . . . 17.1 112.445 178.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.407 ' HG2' ' HE1' ' A' ' 13' ' ' MET . 71.8 mt-10 -112.39 151.42 29.83 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 116.377 1.991 . . . . 49.5 116.377 -179.053 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.5 tp -134.66 109.25 8.5 Favored 'General case' 0 C--O 1.197 -1.682 0 N-CA-C 107.708 -1.219 . . . . 19.12 107.708 177.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -114.93 177.4 4.66 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.068 -1.456 . . . . 52.9 107.068 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 64.66 28.31 73.11 Favored Glycine 0 N--CA 1.461 0.339 0 N-CA-C 118.423 2.129 . . . . 40.05 118.423 176.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 51.2 mt -73.76 -36.65 65.13 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.165 -0.68 . . . . 32.73 109.165 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . 0.632 HG21 ' CZ ' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -142.53 -175.47 4.48 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.172 1.175 . . . . 33.17 114.172 179.011 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.7 p -124.48 157.49 35.13 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 103.511 -2.774 . . . . 34.41 103.511 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -70.16 -18.78 63.22 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 118.055 -1.458 . . . . 69.66 109.914 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.78 -43.68 68.25 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 108.561 -0.903 . . . . 72.08 108.561 178.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.448 ' CD ' HG22 ' A' ' 59' ' ' THR . 12.8 tt0 -80.05 -25.94 39.92 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 113.752 1.019 . . . . 68.88 113.752 -178.049 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -82.74 76.36 9.59 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.034 -0.53 . . . . 25.88 110.209 -178.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.1 m -88.27 167.09 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 C-N-CA 123.581 0.753 . . . . 21.44 112.176 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.725 ' HG2' ' O ' ' A' ' 98' ' ' ASN . 94.5 mt-10 -53.12 147.69 9.33 Favored 'General case' 0 CA--C 1.492 -1.25 0 N-CA-C 107.553 -1.277 . . . . 63.47 107.553 179.685 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 160.88 179.43 35.63 Favored Glycine 0 CA--C 1.494 -1.233 0 C-N-CA 118.924 -1.608 . . . . 21.96 109.425 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 95.6 mt -104.68 123.57 58.74 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 104.131 -2.544 . . . . 25.14 104.131 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -116.08 150.3 37.54 Favored 'General case' 0 CA--C 1.495 -1.155 0 CA-C-N 114.849 -1.069 . . . . 19.62 111.21 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -124.36 120.14 31.28 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 108.222 -1.029 . . . . 40.7 108.222 177.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 74.6 t -101.36 115.79 43.75 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 N-CA-C 106.118 -1.808 . . . . 18.37 106.118 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -108.27 126.58 52.99 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.494 0.664 . . . . 43.6 110.071 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 86.4 mt -111.33 121.18 63.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 107.146 -1.427 . . . . 16.04 107.146 -176.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -78.73 75.97 5.23 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 113.584 0.957 . . . . 53.69 113.584 -178.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 73.5 p -70.65 -31.92 69.03 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.893 -1.049 . . . . 18.98 112.667 -178.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -58.32 -51.84 68.09 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 112.643 0.608 . . . . 54.0 112.643 -179.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.9 m -59.11 -40.7 86.2 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.332 -0.547 . . . . 38.13 111.415 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.497 ' O ' HD13 ' A' ' 82' ' ' LEU . 92.3 t80 -57.57 -48.94 78.0 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 123.906 0.754 . . . . 25.54 111.626 -179.016 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -71.98 -37.44 69.87 Favored 'General case' 0 CA--C 1.481 -1.674 0 C-N-CA 118.454 -1.298 . . . . 26.25 112.02 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.9 mmmt -55.7 -43.18 76.21 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.461 -0.57 . . . . 73.14 109.461 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.34 -21.65 65.46 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 119.139 -0.458 . . . . 43.31 111.959 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.497 HD13 ' O ' ' A' ' 78' ' ' TYR . 11.0 mp -92.02 -1.98 56.95 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 123.651 0.594 . . . . 42.93 110.165 178.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.98 13.61 82.88 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-O 122.189 0.883 . . . . 38.61 112.874 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 54.7 mt -101.12 143.14 14.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 106.022 -1.844 . . . . 40.61 106.022 179.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.8 t -101.48 107.4 50.95 Favored Pre-proline 0 CA--C 1.555 1.146 0 N-CA-C 107.306 -1.368 . . . . 47.32 107.306 178.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -75.24 158.26 41.33 Favored 'Trans proline' 0 C--O 1.21 -0.922 1 C-N-CA 125.394 4.063 . . . . 31.24 115.291 -179.06 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -81.57 -45.74 15.44 Favored 'General case' 0 C--N 1.315 -0.931 0 O-C-N 121.679 -0.638 . . . . 20.17 112.419 178.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 59.9 m80 -84.27 147.99 26.93 Favored 'General case' 0 CA--C 1.494 -1.181 0 N-CA-C 115.952 1.834 . . . . 21.76 115.952 -175.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -70.85 -42.2 70.46 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 107.531 -1.285 . . . . 31.04 107.531 175.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -168.79 174.78 6.34 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 108.315 -0.994 . . . . 32.96 108.315 177.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -111.44 133.23 53.88 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 106.169 -1.789 . . . . 24.3 106.169 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -120.23 142.46 49.01 Favored 'General case' 0 CA--C 1.509 -0.599 0 O-C-N 121.931 -0.481 . . . . 72.15 110.011 179.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 92.9 t -127.39 115.02 38.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 103.395 -2.817 . . . . 25.8 103.395 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -112.6 126.66 70.02 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 N-CA-C 109.037 -0.727 . . . . 18.47 109.037 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -152.11 153.99 35.01 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 113.438 0.903 . . . . 19.34 113.438 -178.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.2 m -87.27 135.88 33.14 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 103.705 -2.702 . . . . 23.38 103.705 174.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -123.86 155.65 37.66 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 121.309 0.576 . . . . 27.65 110.642 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.725 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 12.2 m120 48.89 22.06 0.52 Allowed 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 117.792 2.515 . . . . 43.83 117.792 179.468 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -60.28 -17.0 39.31 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 123.972 0.909 . . . . 70.99 110.263 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.8 m -129.19 40.85 3.56 Favored 'General case' 0 C--O 1.214 -0.815 0 N-CA-C 108.094 -1.076 . . . . 75.57 108.094 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.79 162.03 38.0 Favored Glycine 0 N--CA 1.436 -1.321 0 N-CA-C 107.838 -2.105 . . . . 59.14 107.838 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.577 ' HA ' ' ND2' ' A' ' 98' ' ' ASN . 23.9 Cg_endo -54.85 132.86 54.47 Favored 'Trans proline' 0 C--N 1.328 -0.524 1 C-N-CA 128.614 6.209 . . . . 61.66 115.453 179.984 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.43 ' HG2' ' CG1' ' A' ' 122' ' ' VAL . 0.8 OUTLIER -139.31 162.56 34.7 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 104.317 -2.475 . . . . 76.05 104.317 -178.061 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.49 128.16 46.63 Favored 'General case' 0 C--O 1.212 -0.906 0 N-CA-C 105.213 -2.144 . . . . 85.47 105.213 176.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -116.6 126.56 53.45 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.614 0.598 . . . . 28.29 112.614 -178.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.1 m -114.6 118.93 35.07 Favored 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 103.866 -2.642 . . . . 21.5 103.866 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 45.4 mm -107.1 117.48 52.98 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 0 N-CA-C 102.721 -3.066 . . . . 23.46 102.721 -177.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.432 ' CB ' " H6'" ' A' ' 501' ' ' FLF . . . -113.63 147.25 38.43 Favored 'General case' 0 C--O 1.248 1.009 0 C-N-CA 120.702 -0.399 . . . . 21.05 111.836 179.173 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -136.56 139.72 42.4 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.707 -0.849 . . . . 15.71 108.707 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 35.9 tp -117.48 119.95 36.63 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 103.601 -2.74 . . . . 17.48 103.601 178.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 26.1 mt -106.23 141.61 37.29 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 119.887 3.292 . . . . 16.39 119.887 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 57.8 m -140.58 159.91 61.14 Favored Pre-proline 0 C--O 1.253 1.243 0 N-CA-C 101.986 -3.339 . . . . 21.87 101.986 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -54.58 -39.96 86.13 Favored 'Trans proline' 0 C--N 1.345 0.355 0 N-CA-C 116.285 1.609 . . . . 18.9 116.285 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -114.04 17.41 17.83 Favored 'General case' 0 CA--C 1.489 -1.366 0 N-CA-C 114.579 1.326 . . . . 36.76 114.579 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 29.3 t -159.47 150.66 19.84 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 118.369 -1.332 . . . . 23.42 111.323 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.8 p90 -147.16 152.57 38.63 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.842 -1.17 . . . . 29.0 107.842 172.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.5 m -123.62 143.98 49.89 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 104.818 -2.29 . . . . 26.59 104.818 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 12.0 t -138.35 141.94 39.69 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 108.23 -1.026 . . . . 17.65 108.23 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 t -138.31 159.31 42.39 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.896 -1.047 . . . . 21.68 109.021 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -125.89 136.46 53.08 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 108.088 -1.078 . . . . 17.42 108.088 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 75.4 t -114.97 121.11 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.535 0 N-CA-C 101.997 -3.335 . . . . 23.37 101.997 175.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.43 ' CG1' ' HG2' ' A' ' 103' ' ' ARG . 85.4 t -116.56 127.38 74.19 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 CA-C-N 115.506 -0.77 . . . . 26.36 109.252 -177.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 67.5 p . . . . . 0 N--CA 1.444 -0.771 0 CA-C-O 116.098 -1.906 . . . . 46.23 110.417 -179.606 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.785 ' HB2' ' O ' ' B' ' 518' ' ' HOH . 28.8 p . . . . . 0 N--CA 1.501 2.105 0 N-CA-C 109.37 -0.604 . . . . 63.11 109.37 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -81.86 -4.22 11.99 Favored 'Trans proline' 0 C--O 1.222 -0.296 0 C-N-CA 124.432 3.421 . . . . 40.29 114.394 -179.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 49.8 tp -135.35 118.68 16.72 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.063 0.459 . . . . 30.98 110.367 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' MET . . . . . 0.413 ' HG3' ' CD2' ' B' ' 56' ' ' HIS . 0.1 OUTLIER -128.4 145.3 51.13 Favored 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 121.518 0.675 . . . . 60.28 109.921 177.706 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 80.3 t -122.75 136.56 59.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 N-CA-C 106.84 -1.541 . . . . 23.61 106.84 -179.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 50.2 tttt -129.67 133.17 46.94 Favored 'General case' 0 C--O 1.212 -0.91 0 N-CA-C 105.68 -1.971 . . . . 45.16 105.68 178.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.3 t -129.95 129.93 66.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 N-CA-C 108.481 -0.933 . . . . 20.31 108.481 -177.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 19.6 mt -118.55 155.59 30.63 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 109.871 -0.418 . . . . 23.92 109.871 -178.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ASP . . . . . 0.488 ' OD2' ' HD3' ' B' ' 21' ' ' ARG . 33.9 t0 -106.86 116.39 31.84 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 105.689 -1.967 . . . . 19.14 105.689 -179.505 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.01 -14.21 58.74 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.09 1.144 . . . . 21.13 114.09 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 70.9 t -88.14 -37.43 10.52 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.099 0 O-C-N 123.835 0.709 . . . . 20.71 110.628 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.488 ' HD3' ' OD2' ' B' ' 18' ' ' ASP . 0.2 OUTLIER -101.59 -14.64 17.36 Favored 'General case' 0 C--N 1.312 -1.024 0 O-C-N 120.832 -1.167 . . . . 64.75 112.634 -178.974 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.35 42.46 49.36 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 119.481 -1.342 . . . . 23.06 110.11 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.5 p -146.11 170.95 7.06 Favored Pre-proline 0 CA--C 1.508 -0.646 0 CA-C-O 122.071 0.939 . . . . 28.28 111.67 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -69.78 153.8 68.41 Favored 'Trans proline' 0 C--O 1.251 1.132 0 N-CA-C 104.371 -2.973 . . . . 21.8 104.371 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.46 105.5 17.81 Favored 'General case' 0 CA--C 1.561 1.392 0 N-CA-C 104.021 -2.585 . . . . 24.71 104.021 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 59.0 mt -91.88 139.8 17.23 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.184 0 CA-C-N 115.141 -0.936 . . . . 32.98 112.537 -176.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.8 35.95 10.8 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 116.71 2.115 . . . . 56.29 116.71 178.943 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' B' ' 48' ' ' LYS . 90.6 t -89.0 131.93 35.09 Favored 'Isoleucine or valine' 0 C--O 1.245 0.825 0 N-CA-C 104.043 -2.577 . . . . 24.29 104.043 178.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.72 134.76 39.11 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 107.662 -1.236 . . . . 20.95 107.662 179.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 86.4 t -128.19 129.07 69.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 107.114 -1.439 . . . . 26.67 107.114 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -118.72 128.97 55.0 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.733 -0.839 . . . . 27.74 108.733 176.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -111.53 134.22 54.63 Favored 'Isoleucine or valine' 0 C--O 1.246 0.894 0 N-CA-C 107.278 -1.379 . . . . 24.43 107.278 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -125.1 159.51 31.26 Favored 'General case' 0 C--O 1.244 0.788 0 N-CA-C 108.792 -0.818 . . . . 26.78 108.792 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -126.98 135.58 51.06 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 107.729 -1.211 . . . . 53.68 107.729 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -73.05 125.19 27.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 118.8 -1.16 . . . . 56.5 110.481 -179.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.93 164.85 17.2 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.782 -1.099 . . . . 45.6 109.546 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.19 -38.35 39.46 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.029 -0.987 . . . . 59.25 113.334 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -85.2 19.64 2.18 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 114.629 -1.169 . . . . 80.78 111.436 -179.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 58.15 40.4 25.06 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 114.801 1.408 . . . . 84.42 114.801 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 33.9 p -117.8 156.83 27.66 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 106.433 -1.691 . . . . 55.77 106.433 176.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -89.78 111.3 22.26 Favored 'General case' 0 CA--C 1.48 -1.732 0 CA-C-N 115.222 -0.899 . . . . 37.41 110.844 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -92.13 139.5 24.33 Favored Pre-proline 0 C--N 1.307 -1.282 0 N-CA-C 107.634 -1.246 . . . . 78.39 107.634 178.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -60.83 137.61 73.76 Favored 'Trans proline' 0 CA--C 1.509 -0.75 0 C-N-CA 124.045 3.163 . . . . 34.15 104.875 179.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' PHE . . . . . 0.58 ' CZ ' HG21 ' B' ' 59' ' ' THR . 86.9 t80 -122.7 -49.43 2.0 Allowed 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.888 0.699 . . . . 27.68 112.888 -176.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -163.16 158.48 21.82 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 105.257 -2.127 . . . . 25.12 105.257 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 71.7 p -153.63 165.31 36.32 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.747 0.654 . . . . 24.75 110.398 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.95 -173.11 45.72 Favored Glycine 0 N--CA 1.442 -0.939 0 N-CA-C 107.993 -2.043 . . . . 22.85 107.993 178.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 28' ' ' VAL . 42.7 mttm -128.2 139.51 52.43 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 124.087 0.955 . . . . 45.29 108.431 178.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 77.2 p -66.36 146.45 54.56 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 119.034 -1.066 . . . . 24.47 111.034 179.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 82.8 p -76.57 -173.04 2.4 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.117 -0.947 . . . . 33.73 112.581 179.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -66.57 -12.37 57.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.47 -0.786 . . . . 78.76 110.046 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 84.2 p -103.95 10.63 36.16 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 120.205 -0.598 . . . . 40.44 111.367 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 71.93 16.17 76.42 Favored Glycine 0 C--O 1.221 -0.704 0 O-C-N 123.512 0.508 . . . . 21.09 112.994 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -112.7 151.66 29.96 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 116.778 2.14 . . . . 46.8 116.778 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 15.5 tp -136.58 108.74 7.23 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 107.859 -1.163 . . . . 25.15 107.859 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' HIS . . . . . 0.413 ' CD2' ' HG3' ' B' ' 13' ' ' MET . 14.5 m80 -113.87 177.32 4.68 Favored 'General case' 0 C--O 1.251 1.162 0 N-CA-C 107.497 -1.297 . . . . 52.75 107.497 -178.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.02 34.16 86.82 Favored Glycine 0 CA--C 1.502 -0.74 0 CA-C-N 113.713 -1.585 . . . . 40.68 114.907 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.58 -32.2 60.28 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 117.264 0.532 . . . . 35.03 110.576 177.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' THR . . . . . 0.58 HG21 ' CZ ' ' B' ' 44' ' ' PHE . 0.0 OUTLIER -147.99 -175.39 4.87 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 122.658 1.218 . . . . 37.05 113.397 179.743 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 77.1 p -125.94 157.62 37.3 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 101.464 -3.532 . . . . 36.16 101.464 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -70.37 -19.28 63.04 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 118.413 -1.315 . . . . 73.94 110.543 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.83 -44.62 69.58 Favored 'General case' 0 CA--C 1.505 -0.783 0 O-C-N 121.282 -0.886 . . . . 71.7 109.123 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLU . . . . . 0.423 ' CD ' HG22 ' B' ' 59' ' ' THR . 21.4 tt0 -78.93 -23.85 44.41 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.483 -1.235 . . . . 72.8 112.068 -178.553 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -86.61 81.29 8.3 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 121.371 -0.831 . . . . 33.31 110.5 -177.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -93.43 171.93 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.95 0.881 . . . . 25.84 113.347 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' GLU . . . . . 0.747 ' HG2' ' O ' ' B' ' 98' ' ' ASN . 95.3 mt-10 -57.29 146.63 28.06 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 108.033 -1.099 . . . . 60.22 108.033 178.885 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.91 -178.25 36.07 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 109.307 -1.517 . . . . 26.18 109.307 -179.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 97.8 mt -106.54 124.38 62.01 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.585 0 N-CA-C 104.684 -2.339 . . . . 28.8 104.684 178.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -117.04 149.27 40.55 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.201 -1.363 . . . . 28.69 111.791 -178.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -125.01 122.42 37.23 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 107.649 -1.241 . . . . 40.51 107.649 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 73.3 t -104.48 119.3 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.107 0 N-CA-C 103.991 -2.596 . . . . 22.14 103.991 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -111.3 125.11 53.48 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-O 121.888 0.851 . . . . 49.93 110.786 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 66.1 mt -107.6 120.35 58.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 CA-C-N 115.363 -0.835 . . . . 21.08 110.195 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 42.0 t0 -77.28 75.83 3.84 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 114.281 1.215 . . . . 51.17 114.281 -179.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 76.4 p -71.09 -35.24 71.77 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.033 -0.985 . . . . 20.53 112.229 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 36.8 tttp -56.73 -46.3 81.4 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 113.208 0.818 . . . . 56.56 113.208 -176.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 67.1 m -63.84 -39.64 94.69 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 116.043 -0.526 . . . . 42.51 110.477 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' TYR . . . . . 0.588 ' O ' HD13 ' B' ' 82' ' ' LEU . 91.5 t80 -58.16 -48.6 79.78 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.491 1.119 . . . . 22.64 111.343 179.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -71.75 -35.25 70.04 Favored 'General case' 0 C--O 1.208 -1.09 0 C-N-CA 118.489 -1.284 . . . . 22.31 113.148 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 24.6 mmmt -60.55 -39.89 89.58 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 107.325 -1.361 . . . . 70.64 107.325 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.66 -20.69 66.44 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 118.656 -1.217 . . . . 43.02 112.468 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.588 HD13 ' O ' ' B' ' 78' ' ' TYR . 9.8 mp -93.8 0.93 56.53 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.168 -0.678 . . . . 43.42 109.168 179.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.41 14.14 82.48 Favored Glycine 0 C--O 1.251 1.193 0 C-N-CA 120.373 -0.918 . . . . 40.45 113.451 -179.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 42.5 mt -104.65 138.64 28.49 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 108.929 -0.767 . . . . 41.63 108.929 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.5 t -91.69 114.43 61.88 Favored Pre-proline 0 C--O 1.24 0.563 0 C-N-CA 119.192 -1.003 . . . . 50.16 108.382 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -86.07 160.45 10.12 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.812 1.675 . . . . 30.07 114.24 -179.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' PHE . . . . . 0.431 ' HB2' ' CD2' ' B' ' 114' ' ' TYR . 92.0 t80 -83.33 -45.24 13.99 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 114.007 1.114 . . . . 20.92 114.007 177.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 58.9 m80 -84.17 147.09 27.5 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 114.7 1.371 . . . . 23.78 114.7 -175.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -69.37 -39.64 77.93 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 106.683 -1.599 . . . . 31.21 106.683 173.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -175.38 175.84 2.1 Favored 'General case' 0 C--O 1.207 -1.148 0 N-CA-C 106.892 -1.522 . . . . 33.91 106.892 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.59 135.34 50.73 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.791 -1.188 . . . . 24.86 107.791 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -125.04 142.2 51.64 Favored 'General case' 0 C--O 1.217 -0.653 0 O-C-N 121.688 -0.632 . . . . 72.47 109.376 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 58.2 t -126.21 119.74 54.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 N-CA-C 101.437 -3.542 . . . . 23.85 101.437 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 48.1 t -116.99 125.37 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 107.711 -1.218 . . . . 19.07 107.711 179.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -152.63 153.9 34.27 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 113.09 0.774 . . . . 21.07 113.09 -176.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 89.6 m -90.14 132.63 35.34 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 104.351 -2.463 . . . . 25.89 104.351 176.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' B' ' 99' ' ' ASP . . . -112.4 162.76 15.22 Favored 'General case' 0 N--CA 1.423 -1.797 0 C-N-CA 120.011 -0.675 . . . . 33.76 111.483 -178.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . 0.747 ' O ' ' HG2' ' B' ' 66' ' ' GLU . 15.9 m120 36.64 21.69 0.0 OUTLIER 'General case' 0 C--O 1.256 1.408 0 N-CA-C 116.809 2.152 . . . . 55.73 116.809 175.505 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASP . . . . . 0.468 ' N ' ' O ' ' B' ' 97' ' ' ALA . 14.1 p-10 -53.87 -18.58 3.46 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-N 115.429 -0.805 . . . . 73.08 109.613 -179.404 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 6.6 m -128.77 46.47 2.61 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.779 -0.823 . . . . 79.7 108.779 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 84.47 161.34 33.02 Favored Glycine 0 C--O 1.253 1.295 0 N-CA-C 108.344 -1.902 . . . . 63.61 108.344 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' PRO . . . . . 0.675 ' HA ' ' ND2' ' B' ' 98' ' ' ASN . 13.0 Cg_endo -55.02 132.86 54.84 Favored 'Trans proline' 0 C--N 1.359 1.089 1 C-N-CA 128.169 5.913 . . . . 66.48 114.66 179.749 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.506 ' H ' ' ND2' ' B' ' 98' ' ' ASN . 0.5 OUTLIER -136.85 163.97 29.4 Favored 'General case' 0 C--O 1.254 1.309 0 N-CA-C 104.81 -2.293 . . . . 76.38 104.81 -177.898 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.516 ' HD2' ' N ' ' B' ' 104' ' ' ARG . 0.0 OUTLIER -99.54 123.67 44.02 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.051 -1.092 . . . . 85.41 108.051 174.019 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -114.06 127.24 55.85 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 115.571 -0.741 . . . . 33.91 112.27 -177.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 54.2 m -114.74 122.82 47.58 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 103.129 -2.915 . . . . 22.88 103.129 173.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 32.5 mm -108.68 118.18 55.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 102.604 -3.11 . . . . 21.39 102.604 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ALA . . . . . 0.424 ' CB ' " H6'" ' B' ' 502' ' ' FLF . . . -114.54 149.54 36.3 Favored 'General case' 0 CA--C 1.503 -0.838 0 C-N-CA 118.95 -1.1 . . . . 20.33 109.298 179.066 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -137.53 138.28 39.48 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 124.185 0.928 . . . . 16.95 109.217 178.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 55.0 tp -118.23 120.12 36.74 Favored 'General case' 0 C--O 1.214 -0.776 0 N-CA-C 102.666 -3.087 . . . . 17.4 102.666 -179.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 12.0 mt -107.26 141.07 39.16 Favored 'General case' 0 C--O 1.25 1.104 0 N-CA-C 118.901 2.926 . . . . 17.14 118.901 -175.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 35.4 m -136.92 158.56 72.66 Favored Pre-proline 0 C--O 1.247 0.944 0 N-CA-C 104.376 -2.453 . . . . 23.9 104.376 175.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -52.02 -45.67 37.36 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 116.913 -1.591 . . . . 17.38 116.094 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.431 ' CD2' ' HB2' ' B' ' 87' ' ' PHE . 36.3 m-85 -107.74 15.6 24.44 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 115.077 1.51 . . . . 31.38 115.077 -179.928 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 28.9 t -157.45 152.82 26.21 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 116.991 -1.884 . . . . 22.98 112.266 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -149.32 148.86 30.03 Favored 'General case' 0 CA--C 1.502 -0.901 0 C-N-CA 118.929 -1.108 . . . . 29.73 110.202 171.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 73.1 m -121.79 143.1 49.59 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 104.004 -2.591 . . . . 25.29 104.004 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 12.1 t -138.64 140.18 38.8 Favored 'General case' 0 N--CA 1.433 -1.293 0 C-N-CA 119.086 -1.046 . . . . 20.32 108.458 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 7.5 t -134.63 159.32 41.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 21.35 109.905 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -121.19 135.84 55.08 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.032 -1.099 . . . . 24.0 108.032 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' VAL . . . . . 0.436 HG23 ' H4 ' ' B' ' 502' ' ' FLF . 97.6 t -115.16 115.38 49.25 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 102.119 -3.289 . . . . 27.72 102.119 174.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.413 ' CG1' ' HG2' ' B' ' 103' ' ' ARG . 70.9 t -112.45 131.29 64.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.758 0 C-N-CA 118.898 -1.121 . . . . 31.0 109.281 -177.389 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 82.1 p . . . . . 0 C--O 1.27 2.132 0 N-CA-C 113.694 0.998 . . . . 54.6 113.694 179.961 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' FLF . . . . . 0.432 " H6'" ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 502' ' ' FLF . . . . . 0.436 ' H4 ' HG23 ' B' ' 121' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . 0.695 ' O ' ' HB2' ' A' ' 10' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . 0.596 ' O ' ' HD2' ' A' ' 31' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 518' ' ' HOH . . . . . 0.785 ' O ' ' HB2' ' B' ' 10' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_