data_1vif_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 1vif _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 ' 19' ' ' PRO . . . . . 0.463 ' C ' ' N ' ' A' ' 21' ' ' ASN . 11.5 Cg_exo . . . . . 0 N--CA 1.452 -0.918 0 CA-C-O 122.038 0.766 . . . . 100.0 112.126 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.6 15.03 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 123.185 1.469 . . . . 100.0 114.035 -177.853 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . 0.463 ' N ' ' C ' ' A' ' 19' ' ' PRO . 0.1 OUTLIER -170.46 -36.98 0.02 OUTLIER 'General case' 1 C--N 1.574 10.355 1 C-N-CA 109.603 -4.839 . . . . 100.0 112.576 -168.87 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -44.48 145.36 0.87 Allowed 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.911 0.757 . . . . 55.42 110.843 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 34.4 m -68.63 -36.55 78.77 Favored 'General case' 0 C--N 1.354 0.783 0 CA-C-O 123.731 1.729 . . . . 39.58 111.954 178.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -129.41 161.92 29.25 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 120.341 -1.474 . . . . 28.04 113.252 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -121.33 166.52 14.22 Favored Glycine 0 N--CA 1.434 -1.49 0 CA-C-N 113.995 -1.457 . . . . 19.54 111.376 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 94.6 mmm -54.32 129.03 33.96 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-O 122.786 1.279 . . . . 33.66 110.808 179.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.4 -9.62 71.71 Favored Glycine 0 N--CA 1.41 -3.054 0 C-N-CA 119.34 -1.41 . . . . 16.67 113.176 177.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -63.43 147.89 50.01 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 119.718 1.759 . . . . 16.8 109.641 178.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -96.23 127.33 42.14 Favored 'General case' 0 C--O 1.25 1.131 0 N-CA-C 107.624 -1.25 . . . . 38.77 107.624 177.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 18.0 m -141.1 171.17 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.146 0 C-N-CA 118.364 -1.334 . . . . 16.59 111.691 -177.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . 0.412 ' NE ' ' OE2' ' A' ' 75' ' ' GLU . 17.2 ptt85 -145.05 160.53 41.23 Favored 'General case' 0 C--O 1.205 -1.24 0 O-C-N 124.479 1.112 . . . . 100.0 110.347 175.87 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -77.13 134.94 38.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.47 -2.419 . . . . 29.1 104.47 176.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -31.37 70.41 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 115.205 1.557 . . . . 78.13 115.205 -179.321 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 98.6 p -159.15 173.21 16.74 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 120.365 -1.459 . . . . 21.71 112.033 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.16 -144.46 41.22 Favored Glycine 0 N--CA 1.48 1.625 0 N-CA-C 110.12 -1.192 . . . . 15.04 110.12 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.01 140.74 30.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.861 1.315 . . . . 10.92 110.78 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.66 156.28 20.06 Favored 'General case' 0 C--N 1.316 -0.854 0 C-N-CA 117.246 -1.781 . . . . 9.45 114.189 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 39.4 t-105 -162.77 138.75 7.22 Favored 'General case' 0 C--O 1.217 -0.609 0 O-C-N 124.661 1.225 . . . . 16.56 108.724 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -157.81 134.77 10.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 121.189 1.813 . . . . 37.09 109.042 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.32 -154.11 23.71 Favored Glycine 0 N--CA 1.426 -2.026 0 C-N-CA 118.67 -1.729 . . . . 16.7 110.056 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.56 145.7 30.6 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 116.154 1.909 . . . . 100.0 116.154 -176.173 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 33.4 mm -68.64 123.74 22.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.202 -0.908 . . . . 15.36 109.716 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.3 m -126.57 8.51 3.75 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.16 0 CA-C-O 121.862 0.839 . . . . 13.34 112.483 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -179.44 -177.59 47.86 Favored Glycine 0 N--CA 1.431 -1.647 0 C-N-CA 116.366 -2.825 . . . . 15.3 111.511 -178.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' TRP . . . . . . . . . . . . 0.263 0.0 OUTLIER -151.87 158.49 43.29 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 113.978 1.103 . . . . 71.63 113.978 -176.633 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 18.7 p90 -152.95 162.12 41.7 Favored 'General case' 0 CA--C 1.486 -1.485 0 O-C-N 121.066 -1.021 . . . . 9.38 110.234 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.2 t -151.0 123.37 8.37 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 125.591 1.807 . . . . 32.12 112.011 -176.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.7 p -136.74 173.85 11.26 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 106.711 -1.589 . . . . 18.37 106.711 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -63.04 -37.03 85.56 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 118.672 -1.211 . . . . 31.31 111.654 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.32 -34.26 61.23 Favored 'General case' 0 C--O 1.207 -1.171 0 CA-C-N 115.495 -0.775 . . . . 57.51 113.055 -179.203 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 62.8 m -130.88 82.57 63.85 Favored Pre-proline 0 C--O 1.215 -0.739 0 N-CA-C 108.297 -1.001 . . . . 13.99 108.297 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -66.9 -14.92 45.57 Favored 'Trans proline' 0 N--CA 1.435 -1.914 0 N-CA-C 114.543 0.939 . . . . 14.86 114.543 -176.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLU . . . . . 0.412 ' OE2' ' OH ' ' A' ' 55' ' ' TYR . 80.9 tt0 -143.24 99.95 3.54 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 107.41 -1.33 . . . . 17.25 107.41 178.951 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -125.62 156.21 19.27 Favored Glycine 0 C--N 1.316 -0.57 0 CA-C-N 115.096 -0.956 . . . . 12.1 111.833 -178.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' TYR . . . . . 0.412 ' OH ' ' OE2' ' A' ' 53' ' ' GLU . 99.0 m-85 -130.26 149.1 52.1 Favored 'General case' 0 C--N 1.361 1.083 0 CA-C-O 121.525 0.678 . . . . 12.53 112.768 179.8 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -101.71 132.15 47.58 Favored 'General case' 0 C--O 1.244 0.815 0 N-CA-C 103.994 -2.595 . . . . 9.17 103.994 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.5 t -126.22 126.23 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 O-C-N 124.586 1.179 . . . . 11.32 110.353 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -90.36 127.59 36.22 Favored 'General case' 0 C--O 1.248 1.008 0 N-CA-C 108.042 -1.096 . . . . 17.39 108.042 178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.9 t -62.34 138.81 58.51 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 117.462 -1.256 . . . . 17.09 110.933 -177.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -85.07 -8.98 58.44 Favored 'General case' 0 N--CA 1.435 -1.178 0 O-C-N 124.306 1.003 . . . . 23.08 109.696 177.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -98.95 -24.43 14.94 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 121.066 -1.021 . . . . 15.51 112.862 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 56.9 m-70 -128.45 83.64 65.56 Favored Pre-proline 0 C--N 1.313 -1.018 0 N-CA-C 108.367 -0.975 . . . . 17.71 108.367 -177.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -52.57 137.09 58.23 Favored 'Trans proline' 0 C--O 1.217 -0.559 0 O-C-N 123.605 1.318 . . . . 14.48 113.76 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.85 -21.15 40.98 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 121.385 0.436 . . . . 14.35 113.654 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 57.7 m -87.46 122.48 31.25 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.024 -1.28 . . . . 19.43 111.589 -178.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 99.6 t -119.43 141.31 40.03 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 CA-C-N 115.287 -0.87 . . . . 8.84 111.205 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLN . . . . . 0.409 ' CG ' ' C4 ' ' A' ' 1' ' ' FOL . 0.2 OUTLIER -129.97 152.25 49.65 Favored 'General case' 0 C--O 1.247 0.949 0 N-CA-C 105.928 -1.878 . . . . 100.0 105.928 176.355 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 23.7 pt -113.91 145.12 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 CA-C-N 118.82 0.737 . . . . 20.63 110.818 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . 0.259 90.3 m-85 -147.25 156.44 46.4 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 114.125 1.157 . . . . 24.01 114.125 -178.669 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -74.06 150.94 43.88 Favored 'Trans proline' 0 N--CA 1.448 -1.178 0 N-CA-C 107.322 -1.838 . . . . 14.67 107.322 177.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 14.5 p -49.49 -39.54 13.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 119.557 1.071 . . . . 22.74 113.045 -179.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.19 -20.7 63.06 Favored 'General case' 0 C--O 1.198 -1.632 0 N-CA-C 115.744 1.757 . . . . 15.68 115.744 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.77 -3.73 58.98 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 114.998 1.481 . . . . 13.86 114.998 -178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.98 151.47 38.12 Favored 'General case' 1 C--N 1.192 -6.24 1 C-N-CA 132.052 4.141 . . . . 23.01 110.145 -163.768 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . 0.412 ' OE2' ' NE ' ' A' ' 31' ' ' ARG . 11.9 pt-20 -144.76 142.86 30.34 Favored 'General case' 0 C--N 1.366 1.311 0 O-C-N 117.938 -2.976 . . . . 41.14 109.869 168.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.0 ttp85 -75.41 144.76 42.05 Favored 'General case' 0 C--O 1.208 -1.084 0 O-C-N 121.591 -0.693 . . . . 42.94 111.112 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.9 pt -127.44 122.35 59.27 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.319 0 N-CA-C 105.798 -1.926 . . . . 31.05 105.798 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . 0.992 50.5 m-20 . . . . . 0 C--O 1.257 1.488 0 C-N-CA 128.969 2.908 . . . . 100.0 117.685 3.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' FOL . . . . . 0.79 ' N5 ' ' O ' ' A' ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . 0.79 ' O ' ' N5 ' ' A' ' 1' ' ' FOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . 0.541 ' C ' ' H ' ' A' ' 21' ' ' ASN . 11.5 Cg_exo . . . . . 0 N--CA 1.452 -0.918 0 CA-C-O 122.038 0.766 . . . . 100.0 112.126 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.6 15.03 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 123.185 1.469 . . . . 100.0 114.035 -177.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . 0.541 ' H ' ' C ' ' A' ' 19' ' ' PRO . 0.1 OUTLIER -170.46 -36.98 0.02 OUTLIER 'General case' 1 C--N 1.574 10.355 1 C-N-CA 109.603 -4.839 . . . . 100.0 112.576 -168.87 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . 0.468 ' HB2' ' HG2' ' A' ' 19' ' ' PRO . . . -44.48 145.36 0.87 Allowed 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.911 0.757 . . . . 55.420000000000002 110.843 -177.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 34.4 m -68.63 -36.55 78.77 Favored 'General case' 0 C--N 1.354 0.783 0 CA-C-O 123.731 1.729 . . . . 39.579999999999998 111.954 178.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -129.41 161.92 29.25 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 120.341 -1.474 . . . . 28.039999999999999 113.252 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -121.33 166.52 14.22 Favored Glycine 0 N--CA 1.434 -1.49 0 CA-C-N 113.995 -1.457 . . . . 19.539999999999999 111.376 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 94.6 mmm -54.32 129.03 33.96 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-O 122.786 1.279 . . . . 33.659999999999997 110.808 179.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.4 -9.62 71.71 Favored Glycine 0 N--CA 1.41 -3.054 0 C-N-CA 119.34 -1.41 . . . . 16.670000000000002 113.176 177.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -63.43 147.89 50.01 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 119.718 1.759 . . . . 16.800000000000001 109.641 178.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -96.23 127.33 42.14 Favored 'General case' 0 C--O 1.25 1.131 0 N-CA-C 107.624 -1.25 . . . . 38.770000000000003 107.624 177.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 18.0 m -141.1 171.17 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.146 0 C-N-CA 118.364 -1.334 . . . . 16.59 111.691 -177.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . 0.412 ' NE ' ' OE2' ' A' ' 75' ' ' GLU . 17.2 ptt85 -145.05 160.53 41.23 Favored 'General case' 0 C--O 1.205 -1.24 0 O-C-N 124.479 1.112 . . . . 100.0 110.347 175.87 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -77.13 134.94 38.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.47 -2.419 . . . . 29.100000000000001 104.47 176.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . 0.502 ' HD2' ' C ' ' A' ' 74' ' ' LEU . 0.0 OUTLIER -68.7 -31.37 70.41 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 115.205 1.557 . . . . 78.129999999999995 115.205 -179.321 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 98.6 p -159.15 173.21 16.74 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 120.365 -1.459 . . . . 21.710000000000001 112.033 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.16 -144.46 41.22 Favored Glycine 0 N--CA 1.48 1.625 0 N-CA-C 110.12 -1.192 . . . . 15.039999999999999 110.12 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.01 140.74 30.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.861 1.315 . . . . 10.92 110.78 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.66 156.28 20.06 Favored 'General case' 0 C--N 1.316 -0.854 0 C-N-CA 117.246 -1.781 . . . . 9.4499999999999993 114.189 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 39.4 t-105 -162.77 138.75 7.22 Favored 'General case' 0 C--O 1.217 -0.609 0 O-C-N 124.661 1.225 . . . . 16.559999999999999 108.724 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -157.81 134.77 10.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 121.189 1.813 . . . . 37.090000000000003 109.042 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.32 -154.11 23.71 Favored Glycine 0 N--CA 1.426 -2.026 0 C-N-CA 118.67 -1.729 . . . . 16.699999999999999 110.056 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 pm0 -105.56 145.7 30.6 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 116.154 1.909 . . . . 100.0 116.154 -176.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 33.4 mm -68.64 123.74 22.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.202 -0.908 . . . . 15.359999999999999 109.716 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.3 m -126.57 8.51 3.75 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.16 0 CA-C-O 121.862 0.839 . . . . 13.34 112.483 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -179.44 -177.59 47.86 Favored Glycine 0 N--CA 1.431 -1.647 0 C-N-CA 116.366 -2.825 . . . . 15.300000000000001 111.511 -178.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' TRP . . . . . 0.482 ' HZ3' ' HG3' ' A' ' 53' ' ' GLU 0.263 0.0 OUTLIER -151.87 158.49 43.29 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 113.978 1.103 . . . . 71.629999999999995 113.978 -176.633 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 18.7 p90 -152.95 162.12 41.7 Favored 'General case' 0 CA--C 1.486 -1.485 0 O-C-N 121.066 -1.021 . . . . 9.3800000000000008 110.234 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.2 t -151.0 123.37 8.37 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 125.591 1.807 . . . . 32.119999999999997 112.011 -176.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.7 p -136.74 173.85 11.26 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 106.711 -1.589 . . . . 18.370000000000001 106.711 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -63.04 -37.03 85.56 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 118.672 -1.211 . . . . 31.309999999999999 111.654 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.32 -34.26 61.23 Favored 'General case' 0 C--O 1.207 -1.171 0 CA-C-N 115.495 -0.775 . . . . 57.509999999999998 113.055 -179.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 62.8 m -130.88 82.57 63.85 Favored Pre-proline 0 C--O 1.215 -0.739 0 N-CA-C 108.297 -1.001 . . . . 13.99 108.297 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -66.9 -14.92 45.57 Favored 'Trans proline' 0 N--CA 1.435 -1.914 0 N-CA-C 114.543 0.939 . . . . 14.859999999999999 114.543 -176.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLU . . . . . 0.482 ' HG3' ' HZ3' ' A' ' 45' ' ' TRP . 80.9 tt0 -143.24 99.95 3.54 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 107.41 -1.33 . . . . 17.25 107.41 178.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -125.62 156.21 19.27 Favored Glycine 0 C--N 1.316 -0.57 0 CA-C-N 115.096 -0.956 . . . . 12.1 111.833 -178.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -130.26 149.1 52.1 Favored 'General case' 0 C--N 1.361 1.083 0 CA-C-O 121.525 0.678 . . . . 12.529999999999999 112.768 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -101.71 132.15 47.58 Favored 'General case' 0 C--O 1.244 0.815 0 N-CA-C 103.994 -2.595 . . . . 9.1699999999999999 103.994 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.5 t -126.22 126.23 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 O-C-N 124.586 1.179 . . . . 11.32 110.353 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -90.36 127.59 36.22 Favored 'General case' 0 C--O 1.248 1.008 0 N-CA-C 108.042 -1.096 . . . . 17.390000000000001 108.042 178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.9 t -62.34 138.81 58.51 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 117.462 -1.256 . . . . 17.09 110.933 -177.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -85.07 -8.98 58.44 Favored 'General case' 0 N--CA 1.435 -1.178 0 O-C-N 124.306 1.003 . . . . 23.079999999999998 109.696 177.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -98.95 -24.43 14.94 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 121.066 -1.021 . . . . 15.51 112.862 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 56.9 m-70 -128.45 83.64 65.56 Favored Pre-proline 0 C--N 1.313 -1.018 0 N-CA-C 108.367 -0.975 . . . . 17.710000000000001 108.367 -177.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -52.57 137.09 58.23 Favored 'Trans proline' 0 C--O 1.217 -0.559 0 O-C-N 123.605 1.318 . . . . 14.48 113.76 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.85 -21.15 40.98 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 121.385 0.436 . . . . 14.35 113.654 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 57.7 m -87.46 122.48 31.25 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.024 -1.28 . . . . 19.43 111.589 -178.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 99.6 t -119.43 141.31 40.03 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 CA-C-N 115.287 -0.87 . . . . 8.8399999999999999 111.205 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLN . . . . . 0.853 ' HG3' ' C4 ' ' A' ' 1' ' ' FOL . 0.2 OUTLIER -129.97 152.25 49.65 Favored 'General case' 0 C--O 1.247 0.949 0 N-CA-C 105.928 -1.878 . . . . 100.0 105.928 176.355 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 23.7 pt -113.91 145.12 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 CA-C-N 118.82 0.737 . . . . 20.629999999999999 110.818 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . 0.259 90.3 m-85 -147.25 156.44 46.4 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 114.125 1.157 . . . . 24.010000000000002 114.125 -178.669 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -74.06 150.94 43.88 Favored 'Trans proline' 0 N--CA 1.448 -1.178 0 N-CA-C 107.322 -1.838 . . . . 14.67 107.322 177.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 14.5 p -49.49 -39.54 13.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 119.557 1.071 . . . . 22.739999999999998 113.045 -179.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.19 -20.7 63.06 Favored 'General case' 0 C--O 1.198 -1.632 0 N-CA-C 115.744 1.757 . . . . 15.68 115.744 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.77 -3.73 58.98 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 114.998 1.481 . . . . 13.859999999999999 114.998 -178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . 0.502 ' C ' ' HD2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -118.98 151.47 38.12 Favored 'General case' 1 C--N 1.192 -6.24 1 C-N-CA 132.052 4.141 . . . . 23.010000000000002 110.145 -163.768 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . 0.412 ' OE2' ' NE ' ' A' ' 31' ' ' ARG . 11.9 pt-20 -144.76 142.86 30.34 Favored 'General case' 0 C--N 1.366 1.311 0 O-C-N 117.938 -2.976 . . . . 41.140000000000001 109.869 168.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.0 ttp85 -75.41 144.76 42.05 Favored 'General case' 0 C--O 1.208 -1.084 0 O-C-N 121.591 -0.693 . . . . 42.939999999999998 111.112 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.9 pt -127.44 122.35 59.27 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.319 0 N-CA-C 105.798 -1.926 . . . . 31.050000000000001 105.798 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . 0.992 50.5 m-20 . . . . . 0 C--O 1.257 1.488 0 C-N-CA 128.969 2.908 . . . . 100.0 117.685 3.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' FOL . . . . . 0.853 ' C4 ' ' HG3' ' A' ' 67' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . 0.79 ' O ' ' N5 ' ' A' ' 1' ' ' FOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.541 ' C ' ' H ' ' A' ' 21' ' ' ASN . 11.5 Cg_exo . . . . . 0 N--CA 1.452 -0.918 0 CA-C-O 122.038 0.766 . . . . 100.0 112.126 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.6 15.03 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 123.185 1.469 . . . . 100.0 114.035 -177.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.541 ' H ' ' C ' ' A' ' 19' ' ' PRO . 0.1 OUTLIER -170.46 -36.98 0.02 OUTLIER 'General case' 1 C--N 1.574 10.355 1 C-N-CA 109.603 -4.839 . . . . 100.0 112.576 -168.87 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.468 ' HB2' ' HG2' ' A' ' 19' ' ' PRO . . . -44.48 145.36 0.87 Allowed 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.911 0.757 . . . . 55.420000000000002 110.843 -177.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 34.4 m -68.63 -36.55 78.77 Favored 'General case' 0 C--N 1.354 0.783 0 CA-C-O 123.731 1.729 . . . . 39.579999999999998 111.954 178.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -129.41 161.92 29.25 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 120.341 -1.474 . . . . 28.039999999999999 113.252 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -121.33 166.52 14.22 Favored Glycine 0 N--CA 1.434 -1.49 0 CA-C-N 113.995 -1.457 . . . . 19.539999999999999 111.376 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 94.6 mmm -54.32 129.03 33.96 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-O 122.786 1.279 . . . . 33.659999999999997 110.808 179.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.4 -9.62 71.71 Favored Glycine 0 N--CA 1.41 -3.054 0 C-N-CA 119.34 -1.41 . . . . 16.670000000000002 113.176 177.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -63.43 147.89 50.01 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 119.718 1.759 . . . . 16.800000000000001 109.641 178.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -96.23 127.33 42.14 Favored 'General case' 0 C--O 1.25 1.131 0 N-CA-C 107.624 -1.25 . . . . 38.770000000000003 107.624 177.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 18.0 m -141.1 171.17 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.146 0 C-N-CA 118.364 -1.334 . . . . 16.59 111.691 -177.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.412 ' NE ' ' OE2' ' A' ' 75' ' ' GLU . 17.2 ptt85 -145.05 160.53 41.23 Favored 'General case' 0 C--O 1.205 -1.24 0 O-C-N 124.479 1.112 . . . . 100.0 110.347 175.87 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -77.13 134.94 38.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.47 -2.419 . . . . 29.100000000000001 104.47 176.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.502 ' HD2' ' C ' ' A' ' 74' ' ' LEU . 0.0 OUTLIER -68.7 -31.37 70.41 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 115.205 1.557 . . . . 78.129999999999995 115.205 -179.321 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 98.6 p -159.15 173.21 16.74 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 120.365 -1.459 . . . . 21.710000000000001 112.033 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.16 -144.46 41.22 Favored Glycine 0 N--CA 1.48 1.625 0 N-CA-C 110.12 -1.192 . . . . 15.039999999999999 110.12 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.01 140.74 30.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.861 1.315 . . . . 10.92 110.78 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.66 156.28 20.06 Favored 'General case' 0 C--N 1.316 -0.854 0 C-N-CA 117.246 -1.781 . . . . 9.4499999999999993 114.189 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 39.4 t-105 -162.77 138.75 7.22 Favored 'General case' 0 C--O 1.217 -0.609 0 O-C-N 124.661 1.225 . . . . 16.559999999999999 108.724 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -157.81 134.77 10.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 121.189 1.813 . . . . 37.090000000000003 109.042 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.32 -154.11 23.71 Favored Glycine 0 N--CA 1.426 -2.026 0 C-N-CA 118.67 -1.729 . . . . 16.699999999999999 110.056 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.56 145.7 30.6 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 116.154 1.909 . . . . 100.0 116.154 -176.173 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 33.4 mm -68.64 123.74 22.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.202 -0.908 . . . . 15.359999999999999 109.716 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.3 m -126.57 8.51 3.75 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.16 0 CA-C-O 121.862 0.839 . . . . 13.34 112.483 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -179.44 -177.59 47.86 Favored Glycine 0 N--CA 1.431 -1.647 0 C-N-CA 116.366 -2.825 . . . . 15.300000000000001 111.511 -178.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.482 ' HZ3' ' HG3' ' A' ' 53' ' ' GLU 0.263 0.0 OUTLIER -151.87 158.49 43.29 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 113.978 1.103 . . . . 71.629999999999995 113.978 -176.633 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 18.7 p90 -152.95 162.12 41.7 Favored 'General case' 0 CA--C 1.486 -1.485 0 O-C-N 121.066 -1.021 . . . . 9.3800000000000008 110.234 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.2 t -151.0 123.37 8.37 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 125.591 1.807 . . . . 32.119999999999997 112.011 -176.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.7 p -136.74 173.85 11.26 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 106.711 -1.589 . . . . 18.370000000000001 106.711 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -63.04 -37.03 85.56 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 118.672 -1.211 . . . . 31.309999999999999 111.654 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.32 -34.26 61.23 Favored 'General case' 0 C--O 1.207 -1.171 0 CA-C-N 115.495 -0.775 . . . . 57.509999999999998 113.055 -179.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 62.8 m -130.88 82.57 63.85 Favored Pre-proline 0 C--O 1.215 -0.739 0 N-CA-C 108.297 -1.001 . . . . 13.99 108.297 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -66.9 -14.92 45.57 Favored 'Trans proline' 0 N--CA 1.435 -1.914 0 N-CA-C 114.543 0.939 . . . . 14.859999999999999 114.543 -176.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.482 ' HG3' ' HZ3' ' A' ' 45' ' ' TRP . 80.9 tt0 -143.24 99.95 3.54 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 107.41 -1.33 . . . . 17.25 107.41 178.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -125.62 156.21 19.27 Favored Glycine 0 C--N 1.316 -0.57 0 CA-C-N 115.096 -0.956 . . . . 12.1 111.833 -178.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -130.26 149.1 52.1 Favored 'General case' 0 C--N 1.361 1.083 0 CA-C-O 121.525 0.678 . . . . 12.529999999999999 112.768 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -101.71 132.15 47.58 Favored 'General case' 0 C--O 1.244 0.815 0 N-CA-C 103.994 -2.595 . . . . 9.1699999999999999 103.994 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.5 t -126.22 126.23 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 O-C-N 124.586 1.179 . . . . 11.32 110.353 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -90.36 127.59 36.22 Favored 'General case' 0 C--O 1.248 1.008 0 N-CA-C 108.042 -1.096 . . . . 17.390000000000001 108.042 178.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.9 t -62.34 138.81 58.51 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 117.462 -1.256 . . . . 17.09 110.933 -177.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -85.07 -8.98 58.44 Favored 'General case' 0 N--CA 1.435 -1.178 0 O-C-N 124.306 1.003 . . . . 23.079999999999998 109.696 177.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -98.95 -24.43 14.94 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 121.066 -1.021 . . . . 15.51 112.862 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 56.9 m-70 -128.45 83.64 65.56 Favored Pre-proline 0 C--N 1.313 -1.018 0 N-CA-C 108.367 -0.975 . . . . 17.710000000000001 108.367 -177.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -52.57 137.09 58.23 Favored 'Trans proline' 0 C--O 1.217 -0.559 0 O-C-N 123.605 1.318 . . . . 14.48 113.76 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.85 -21.15 40.98 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-O 121.385 0.436 . . . . 14.35 113.654 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 57.7 m -87.46 122.48 31.25 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.024 -1.28 . . . . 19.43 111.589 -178.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 99.6 t -119.43 141.31 40.03 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 CA-C-N 115.287 -0.87 . . . . 8.8399999999999999 111.205 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.853 ' HG3' ' C4 ' ' A' ' 1' ' ' FOL . 0.2 OUTLIER -129.97 152.25 49.65 Favored 'General case' 0 C--O 1.247 0.949 0 N-CA-C 105.928 -1.878 . . . . 100.0 105.928 176.355 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 23.7 pt -113.91 145.12 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 CA-C-N 118.82 0.737 . . . . 20.629999999999999 110.818 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . 0.259 90.3 m-85 -147.25 156.44 46.4 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 114.125 1.157 . . . . 24.010000000000002 114.125 -178.669 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -74.06 150.94 43.88 Favored 'Trans proline' 0 N--CA 1.448 -1.178 0 N-CA-C 107.322 -1.838 . . . . 14.67 107.322 177.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 14.5 p -49.49 -39.54 13.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 119.557 1.071 . . . . 22.739999999999998 113.045 -179.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.19 -20.7 63.06 Favored 'General case' 0 C--O 1.198 -1.632 0 N-CA-C 115.744 1.757 . . . . 15.68 115.744 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.77 -3.73 58.98 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 114.998 1.481 . . . . 13.859999999999999 114.998 -178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.502 ' C ' ' HD2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -118.98 151.47 38.12 Favored 'General case' 1 C--N 1.192 -6.24 1 C-N-CA 132.052 4.141 . . . . 23.010000000000002 110.145 -163.768 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.412 ' OE2' ' NE ' ' A' ' 31' ' ' ARG . 11.9 pt-20 -144.76 142.86 30.34 Favored 'General case' 0 C--N 1.366 1.311 0 O-C-N 117.938 -2.976 . . . . 41.140000000000001 109.869 168.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.0 ttp85 -75.41 144.76 42.05 Favored 'General case' 0 C--O 1.208 -1.084 0 O-C-N 121.591 -0.693 . . . . 42.939999999999998 111.112 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.9 pt -127.44 122.35 59.27 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.319 0 N-CA-C 105.798 -1.926 . . . . 31.050000000000001 105.798 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . 0.992 50.5 m-20 . . . . . 0 C--O 1.257 1.488 0 C-N-CA 128.969 2.908 . . . . 100.0 117.685 3.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' FOL . . . . . 0.853 ' C4 ' ' HG3' ' A' ' 67' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . 0.79 ' O ' ' N5 ' ' A' ' 1' ' ' FOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_