data_1nuc_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 1nuc _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 ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 mt . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 106.426 -1.694 . . . . 51.22 106.426 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -114.41 139.82 49.19 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.63 -0.878 . . . . 78.95 108.63 -179.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.7 mtmm -89.0 150.28 22.87 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.238 -1.023 . . . . 47.52 108.238 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -138.21 154.07 73.64 Favored Pre-proline 0 CA--C 1.505 -0.753 0 N-CA-C 107.887 -1.153 . . . . 51.9 107.887 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -77.17 152.86 31.46 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 124.259 3.306 . . . . 31.74 111.728 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -154.18 162.33 41.26 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 103.991 -2.596 . . . . 32.12 103.991 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.2 m -123.87 128.41 49.44 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.186 -0.672 . . . . 28.41 109.186 -178.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.59 130.4 44.18 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 111.533 0.198 . . . . 33.53 111.533 -179.185 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 57.7 mt -103.81 -52.04 8.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 104.451 -2.426 . . . . 33.05 104.451 175.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -170.68 132.9 0.95 Allowed 'General case' 0 C--O 1.237 0.423 0 N-CA-C 113.732 1.012 . . . . 56.97 113.732 -178.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.67 134.45 36.42 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 104.887 -2.264 . . . . 32.94 104.887 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 96.7 mt -99.8 -49.87 11.05 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.502 0 CA-C-O 120.895 0.378 . . . . 46.34 110.044 -179.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -159.69 -165.23 1.48 Allowed 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 107.707 -1.22 . . . . 35.66 107.707 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -52.66 -39.74 54.76 Favored Glycine 0 C--O 1.222 -0.603 0 N-CA-C 119.026 2.37 . . . . 29.3 119.026 -176.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.5 p30 -122.27 12.77 10.27 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 116.559 2.059 . . . . 27.4 116.559 -177.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.8 m -137.77 135.08 35.99 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.984 -0.747 . . . . 29.65 108.984 179.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . . . -146.62 158.74 43.96 Favored 'General case' . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . 0.454 ' CB ' ' HZ2' ' A' ' 24' ' ' LYS . 5.8 mtpm? -107.02 129.0 54.86 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 106.667 -1.605 . . . . 69.27 106.667 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.4 mt -131.19 157.12 44.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.3 0.572 . . . . 28.24 110.72 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 53.5 tpp -96.7 116.07 28.5 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 101.198 -3.63 . . . . 43.45 101.198 175.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -126.59 124.38 39.82 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.045 -1.094 . . . . 36.09 108.045 -178.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 54.83 41.93 31.54 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.808 0.813 . . . . 65.23 109.259 -179.407 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.97 16.58 70.7 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 115.645 1.018 . . . . 46.56 115.645 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -133.18 127.85 20.17 Favored Pre-proline 0 N--CA 1.447 -0.622 0 C-N-CA 119.491 -0.884 . . . . 85.39 112.958 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -66.7 132.37 28.55 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 121.722 1.614 . . . . 40.87 110.564 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 92.2 mtp -149.11 151.12 33.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.306 -0.407 . . . . 47.44 111.264 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.27 133.23 42.17 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 106.099 -1.815 . . . . 36.4 106.099 174.584 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -110.45 147.15 34.63 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 114.961 -1.018 . . . . 29.18 109.14 -179.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -123.95 128.27 49.18 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 103.478 -2.786 . . . . 25.2 103.478 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.4 mt -65.55 130.72 44.31 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.742 0.645 . . . . 27.1 112.742 -179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -71.21 150.69 45.05 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 121.272 0.558 . . . . 29.96 112.423 178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 24.6 mt 60.28 9.68 2.04 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 118.988 2.958 . . . . 33.45 118.988 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.4 m -138.56 166.41 23.01 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 C-N-CA 118.703 -1.199 . . . . 32.09 113.581 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -145.31 112.29 5.99 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.876 -1.056 . . . . 36.28 111.445 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 34.4 p -90.03 154.57 47.38 Favored Pre-proline 0 C--O 1.236 0.377 0 N-CA-C 104.834 -2.284 . . . . 31.69 104.834 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -61.24 145.97 97.94 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 121.719 1.613 . . . . 38.18 113.113 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -69.1 145.53 53.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 113.588 -1.642 . . . . 56.95 113.137 -179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 39.6 p -139.04 -11.86 1.25 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.881 -1.155 . . . . 50.11 107.881 177.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . 0.5 ' HZ2' ' H1 ' ' A' ' 251' ' ' HOH . 0.1 OUTLIER -100.57 -75.41 0.58 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 115.56 1.689 . . . . 64.23 115.56 -176.997 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HIS . . . . . 0.713 ' HD1' ' H ' ' A' ' 48' ' ' LYS . 2.7 t-80 -51.25 119.46 12.57 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 115.933 1.827 . . . . 62.54 115.933 -177.546 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -61.15 -28.9 86.08 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 124.953 3.769 . . . . 69.68 114.147 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . 0.713 ' H ' ' HD1' ' A' ' 46' ' ' HIS . 40.3 ttmt -61.2 -18.75 59.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.427 -0.351 . . . . 98.09 110.371 178.954 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -116.75 -45.35 2.79 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.62 -0.511 . . . . 80.92 109.62 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 91.42 -170.32 33.9 Favored Glycine 0 C--N 1.33 0.249 0 N-CA-C 109.244 -1.543 . . . . 76.16 109.244 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 42.3 t -85.16 101.75 10.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 106.283 -1.747 . . . . 66.41 106.283 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -76.14 147.57 38.43 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.696 -0.684 . . . . 62.97 110.573 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.0 tptt -53.89 131.53 40.18 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.121 -0.491 . . . . 74.54 109.931 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 83.15 -4.05 1.25 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.917 1.08 . . . . 51.33 113.917 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -59.9 -56.51 24.39 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.415 -1.074 . . . . 35.5 110.415 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.01 -38.01 95.34 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.583 2.189 . . . . 34.75 112.023 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -65.27 -45.88 82.74 Favored 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.395 0.434 . . . . 45.14 111.191 178.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.46 -39.26 92.8 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 110.42 -0.215 . . . . 28.75 110.42 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.9 m -64.38 -44.23 92.03 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.949 -0.7 . . . . 38.88 110.84 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.22 -40.96 97.87 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.981 -0.288 . . . . 29.6 111.67 -179.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -61.38 -53.14 60.44 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.776 -0.453 . . . . 28.88 109.776 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.6 m -59.06 -46.8 87.32 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.594 0.59 . . . . 26.1 112.594 179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -56.16 -52.16 65.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.98 -0.555 . . . . 50.45 109.655 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.38 -50.47 71.47 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-O 122.102 0.954 . . . . 69.15 110.887 -179.69 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.1 ttt -57.41 -47.48 81.6 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 114.488 1.292 . . . . 33.11 114.488 -178.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.1 m -78.77 -32.53 15.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 113.819 1.044 . . . . 30.47 113.819 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -71.86 -31.7 66.74 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 114.327 1.232 . . . . 49.23 114.327 -178.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -88.05 -0.08 56.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 116.046 1.869 . . . . 48.76 116.046 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.37 146.03 33.09 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 114.058 1.133 . . . . 31.93 114.058 -178.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -74.06 -43.12 58.93 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 104.515 -2.402 . . . . 50.82 104.515 176.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.4 pttt -143.27 143.1 31.58 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 117.712 2.486 . . . . 49.15 117.712 179.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 77.4 mt -115.19 137.5 48.53 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 CA-C-N 114.139 -1.391 . . . . 29.78 109.523 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -130.98 147.61 52.64 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 107.875 -1.158 . . . . 36.14 107.875 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 33.0 m -118.08 140.96 39.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 105.387 -2.079 . . . . 31.37 105.387 177.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -130.43 112.42 13.23 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.796 -1.557 . . . . 37.03 106.796 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -80.46 157.92 26.05 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.266 -1.013 . . . . 29.64 108.266 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -88.82 -161.11 0.72 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 106.327 -1.731 . . . . 32.1 106.327 177.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . 0.487 ' HZ2' ' HG1' ' A' ' 120' ' ' THR . 14.3 pttt -92.6 -8.77 43.29 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 115.105 1.52 . . . . 59.33 115.105 -178.943 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.53 -148.12 23.08 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.451 -0.88 . . . . 33.99 111.348 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -65.41 148.4 51.77 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.455 0.645 . . . . 44.32 110.701 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 27.1 mtt85 -96.38 -6.58 37.2 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 117.055 2.243 . . . . 60.59 117.055 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 46.0 p -138.87 158.76 43.63 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.634 -1.617 . . . . 34.64 106.634 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.0 p30 -99.58 -179.0 4.06 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 109.433 -0.58 . . . . 28.81 109.433 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 41.0 pttt -57.75 -23.88 54.25 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 114.87 1.433 . . . . 43.24 114.87 -178.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -88.86 1.24 55.66 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.33 -0.395 . . . . 33.31 110.511 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.28 12.35 83.25 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 115.594 0.998 . . . . 26.48 115.594 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 78.5 mtm180 -82.7 138.94 33.93 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.505 0.652 . . . . 26.03 110.734 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -66.26 136.9 34.95 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 107.874 -2.09 . . . . 24.91 107.874 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.5 mt -107.35 111.62 24.05 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.877 -0.786 . . . . 26.93 108.877 179.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -154.87 175.05 14.26 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 115.095 1.517 . . . . 24.57 115.095 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -101.6 122.85 44.62 Favored 'General case' 0 N--CA 1.448 -0.536 1 N-CA-C 98.9 -4.482 . . . . 26.79 98.9 175.052 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -104.51 136.14 39.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 C-N-CA 120.371 -0.531 . . . . 35.6 110.356 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -116.88 133.02 56.53 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 116.288 -0.414 . . . . 32.21 110.891 -178.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -116.29 108.03 15.59 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 103.624 -2.732 . . . . 29.26 103.624 177.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 55.67 46.97 21.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.271 -0.877 . . . . 35.31 110.607 -178.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.99 0.03 63.8 Favored Glycine 0 CA--C 1.503 -0.69 0 N-CA-C 117.502 1.761 . . . . 33.22 117.502 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -105.22 124.46 49.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.26 -0.644 . . . . 74.28 109.26 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.6 ttm -69.63 118.85 13.01 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 112.438 0.533 . . . . 29.75 112.438 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 98.1 t -63.13 -40.31 88.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 C-N-CA 121.092 -0.243 . . . . 24.14 110.947 179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.62 -49.42 72.87 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 120.83 -0.348 . . . . 24.17 110.551 -179.303 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.6 tm-20 -67.77 -39.84 84.06 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.361 0.504 . . . . 47.97 112.361 -179.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.45 -47.01 76.72 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.08 0.467 . . . . 25.94 110.992 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 64.4 mt -63.43 -45.75 89.52 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.707 0.765 . . . . 27.65 112.309 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 20.3 t -63.34 -40.45 89.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.466 -0.568 . . . . 33.11 109.466 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 52.8 tpt85 -63.07 -27.12 69.18 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.016 0.747 . . . . 35.34 113.016 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -92.38 2.74 56.48 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.699 1.0 . . . . 37.85 113.699 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.71 30.8 74.94 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.563 -1.015 . . . . 30.3 110.563 -178.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.1 mt -107.67 2.63 23.97 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.468 0.652 . . . . 29.8 111.699 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -156.83 155.92 32.33 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.144 -1.058 . . . . 32.66 108.144 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -116.77 147.31 42.18 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 104.475 -2.417 . . . . 63.17 104.475 178.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.31 124.35 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 104.889 -2.263 . . . . 34.89 104.889 177.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -152.36 173.23 15.32 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.875 -0.33 . . . . 31.97 111.495 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 52.48 51.69 15.65 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.817 0.847 . . . . 37.97 112.607 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 44.0 t -87.58 102.94 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.642 0 C-N-CA 119.124 -1.03 . . . . 44.97 108.905 -178.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -115.48 111.69 21.14 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.683 -0.69 . . . . 47.26 111.698 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 27.0 mmtm -60.48 144.03 89.08 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 106.908 -1.516 . . . . 68.56 106.908 178.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -90.26 13.24 53.99 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 N-CA-C 114.914 1.082 . . . . 38.33 114.914 -0.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -85.08 64.1 8.49 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 117.9 0.318 . . . . 35.25 111.308 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -145.51 28.01 1.21 Allowed 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.165 -1.014 . . . . 43.0 113.669 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' THR . . . . . 0.487 ' HG1' ' HZ2' ' A' ' 78' ' ' LYS . 43.1 m -50.06 -44.06 51.51 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 113.121 0.786 . . . . 38.0 113.121 -178.754 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 34.9 m-70 -95.7 18.26 13.34 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 115.949 1.833 . . . . 37.49 115.949 -178.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -57.42 -46.98 82.93 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 115.361 1.615 . . . . 45.57 115.361 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 19.5 mm100 -64.99 -42.41 94.54 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.232 0.456 . . . . 62.48 112.232 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -58.32 -46.6 85.87 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.272 0.558 . . . . 55.16 109.982 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 69.2 mt -68.52 -34.64 76.23 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 119.735 -0.786 . . . . 33.46 111.251 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -65.34 -39.49 92.46 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 120.066 -0.654 . . . . 45.49 111.788 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -33.83 75.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 119.087 -1.045 . . . . 70.18 110.916 179.18 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 73.0 m -71.02 -35.79 72.15 Favored 'General case' 0 CA--C 1.511 -0.528 0 C-N-CA 120.677 -0.409 . . . . 35.21 110.612 178.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -67.19 -37.19 83.26 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 120.399 -0.52 . . . . 46.31 111.244 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.45 -34.7 78.33 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.883 -0.599 . . . . 34.04 109.916 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -71.69 -45.06 63.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.402 -0.363 . . . . 44.88 110.584 179.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -59.72 -42.38 92.97 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.096 -0.705 . . . . 34.06 109.096 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt -60.48 -51.01 71.28 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.182 -0.917 . . . . 70.77 110.262 179.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -64.47 -32.43 74.05 Favored 'General case' 0 C--O 1.223 -0.325 0 O-C-N 123.458 0.474 . . . . 74.33 112.142 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -82.53 1.36 38.25 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.258 -0.577 . . . . 35.9 109.709 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 25.1 mmtp 50.78 47.95 23.66 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 124.282 1.033 . . . . 67.5 113.306 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 89.9 mt -83.61 135.13 34.73 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 117.156 2.28 . . . . 36.29 117.156 -178.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 36.82 -99.44 0.02 OUTLIER 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 114.991 1.478 . . . . 41.64 114.991 176.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 5.2 mt -51.49 -32.93 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.748 0.309 . . . . 46.63 111.336 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' TRP . . . . . . . . . . . . . 55.8 m95 -96.99 23.53 7.14 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.594 0.59 . . . . 53.01 112.594 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 85.8 p . . . . . 0 C--O 1.259 1.584 0 C-N-CA 120.075 -0.65 . . . . 56.94 112.283 -179.397 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ' CA' . . . . . 0.842 'CA ' ' O ' ' A' ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' THP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . 0.842 ' O ' 'CA ' ' A' ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . 0.5 ' H1 ' ' HZ2' ' A' ' 45' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 mt . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 106.426 -1.694 . . . . 51.22 106.426 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -114.41 139.82 49.19 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.63 -0.878 . . . . 78.95 108.63 -179.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.7 mtmm -89.0 150.28 22.87 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.238 -1.023 . . . . 47.52 108.238 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -138.21 154.07 73.64 Favored Pre-proline 0 CA--C 1.505 -0.753 0 N-CA-C 107.887 -1.153 . . . . 51.9 107.887 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -77.17 152.86 31.46 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 124.259 3.306 . . . . 31.74 111.728 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -154.18 162.33 41.26 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 103.991 -2.596 . . . . 32.12 103.991 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.2 m -123.87 128.41 49.44 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.186 -0.672 . . . . 28.41 109.186 -178.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.59 130.4 44.18 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 111.533 0.198 . . . . 33.53 111.533 -179.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 57.7 mt -103.81 -52.04 8.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 104.451 -2.426 . . . . 33.05 104.451 175.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -170.68 132.9 0.95 Allowed 'General case' 0 C--O 1.237 0.423 0 N-CA-C 113.732 1.012 . . . . 56.97 113.732 -178.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.67 134.45 36.42 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 104.887 -2.264 . . . . 32.94 104.887 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 96.7 mt -99.8 -49.87 11.05 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.502 0 CA-C-O 120.895 0.378 . . . . 46.34 110.044 -179.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -159.69 -165.23 1.48 Allowed 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 107.707 -1.22 . . . . 35.66 107.707 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -52.66 -39.74 54.76 Favored Glycine 0 C--O 1.222 -0.603 0 N-CA-C 119.026 2.37 . . . . 29.3 119.026 -176.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.5 p30 -122.27 12.77 10.27 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 116.559 2.059 . . . . 27.4 116.559 -177.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.8 m -137.77 135.08 35.99 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.984 -0.747 . . . . 29.65 108.984 179.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . . . -146.62 158.74 43.96 Favored 'General case' . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . 0.706 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 5.8 mtpm? -107.02 129.0 54.86 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 106.667 -1.605 . . . . 69.27 106.667 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.4 mt -131.19 157.12 44.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.3 0.572 . . . . 28.24 110.72 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 53.5 tpp -96.7 116.07 28.5 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 101.198 -3.63 . . . . 43.45 101.198 175.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . 0.554 ' CZ ' ' HD2' ' A' ' 28' ' ' LYS . 52.5 t80 -126.59 124.38 39.82 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.045 -1.094 . . . . 36.09 108.045 -178.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . 0.554 ' HD2' ' CZ ' ' A' ' 27' ' ' TYR . 0.1 OUTLIER 54.83 41.93 31.54 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.808 0.813 . . . . 65.23 109.259 -179.407 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.97 16.58 70.7 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 115.645 1.018 . . . . 46.56 115.645 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -133.18 127.85 20.17 Favored Pre-proline 0 N--CA 1.447 -0.622 0 C-N-CA 119.491 -0.884 . . . . 85.39 112.958 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -66.7 132.37 28.55 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 121.722 1.614 . . . . 40.87 110.564 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 92.2 mtp -149.11 151.12 33.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.306 -0.407 . . . . 47.44 111.264 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.27 133.23 42.17 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 106.099 -1.815 . . . . 36.4 106.099 174.584 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -110.45 147.15 34.63 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 114.961 -1.018 . . . . 29.18 109.14 -179.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -123.95 128.27 49.18 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 103.478 -2.786 . . . . 25.2 103.478 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.4 mt -65.55 130.72 44.31 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.742 0.645 . . . . 27.1 112.742 -179.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -71.21 150.69 45.05 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 121.272 0.558 . . . . 29.96 112.423 178.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 24.6 mt 60.28 9.68 2.04 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 118.988 2.958 . . . . 33.45 118.988 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.4 m -138.56 166.41 23.01 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 C-N-CA 118.703 -1.199 . . . . 32.09 113.581 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -145.31 112.29 5.99 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.876 -1.056 . . . . 36.28 111.445 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 34.4 p -90.03 154.57 47.38 Favored Pre-proline 0 C--O 1.236 0.377 0 N-CA-C 104.834 -2.284 . . . . 31.69 104.834 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -61.24 145.97 97.94 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 121.719 1.613 . . . . 38.18 113.113 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -69.1 145.53 53.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 113.588 -1.642 . . . . 56.95 113.137 -179.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 39.6 p -139.04 -11.86 1.25 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.881 -1.155 . . . . 50.11 107.881 177.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.57 -75.41 0.58 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 115.56 1.689 . . . . 64.23 115.56 -176.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -51.25 119.46 12.57 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 115.933 1.827 . . . . 62.54 115.933 -177.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -61.15 -28.9 86.08 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 124.953 3.769 . . . . 69.68 114.147 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -61.2 -18.75 59.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.427 -0.351 . . . . 98.09 110.371 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -116.75 -45.35 2.79 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.62 -0.511 . . . . 80.92 109.62 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 91.42 -170.32 33.9 Favored Glycine 0 C--N 1.33 0.249 0 N-CA-C 109.244 -1.543 . . . . 76.16 109.244 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 42.3 t -85.16 101.75 10.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 106.283 -1.747 . . . . 66.41 106.283 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -76.14 147.57 38.43 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.696 -0.684 . . . . 62.97 110.573 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . 0.638 ' HD2' ' O ' ' A' ' 257' ' ' HOH . 42.0 tptt -53.89 131.53 40.18 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.121 -0.491 . . . . 74.54 109.931 179.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TYR . . . . . 0.524 ' CD2' ' HG3' ' A' ' 53' ' ' LYS . 64.1 m-85 83.15 -4.05 1.25 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.917 1.08 . . . . 51.33 113.917 -178.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -59.9 -56.51 24.39 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.415 -1.074 . . . . 35.5 110.415 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.01 -38.01 95.34 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.583 2.189 . . . . 34.75 112.023 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . 0.498 ' OE1' ' HA ' ' A' ' 54' ' ' TYR . 31.3 mp0 -65.27 -45.88 82.74 Favored 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.395 0.434 . . . . 45.14 111.191 178.655 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.46 -39.26 92.8 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 110.42 -0.215 . . . . 28.75 110.42 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.9 m -64.38 -44.23 92.03 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.949 -0.7 . . . . 38.88 110.84 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.22 -40.96 97.87 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.981 -0.288 . . . . 29.6 111.67 -179.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -61.38 -53.14 60.44 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.776 -0.453 . . . . 28.88 109.776 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.6 m -59.06 -46.8 87.32 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.594 0.59 . . . . 26.1 112.594 179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -56.16 -52.16 65.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.98 -0.555 . . . . 50.45 109.655 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.38 -50.47 71.47 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-O 122.102 0.954 . . . . 69.15 110.887 -179.69 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.1 ttt -57.41 -47.48 81.6 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 114.488 1.292 . . . . 33.11 114.488 -178.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.1 m -78.77 -32.53 15.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 113.819 1.044 . . . . 30.47 113.819 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -71.86 -31.7 66.74 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 114.327 1.232 . . . . 49.23 114.327 -178.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -88.05 -0.08 56.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 116.046 1.869 . . . . 48.76 116.046 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.37 146.03 33.09 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 114.058 1.133 . . . . 31.93 114.058 -178.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -74.06 -43.12 58.93 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 104.515 -2.402 . . . . 50.82 104.515 176.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.4 pttt -143.27 143.1 31.58 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 117.712 2.486 . . . . 49.15 117.712 179.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 77.4 mt -115.19 137.5 48.53 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 CA-C-N 114.139 -1.391 . . . . 29.78 109.523 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -130.98 147.61 52.64 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 107.875 -1.158 . . . . 36.14 107.875 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 33.0 m -118.08 140.96 39.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 105.387 -2.079 . . . . 31.37 105.387 177.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -130.43 112.42 13.23 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.796 -1.557 . . . . 37.03 106.796 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -80.46 157.92 26.05 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.266 -1.013 . . . . 29.64 108.266 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . 0.424 ' HB3' ' OD1' ' A' ' 118' ' ' ASN . 6.3 t0 -88.82 -161.11 0.72 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 106.327 -1.731 . . . . 32.1 106.327 177.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.3 pttt -92.6 -8.77 43.29 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 115.105 1.52 . . . . 59.33 115.105 -178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.53 -148.12 23.08 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.451 -0.88 . . . . 33.99 111.348 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -65.41 148.4 51.77 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.455 0.645 . . . . 44.32 110.701 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 27.1 mtt85 -96.38 -6.58 37.2 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 117.055 2.243 . . . . 60.59 117.055 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 46.0 p -138.87 158.76 43.63 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.634 -1.617 . . . . 34.64 106.634 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.0 p30 -99.58 -179.0 4.06 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 109.433 -0.58 . . . . 28.81 109.433 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . 0.46 ' HE3' ' CE2' ' A' ' 85' ' ' TYR . 41.0 pttt -57.75 -23.88 54.25 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 114.87 1.433 . . . . 43.24 114.87 -178.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TYR . . . . . 0.46 ' CE2' ' HE3' ' A' ' 84' ' ' LYS . 97.0 m-85 -88.86 1.24 55.66 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.33 -0.395 . . . . 33.31 110.511 179.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.28 12.35 83.25 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 115.594 0.998 . . . . 26.48 115.594 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 78.5 mtm180 -82.7 138.94 33.93 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.505 0.652 . . . . 26.03 110.734 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -66.26 136.9 34.95 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 107.874 -2.09 . . . . 24.91 107.874 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.5 mt -107.35 111.62 24.05 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.877 -0.786 . . . . 26.93 108.877 179.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -154.87 175.05 14.26 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 115.095 1.517 . . . . 24.57 115.095 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -101.6 122.85 44.62 Favored 'General case' 0 N--CA 1.448 -0.536 1 N-CA-C 98.9 -4.482 . . . . 26.79 98.9 175.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -104.51 136.14 39.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 C-N-CA 120.371 -0.531 . . . . 35.6 110.356 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -116.88 133.02 56.53 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 116.288 -0.414 . . . . 32.21 110.891 -178.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -116.29 108.03 15.59 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 103.624 -2.732 . . . . 29.26 103.624 177.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 55.67 46.97 21.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.271 -0.877 . . . . 35.31 110.607 -178.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.99 0.03 63.8 Favored Glycine 0 CA--C 1.503 -0.69 0 N-CA-C 117.502 1.761 . . . . 33.22 117.502 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -105.22 124.46 49.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.26 -0.644 . . . . 74.28 109.26 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.6 ttm -69.63 118.85 13.01 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 112.438 0.533 . . . . 29.75 112.438 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 98.1 t -63.13 -40.31 88.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 C-N-CA 121.092 -0.243 . . . . 24.14 110.947 179.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.62 -49.42 72.87 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 120.83 -0.348 . . . . 24.17 110.551 -179.303 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . 0.666 ' HG3' ' NE2' ' A' ' 124' ' ' HIS . 15.6 tm-20 -67.77 -39.84 84.06 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.361 0.504 . . . . 47.97 112.361 -179.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.45 -47.01 76.72 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.08 0.467 . . . . 25.94 110.992 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 64.4 mt -63.43 -45.75 89.52 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.707 0.765 . . . . 27.65 112.309 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 20.3 t -63.34 -40.45 89.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.466 -0.568 . . . . 33.11 109.466 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 52.8 tpt85 -63.07 -27.12 69.18 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.016 0.747 . . . . 35.34 113.016 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -92.38 2.74 56.48 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.699 1.0 . . . . 37.85 113.699 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.71 30.8 74.94 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.563 -1.015 . . . . 30.3 110.563 -178.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.1 mt -107.67 2.63 23.97 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.468 0.652 . . . . 29.8 111.699 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -156.83 155.92 32.33 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.144 -1.058 . . . . 32.66 108.144 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -116.77 147.31 42.18 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 104.475 -2.417 . . . . 63.17 104.475 178.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.31 124.35 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 104.889 -2.263 . . . . 34.89 104.889 177.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -152.36 173.23 15.32 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.875 -0.33 . . . . 31.97 111.495 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 52.48 51.69 15.65 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.817 0.847 . . . . 37.97 112.607 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 44.0 t -87.58 102.94 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.642 0 C-N-CA 119.124 -1.03 . . . . 44.97 108.905 -178.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -115.48 111.69 21.14 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.683 -0.69 . . . . 47.26 111.698 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . 0.549 ' HD3' ' ND2' ' A' ' 119' ' ' ASN . 27.0 mmtm -60.48 144.03 89.08 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 106.908 -1.516 . . . . 68.56 106.908 178.042 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -90.26 13.24 53.99 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 N-CA-C 114.914 1.082 . . . . 38.33 114.914 -0.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASN . . . . . 0.424 ' OD1' ' HB3' ' A' ' 77' ' ' ASP . 74.6 m-20 -85.08 64.1 8.49 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 117.9 0.318 . . . . 35.25 111.308 -179.841 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASN . . . . . 0.549 ' ND2' ' HD3' ' A' ' 116' ' ' LYS . 39.2 p-10 -145.51 28.01 1.21 Allowed 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.165 -1.014 . . . . 43.0 113.669 -179.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 43.1 m -50.06 -44.06 51.51 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 113.121 0.786 . . . . 38.0 113.121 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 34.9 m-70 -95.7 18.26 13.34 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 115.949 1.833 . . . . 37.49 115.949 -178.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -57.42 -46.98 82.93 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 115.361 1.615 . . . . 45.57 115.361 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 19.5 mm100 -64.99 -42.41 94.54 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.232 0.456 . . . . 62.48 112.232 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HIS . . . . . 0.666 ' NE2' ' HG3' ' A' ' 101' ' ' GLU . 81.0 t60 -58.32 -46.6 85.87 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.272 0.558 . . . . 55.16 109.982 177.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 69.2 mt -68.52 -34.64 76.23 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 119.735 -0.786 . . . . 33.46 111.251 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -65.34 -39.49 92.46 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 120.066 -0.654 . . . . 45.49 111.788 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -33.83 75.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 119.087 -1.045 . . . . 70.18 110.916 179.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 73.0 m -71.02 -35.79 72.15 Favored 'General case' 0 CA--C 1.511 -0.528 0 C-N-CA 120.677 -0.409 . . . . 35.21 110.612 178.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -67.19 -37.19 83.26 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 120.399 -0.52 . . . . 46.31 111.244 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.45 -34.7 78.33 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.883 -0.599 . . . . 34.04 109.916 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLN . . . . . 0.437 ' HA ' ' HG2' ' A' ' 134' ' ' LYS . 69.5 tp60 -71.69 -45.06 63.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.402 -0.363 . . . . 44.88 110.584 179.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -59.72 -42.38 92.97 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.096 -0.705 . . . . 34.06 109.096 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . 0.463 ' HG3' ' CD2' ' A' ' 140' ' ' TRP . 1.8 ttpt -60.48 -51.01 71.28 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.182 -0.917 . . . . 70.77 110.262 179.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LYS . . . . . 0.437 ' HG2' ' HA ' ' A' ' 131' ' ' GLN . 16.5 ptpt -64.47 -32.43 74.05 Favored 'General case' 0 C--O 1.223 -0.325 0 O-C-N 123.458 0.474 . . . . 74.33 112.142 179.355 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -82.53 1.36 38.25 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.258 -0.577 . . . . 35.9 109.709 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 25.1 mmtp 50.78 47.95 23.66 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 124.282 1.033 . . . . 67.5 113.306 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 89.9 mt -83.61 135.13 34.73 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 117.156 2.28 . . . . 36.29 117.156 -178.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 36.82 -99.44 0.02 OUTLIER 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 114.991 1.478 . . . . 41.64 114.991 176.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 5.2 mt -51.49 -32.93 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.748 0.309 . . . . 46.63 111.336 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' TRP . . . . . 0.463 ' CD2' ' HG3' ' A' ' 133' ' ' LYS . 55.8 m95 -96.99 23.53 7.14 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.594 0.59 . . . . 53.01 112.594 -179.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 85.8 p . . . . . 0 C--O 1.259 1.584 0 C-N-CA 120.075 -0.65 . . . . 56.94 112.283 -179.397 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ' CA' . . . . . 0.842 'CA ' ' O ' ' A' ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' THP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . 0.842 ' O ' 'CA ' ' A' ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . 0.638 ' O ' ' HD2' ' A' ' 53' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 mt . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 106.426 -1.694 . . . . 51.219999999999999 106.426 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -114.41 139.82 49.19 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.63 -0.878 . . . . 78.950000000000003 108.63 -179.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.7 mtmm -89.0 150.28 22.87 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.238 -1.023 . . . . 47.520000000000003 108.238 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -138.21 154.07 73.64 Favored Pre-proline 0 CA--C 1.505 -0.753 0 N-CA-C 107.887 -1.153 . . . . 51.899999999999999 107.887 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -77.17 152.86 31.46 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 124.259 3.306 . . . . 31.739999999999998 111.728 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -154.18 162.33 41.26 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 103.991 -2.596 . . . . 32.119999999999997 103.991 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.2 m -123.87 128.41 49.44 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.186 -0.672 . . . . 28.41 109.186 -178.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.59 130.4 44.18 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 111.533 0.198 . . . . 33.530000000000001 111.533 -179.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 57.7 mt -103.81 -52.04 8.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 104.451 -2.426 . . . . 33.049999999999997 104.451 175.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -170.68 132.9 0.95 Allowed 'General case' 0 C--O 1.237 0.423 0 N-CA-C 113.732 1.012 . . . . 56.969999999999999 113.732 -178.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.67 134.45 36.42 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 104.887 -2.264 . . . . 32.939999999999998 104.887 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 96.7 mt -99.8 -49.87 11.05 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.502 0 CA-C-O 120.895 0.378 . . . . 46.340000000000003 110.044 -179.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -159.69 -165.23 1.48 Allowed 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 107.707 -1.22 . . . . 35.659999999999997 107.707 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -52.66 -39.74 54.76 Favored Glycine 0 C--O 1.222 -0.603 0 N-CA-C 119.026 2.37 . . . . 29.300000000000001 119.026 -176.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.5 p30 -122.27 12.77 10.27 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 116.559 2.059 . . . . 27.399999999999999 116.559 -177.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.8 m -137.77 135.08 35.99 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 108.984 -0.747 . . . . 29.649999999999999 108.984 179.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . . . -146.62 158.74 43.96 Favored 'General case' . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.706 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 5.8 mtpm? -107.02 129.0 54.86 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 106.667 -1.605 . . . . 69.269999999999996 106.667 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.4 mt -131.19 157.12 44.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.3 0.572 . . . . 28.239999999999998 110.72 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 53.5 tpp -96.7 116.07 28.5 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 101.198 -3.63 . . . . 43.450000000000003 101.198 175.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.554 ' CZ ' ' HD2' ' A' ' 28' ' ' LYS . 52.5 t80 -126.59 124.38 39.82 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.045 -1.094 . . . . 36.090000000000003 108.045 -178.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.554 ' HD2' ' CZ ' ' A' ' 27' ' ' TYR . 0.1 OUTLIER 54.83 41.93 31.54 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.808 0.813 . . . . 65.230000000000004 109.259 -179.407 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.97 16.58 70.7 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 115.645 1.018 . . . . 46.560000000000002 115.645 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -133.18 127.85 20.17 Favored Pre-proline 0 N--CA 1.447 -0.622 0 C-N-CA 119.491 -0.884 . . . . 85.390000000000001 112.958 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -66.7 132.37 28.55 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 121.722 1.614 . . . . 40.869999999999997 110.564 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 92.2 mtp -149.11 151.12 33.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.306 -0.407 . . . . 47.439999999999998 111.264 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.27 133.23 42.17 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 106.099 -1.815 . . . . 36.399999999999999 106.099 174.584 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -110.45 147.15 34.63 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 114.961 -1.018 . . . . 29.18 109.14 -179.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -123.95 128.27 49.18 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 103.478 -2.786 . . . . 25.199999999999999 103.478 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.4 mt -65.55 130.72 44.31 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.742 0.645 . . . . 27.100000000000001 112.742 -179.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -71.21 150.69 45.05 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 121.272 0.558 . . . . 29.960000000000001 112.423 178.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 24.6 mt 60.28 9.68 2.04 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 118.988 2.958 . . . . 33.450000000000003 118.988 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.4 m -138.56 166.41 23.01 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 C-N-CA 118.703 -1.199 . . . . 32.090000000000003 113.581 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -145.31 112.29 5.99 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.876 -1.056 . . . . 36.280000000000001 111.445 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 34.4 p -90.03 154.57 47.38 Favored Pre-proline 0 C--O 1.236 0.377 0 N-CA-C 104.834 -2.284 . . . . 31.690000000000001 104.834 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -61.24 145.97 97.94 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 121.719 1.613 . . . . 38.18 113.113 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -69.1 145.53 53.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 113.588 -1.642 . . . . 56.950000000000003 113.137 -179.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 39.6 p -139.04 -11.86 1.25 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.881 -1.155 . . . . 50.109999999999999 107.881 177.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.57 -75.41 0.58 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 115.56 1.689 . . . . 64.230000000000004 115.56 -176.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -51.25 119.46 12.57 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 115.933 1.827 . . . . 62.539999999999999 115.933 -177.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -61.15 -28.9 86.08 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 124.953 3.769 . . . . 69.680000000000007 114.147 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -61.2 -18.75 59.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.427 -0.351 . . . . 98.090000000000003 110.371 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -116.75 -45.35 2.79 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.62 -0.511 . . . . 80.920000000000002 109.62 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 91.42 -170.32 33.9 Favored Glycine 0 C--N 1.33 0.249 0 N-CA-C 109.244 -1.543 . . . . 76.159999999999997 109.244 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 42.3 t -85.16 101.75 10.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 106.283 -1.747 . . . . 66.409999999999997 106.283 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -76.14 147.57 38.43 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.696 -0.684 . . . . 62.969999999999999 110.573 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.638 ' HD2' ' O ' ' A' ' 257' ' ' HOH . 42.0 tptt -53.89 131.53 40.18 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.121 -0.491 . . . . 74.540000000000006 109.931 179.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.524 ' CD2' ' HG3' ' A' ' 53' ' ' LYS . 64.1 m-85 83.15 -4.05 1.25 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.917 1.08 . . . . 51.329999999999998 113.917 -178.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -59.9 -56.51 24.39 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.415 -1.074 . . . . 35.5 110.415 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.01 -38.01 95.34 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.583 2.189 . . . . 34.75 112.023 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.498 ' OE1' ' HA ' ' A' ' 54' ' ' TYR . 31.3 mp0 -65.27 -45.88 82.74 Favored 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.395 0.434 . . . . 45.140000000000001 111.191 178.655 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.46 -39.26 92.8 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 110.42 -0.215 . . . . 28.75 110.42 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.9 m -64.38 -44.23 92.03 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.949 -0.7 . . . . 38.880000000000003 110.84 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.22 -40.96 97.87 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.981 -0.288 . . . . 29.600000000000001 111.67 -179.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -61.38 -53.14 60.44 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.776 -0.453 . . . . 28.879999999999999 109.776 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.6 m -59.06 -46.8 87.32 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.594 0.59 . . . . 26.100000000000001 112.594 179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -56.16 -52.16 65.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.98 -0.555 . . . . 50.450000000000003 109.655 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.38 -50.47 71.47 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-O 122.102 0.954 . . . . 69.150000000000006 110.887 -179.69 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.1 ttt -57.41 -47.48 81.6 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 114.488 1.292 . . . . 33.109999999999999 114.488 -178.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.1 m -78.77 -32.53 15.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 113.819 1.044 . . . . 30.469999999999999 113.819 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -71.86 -31.7 66.74 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 114.327 1.232 . . . . 49.229999999999997 114.327 -178.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -88.05 -0.08 56.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 116.046 1.869 . . . . 48.759999999999998 116.046 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.37 146.03 33.09 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 114.058 1.133 . . . . 31.93 114.058 -178.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -74.06 -43.12 58.93 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 104.515 -2.402 . . . . 50.82 104.515 176.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.4 pttt -143.27 143.1 31.58 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 117.712 2.486 . . . . 49.149999999999999 117.712 179.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 77.4 mt -115.19 137.5 48.53 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 CA-C-N 114.139 -1.391 . . . . 29.780000000000001 109.523 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -130.98 147.61 52.64 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 107.875 -1.158 . . . . 36.140000000000001 107.875 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 33.0 m -118.08 140.96 39.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 105.387 -2.079 . . . . 31.370000000000001 105.387 177.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -130.43 112.42 13.23 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.796 -1.557 . . . . 37.030000000000001 106.796 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -80.46 157.92 26.05 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.266 -1.013 . . . . 29.640000000000001 108.266 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.424 ' HB3' ' OD1' ' A' ' 118' ' ' ASN . 6.3 t0 -88.82 -161.11 0.72 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 106.327 -1.731 . . . . 32.100000000000001 106.327 177.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.3 pttt -92.6 -8.77 43.29 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 115.105 1.52 . . . . 59.329999999999998 115.105 -178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.53 -148.12 23.08 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.451 -0.88 . . . . 33.990000000000002 111.348 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -65.41 148.4 51.77 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.455 0.645 . . . . 44.32 110.701 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 27.1 mtt85 -96.38 -6.58 37.2 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 117.055 2.243 . . . . 60.590000000000003 117.055 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 46.0 p -138.87 158.76 43.63 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.634 -1.617 . . . . 34.640000000000001 106.634 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.0 p30 -99.58 -179.0 4.06 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 109.433 -0.58 . . . . 28.809999999999999 109.433 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.46 ' HE3' ' CE2' ' A' ' 85' ' ' TYR . 41.0 pttt -57.75 -23.88 54.25 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 114.87 1.433 . . . . 43.240000000000002 114.87 -178.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.46 ' CE2' ' HE3' ' A' ' 84' ' ' LYS . 97.0 m-85 -88.86 1.24 55.66 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.33 -0.395 . . . . 33.310000000000002 110.511 179.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.28 12.35 83.25 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 115.594 0.998 . . . . 26.48 115.594 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 78.5 mtm180 -82.7 138.94 33.93 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.505 0.652 . . . . 26.030000000000001 110.734 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -66.26 136.9 34.95 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 107.874 -2.09 . . . . 24.91 107.874 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.5 mt -107.35 111.62 24.05 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.877 -0.786 . . . . 26.93 108.877 179.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -154.87 175.05 14.26 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 115.095 1.517 . . . . 24.57 115.095 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -101.6 122.85 44.62 Favored 'General case' 0 N--CA 1.448 -0.536 1 N-CA-C 98.9 -4.482 . . . . 26.789999999999999 98.9 175.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -104.51 136.14 39.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 C-N-CA 120.371 -0.531 . . . . 35.600000000000001 110.356 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -116.88 133.02 56.53 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 116.288 -0.414 . . . . 32.210000000000001 110.891 -178.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -116.29 108.03 15.59 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 103.624 -2.732 . . . . 29.260000000000002 103.624 177.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 55.67 46.97 21.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.271 -0.877 . . . . 35.310000000000002 110.607 -178.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.99 0.03 63.8 Favored Glycine 0 CA--C 1.503 -0.69 0 N-CA-C 117.502 1.761 . . . . 33.219999999999999 117.502 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -105.22 124.46 49.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.26 -0.644 . . . . 74.280000000000001 109.26 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.6 ttm -69.63 118.85 13.01 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 112.438 0.533 . . . . 29.75 112.438 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 98.1 t -63.13 -40.31 88.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 C-N-CA 121.092 -0.243 . . . . 24.140000000000001 110.947 179.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.62 -49.42 72.87 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 120.83 -0.348 . . . . 24.170000000000002 110.551 -179.303 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.666 ' HG3' ' NE2' ' A' ' 124' ' ' HIS . 15.6 tm-20 -67.77 -39.84 84.06 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.361 0.504 . . . . 47.969999999999999 112.361 -179.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.45 -47.01 76.72 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.08 0.467 . . . . 25.940000000000001 110.992 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 64.4 mt -63.43 -45.75 89.52 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.707 0.765 . . . . 27.649999999999999 112.309 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 20.3 t -63.34 -40.45 89.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.466 -0.568 . . . . 33.109999999999999 109.466 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 52.8 tpt85 -63.07 -27.12 69.18 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.016 0.747 . . . . 35.340000000000003 113.016 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -92.38 2.74 56.48 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.699 1.0 . . . . 37.850000000000001 113.699 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.71 30.8 74.94 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.563 -1.015 . . . . 30.300000000000001 110.563 -178.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.1 mt -107.67 2.63 23.97 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.468 0.652 . . . . 29.800000000000001 111.699 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -156.83 155.92 32.33 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.144 -1.058 . . . . 32.659999999999997 108.144 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -116.77 147.31 42.18 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 104.475 -2.417 . . . . 63.170000000000002 104.475 178.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.31 124.35 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 104.889 -2.263 . . . . 34.890000000000001 104.889 177.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -152.36 173.23 15.32 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.875 -0.33 . . . . 31.969999999999999 111.495 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 52.48 51.69 15.65 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.817 0.847 . . . . 37.969999999999999 112.607 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 44.0 t -87.58 102.94 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.642 0 C-N-CA 119.124 -1.03 . . . . 44.969999999999999 108.905 -178.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -115.48 111.69 21.14 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.683 -0.69 . . . . 47.259999999999998 111.698 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.549 ' HD3' ' ND2' ' A' ' 119' ' ' ASN . 27.0 mmtm -60.48 144.03 89.08 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 106.908 -1.516 . . . . 68.560000000000002 106.908 178.042 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -90.26 13.24 53.99 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 N-CA-C 114.914 1.082 . . . . 38.329999999999998 114.914 -0.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.424 ' OD1' ' HB3' ' A' ' 77' ' ' ASP . 74.6 m-20 -85.08 64.1 8.49 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 117.9 0.318 . . . . 35.25 111.308 -179.841 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.549 ' ND2' ' HD3' ' A' ' 116' ' ' LYS . 39.2 p-10 -145.51 28.01 1.21 Allowed 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.165 -1.014 . . . . 43.0 113.669 -179.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 43.1 m -50.06 -44.06 51.51 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 113.121 0.786 . . . . 38.0 113.121 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 34.9 m-70 -95.7 18.26 13.34 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 115.949 1.833 . . . . 37.490000000000002 115.949 -178.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -57.42 -46.98 82.93 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 115.361 1.615 . . . . 45.57 115.361 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 19.5 mm100 -64.99 -42.41 94.54 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.232 0.456 . . . . 62.479999999999997 112.232 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HIS . . . . . 0.666 ' NE2' ' HG3' ' A' ' 101' ' ' GLU . 81.0 t60 -58.32 -46.6 85.87 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.272 0.558 . . . . 55.159999999999997 109.982 177.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 69.2 mt -68.52 -34.64 76.23 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 119.735 -0.786 . . . . 33.460000000000001 111.251 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -65.34 -39.49 92.46 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 120.066 -0.654 . . . . 45.490000000000002 111.788 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -33.83 75.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 119.087 -1.045 . . . . 70.180000000000007 110.916 179.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 73.0 m -71.02 -35.79 72.15 Favored 'General case' 0 CA--C 1.511 -0.528 0 C-N-CA 120.677 -0.409 . . . . 35.210000000000001 110.612 178.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -67.19 -37.19 83.26 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 120.399 -0.52 . . . . 46.310000000000002 111.244 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.45 -34.7 78.33 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.883 -0.599 . . . . 34.039999999999999 109.916 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.437 ' HA ' ' HG2' ' A' ' 134' ' ' LYS . 69.5 tp60 -71.69 -45.06 63.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.402 -0.363 . . . . 44.880000000000003 110.584 179.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -59.72 -42.38 92.97 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.096 -0.705 . . . . 34.060000000000002 109.096 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.463 ' HG3' ' CD2' ' A' ' 140' ' ' TRP . 1.8 ttpt -60.48 -51.01 71.28 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.182 -0.917 . . . . 70.769999999999996 110.262 179.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.437 ' HG2' ' HA ' ' A' ' 131' ' ' GLN . 16.5 ptpt -64.47 -32.43 74.05 Favored 'General case' 0 C--O 1.223 -0.325 0 O-C-N 123.458 0.474 . . . . 74.329999999999998 112.142 179.355 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -82.53 1.36 38.25 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.258 -0.577 . . . . 35.899999999999999 109.709 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 25.1 mmtp 50.78 47.95 23.66 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 124.282 1.033 . . . . 67.5 113.306 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 89.9 mt -83.61 135.13 34.73 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 117.156 2.28 . . . . 36.289999999999999 117.156 -178.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 36.82 -99.44 0.02 OUTLIER 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 114.991 1.478 . . . . 41.640000000000001 114.991 176.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 5.2 mt -51.49 -32.93 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.748 0.309 . . . . 46.630000000000003 111.336 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.463 ' CD2' ' HG3' ' A' ' 133' ' ' LYS . 55.8 m95 -96.99 23.53 7.14 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.594 0.59 . . . . 53.009999999999998 112.594 -179.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 85.8 p . . . . . 0 C--O 1.259 1.584 0 C-N-CA 120.075 -0.65 . . . . 56.939999999999998 112.283 -179.397 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ' CA' . . . . . 0.842 'CA ' ' O ' ' A' ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' THP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . 0.842 ' O ' 'CA ' ' A' ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . 0.638 ' O ' ' HD2' ' A' ' 53' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_