data_1s98_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 1s98 _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 ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.212 -0.888 0 N-CA-C 109.149 -0.686 . . . . 52.21 109.149 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 mt -99.83 122.09 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.466 -2.251 0 N-CA-C 106.446 -1.687 . . . . 55.29 106.446 172.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.2 p -135.93 163.38 30.4 Favored 'General case' 0 C--O 1.188 -2.176 0 C-N-CA 114.452 -2.899 . . . . 57.16 114.915 -175.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.5 mp -108.93 143.91 37.56 Favored 'General case' 0 C--O 1.16 -3.655 0 N-CA-C 107.499 -1.297 . . . . 58.27 107.499 173.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 89.7 p -71.19 164.79 24.95 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 104.54 -2.393 . . . . 59.75 104.54 171.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -54.31 -50.09 68.16 Favored 'General case' 0 N--CA 1.51 2.549 0 CA-C-O 121.504 0.668 . . . . 64.88 112.654 174.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.5 p -64.33 -30.21 71.26 Favored 'General case' 0 C--O 1.209 -1.026 0 C-N-CA 118.916 -1.114 . . . . 58.22 112.25 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.23 -48.17 24.72 Favored 'General case' 0 C--O 1.186 -2.284 0 N-CA-C 104.471 -2.418 . . . . 52.33 104.471 -173.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.27 -48.03 65.52 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 117.331 2.345 . . . . 57.02 117.331 171.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.41 -36.53 84.03 Favored 'General case' 0 C--N 1.299 -1.626 0 C-N-CA 117.733 -1.587 . . . . 59.15 108.775 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.32 -44.84 67.43 Favored 'General case' 0 C--N 1.36 1.041 0 CA-C-O 123.292 1.52 . . . . 68.98 107.764 -175.718 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.79 -33.42 63.48 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.838 0 CA-C-N 113.227 -1.806 . . . . 56.97 106.468 -173.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.6 m-20 -72.52 -37.16 68.43 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 116.689 -2.004 . . . . 62.64 107.967 -173.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' THR . . . . . 0.739 ' CG2' ' O ' ' A' ' 116' ' ' HOH 0.365 0.1 OUTLIER -68.05 -25.16 65.22 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 117.019 2.229 . . . . 67.94 117.019 175.392 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -73.48 -38.15 65.5 Favored 'General case' 0 C--O 1.174 -2.903 0 CA-C-N 120.881 1.673 . . . . 70.23 114.379 166.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.7 mt -71.08 -40.23 71.69 Favored 'General case' 0 CA--C 1.591 2.537 0 CA-C-N 118.847 0.749 . . . . 73.55 111.669 -177.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.14 -74.69 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.256 1.422 . . . . 76.94 112.355 165.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -44.7 -15.37 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 115.975 1.843 . . . . 79.49 115.975 169.241 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.23 -13.5 15.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 118.522 -2.611 . . . . 79.18 104.434 -179.567 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.06 -71.01 2.27 Favored Glycine 0 C--O 1.262 1.897 0 CA-C-N 113.966 -1.47 . . . . 78.61 112.533 175.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . 0.598 ' CA ' ' CE ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -86.35 148.0 25.79 Favored 'General case' 0 CA--C 1.611 3.307 0 O-C-N 125.473 1.337 . . . . 80.43 114.063 -172.954 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 157.69 168.17 19.72 Favored Glycine 0 C--N 1.361 1.96 0 N-CA-C 120.382 2.913 . . . . 77.58 120.382 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -109.97 -58.89 2.0 Favored 'General case' 0 C--N 1.312 -1.063 0 O-C-N 121.484 -1.009 . . . . 71.34 108.33 170.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 176.87 -150.91 10.66 Favored Glycine 0 C--O 1.195 -2.317 0 N-CA-C 116.19 1.236 . . . . 67.94 116.19 175.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . 0.44 ' O ' ' N ' ' A' ' 63' ' ' VAL . 76.0 mt -96.93 141.08 30.55 Favored 'General case' 0 C--O 1.208 -1.111 0 N-CA-C 112.459 0.54 . . . . 66.24 112.459 179.174 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 35.4 ttm-85 -85.2 128.69 34.77 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 113.7 1.0 . . . . 59.04 113.7 153.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.16 136.26 39.37 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 109.153 -0.684 . . . . 61.17 109.153 159.17 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -150.26 165.08 29.84 Favored Glycine 0 N--CA 1.491 2.303 0 C-N-CA 119.602 -1.285 . . . . 49.09 112.922 -176.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -135.05 132.49 53.21 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.97 0 C-N-CA 117.097 -1.841 . . . . 42.54 108.663 171.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 37.4 ptt85 -126.97 165.93 18.5 Favored 'General case' 0 C--O 1.293 3.373 0 O-C-N 123.906 0.754 . . . . 53.12 111.545 -179.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 70.7 p -69.51 150.07 47.56 Favored 'General case' 0 C--O 1.215 -0.723 0 O-C-N 124.179 0.924 . . . . 48.56 109.093 173.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.7 t -145.45 98.84 3.21 Favored 'General case' 0 C--O 1.256 1.418 0 CA-C-O 122.226 1.012 . . . . 57.28 109.03 173.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.77 -165.58 54.31 Favored Glycine 0 C--O 1.196 -2.244 0 CA-C-O 123.288 1.493 . . . . 61.75 110.399 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 p -88.65 -19.26 26.43 Favored 'General case' 0 N--CA 1.421 -1.915 0 C-N-CA 114.289 -2.965 . . . . 65.33 111.632 -172.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . 0.47 ' N ' ' O ' ' A' ' 124' ' ' HOH . 97.7 p -125.14 19.08 8.34 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 119.734 3.235 . . . . 59.03 119.734 177.768 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -121.89 162.76 15.54 Favored Glycine 0 CA--C 1.536 1.385 0 CA-C-O 122.373 0.985 . . . . 54.08 111.658 -172.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.8 141.69 40.85 Favored 'General case' 0 C--O 1.189 -2.125 0 N-CA-C 100.208 -3.997 . . . . 47.49 100.208 -177.322 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -133.5 130.17 38.16 Favored 'General case' 0 CA--C 1.457 -2.601 0 N-CA-C 106.415 -1.698 . . . . 44.37 106.415 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -59.3 135.56 57.69 Favored 'General case' 0 CA--C 1.563 1.449 0 CA-C-N 113.922 -1.49 . . . . 46.21 112.772 166.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.7 t -109.86 133.12 56.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.022 0 N-CA-C 107.395 -1.335 . . . . 50.85 107.395 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.25 104.85 4.15 Favored 'General case' 0 C--O 1.192 -1.922 0 N-CA-C 107.931 -1.137 . . . . 58.03 107.931 -171.729 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -148.96 168.36 23.29 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.592 1.33 . . . . 68.97 114.592 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -79.01 145.73 33.73 Favored 'General case' 0 C--O 1.174 -2.873 0 N-CA-C 109.617 -0.512 . . . . 60.77 109.617 172.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -133.22 147.88 31.25 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.93 0 CA-C-O 118.07 -0.967 . . . . 68.61 109.624 173.83 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.9 m-20 -98.59 -13.85 20.19 Favored 'General case' 0 N--CA 1.512 2.671 0 CA-C-O 123.047 1.404 . . . . 76.39 111.201 -175.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.18 149.69 10.3 Favored Pre-proline 0 C--O 1.21 -1.012 0 CA-C-N 113.738 -1.574 . . . . 78.43 110.386 175.203 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -67.99 152.53 76.7 Favored 'Trans proline' 0 N--CA 1.433 -2.086 0 C-N-CA 122.307 2.004 . . . . 70.61 111.122 166.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.261 0.8 OUTLIER -100.31 159.89 28.52 Favored Pre-proline 0 N--CA 1.43 -1.44 0 N-CA-C 103.134 -2.913 . . . . 70.0 103.134 -176.688 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.03 -8.39 2.34 Favored 'Trans proline' 0 CA--C 1.578 2.705 0 C-N-CA 122.226 1.951 . . . . 67.72 115.341 169.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -100.18 -11.84 20.09 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.604 0.762 . . . . 72.77 111.792 -177.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -93.5 159.21 15.34 Favored 'General case' 0 C--O 1.204 -1.304 0 N-CA-C 118.043 2.609 . . . . 57.59 118.043 -177.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . 0.896 ' CB ' ' CE ' ' A' ' 69' ' ' MET . . . -116.27 140.28 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.967 0 N-CA-C 101.075 -3.676 . . . . 53.09 101.075 168.661 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 49.4 t -107.68 126.02 64.07 Favored 'Isoleucine or valine' 0 C--O 1.181 -2.536 0 CA-C-N 119.299 0.954 . . . . 50.03 112.113 178.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -109.75 160.12 16.59 Favored 'General case' 0 CA--C 1.446 -3.057 0 N-CA-C 106.211 -1.774 . . . . 53.49 106.211 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -139.32 133.26 30.94 Favored 'General case' 1 C--O 1.146 -4.374 0 C-N-CA 117.93 -1.508 . . . . 64.72 109.998 175.705 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -145.65 147.56 32.14 Favored 'General case' 0 C--O 1.261 1.71 0 N-CA-C 109.146 -0.687 . . . . 57.41 109.146 175.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 27.5 mttp 35.15 41.96 0.08 Allowed 'General case' 0 C--O 1.158 -3.745 0 CA-C-N 113.823 -1.535 . . . . 66.48 111.623 -173.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.97 0.33 85.13 Favored Glycine 0 N--CA 1.421 -2.352 0 O-C-N 119.131 -2.231 . . . . 51.37 118.439 173.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -112.93 137.07 47.19 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.094 0 N-CA-C 116.058 1.873 . . . . 53.08 116.058 170.881 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -81.13 125.08 29.8 Favored 'General case' 0 N--CA 1.401 -2.915 0 CA-C-N 112.731 -2.031 . . . . 69.34 110.741 -178.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . 0.304 0.3 OUTLIER -118.81 113.89 43.1 Favored 'Isoleucine or valine' 1 C--O 1.147 -4.327 0 N-CA-C 109.358 -0.608 . . . . 47.67 109.358 -178.711 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . 0.44 ' N ' ' O ' ' A' ' 26' ' ' LEU . 87.3 t -94.46 130.7 42.96 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.763 0 N-CA-C 109.112 -0.699 . . . . 50.7 109.112 -173.178 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 99.3 t -138.73 126.07 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.057 0 N-CA-C 108.453 -0.943 . . . . 49.92 108.453 -170.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -60.4 136.41 58.04 Favored 'General case' 0 C--O 1.264 1.864 0 N-CA-C 107.415 -1.328 . . . . 57.5 107.415 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -59.05 -40.1 95.14 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 128.297 2.856 . . . . 50.18 113.365 -173.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 39.0 mttp -74.14 -5.74 43.56 Favored 'General case' 0 C--O 1.172 -2.985 0 N-CA-C 113.281 0.845 . . . . 69.03 113.281 176.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 73.5 m -114.49 5.08 15.44 Favored 'General case' 0 C--O 1.185 -2.342 0 N-CA-C 116.763 2.135 . . . . 48.85 116.763 172.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' MET . . . . . 0.896 ' CE ' ' CB ' ' A' ' 53' ' ' ILE . 8.7 ttm -61.23 -53.79 52.39 Favored 'General case' 0 C--O 1.2 -1.533 0 C-N-CA 127.31 2.244 . . . . 52.64 108.213 -173.227 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -60.85 -43.8 97.87 Favored 'General case' 0 C--O 1.182 -2.46 0 N-CA-C 113.55 0.944 . . . . 67.53 113.55 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -51.7 -48.73 63.41 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-O 122.477 1.132 . . . . 47.23 112.312 172.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.9 mt -87.2 -13.77 42.99 Favored 'General case' 0 C--O 1.163 -3.492 0 CA-C-N 115.388 -0.823 . . . . 50.45 110.669 -166.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -52.14 138.94 24.62 Favored 'General case' 0 C--O 1.207 -1.136 0 CA-C-N 118.854 0.752 . . . . 58.3 109.673 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.5 -10.38 69.74 Favored Glycine 0 C--O 1.183 -3.084 0 N-CA-C 120.296 2.878 . . . . 51.53 120.296 -172.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.4 p -79.57 141.51 36.54 Favored 'General case' 0 C--O 1.182 -2.498 0 O-C-N 119.942 -1.917 . . . . 58.06 108.186 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -113.31 126.05 54.96 Favored 'General case' 0 N--CA 1.407 -2.621 0 CA-C-N 113.711 -1.586 . . . . 59.17 109.718 168.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.3 tp -78.95 116.78 19.48 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 114.409 1.262 . . . . 51.13 114.409 163.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -110.77 164.48 12.72 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 109.375 -0.602 . . . . 62.39 109.375 177.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -135.06 127.63 30.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 124.384 1.073 . . . . 59.46 110.009 173.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 47.3 t -99.68 119.64 47.99 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.087 0 N-CA-C 103.902 -2.629 . . . . 57.65 103.902 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . . . -83.39 -28.12 29.13 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.678 0.992 . . . . 61.31 113.678 -168.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLU . . . . . 0.788 ' CB ' ' O ' ' A' ' 110' ' ' HOH . . . -137.41 156.73 47.84 Favored 'General case' 0 CA--C 1.58 2.105 0 CA-C-N 114.062 -1.426 . . . . 62.75 114.458 -174.382 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 100.48 -177.42 28.34 Favored Glycine 0 CA--C 1.565 3.187 0 CA-C-O 122.858 1.254 . . . . 60.21 110.404 173.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.17 -24.42 63.14 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-O 118.494 -0.765 . . . . 55.05 111.617 -173.805 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASN . . . . . 0.45 ' ND2' ' O ' ' A' ' 119' ' ' HOH . 0.2 OUTLIER -101.73 32.44 3.39 Favored 'General case' 0 C--O 1.208 -1.107 0 N-CA-C 119.944 3.313 . . . . 67.14 119.944 169.577 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -44.94 141.35 2.23 Favored 'General case' 0 C--O 1.186 -2.246 0 N-CA-C 111.942 0.349 . . . . 59.14 111.942 165.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 131.6 -176.04 19.37 Favored Glycine 0 C--O 1.19 -2.608 0 O-C-N 123.573 0.545 . . . . 50.69 112.452 176.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -85.69 157.58 20.27 Favored 'General case' 0 C--O 1.179 -2.647 0 N-CA-C 112.417 0.525 . . . . 56.72 112.417 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.99 151.03 31.49 Favored 'General case' 0 C--O 1.176 -2.771 0 N-CA-C 105.403 -2.073 . . . . 65.36 105.403 -164.283 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PHE . . . . . 0.405 ' N ' ' CD2' ' A' ' 90' ' ' PHE . 10.5 m-85 -123.47 140.8 52.64 Favored 'General case' 0 C--O 1.162 -3.514 0 C-N-CA 124.958 1.303 . . . . 54.9 113.743 174.439 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 55.9 p -139.46 165.38 27.38 Favored 'General case' 0 CA--C 1.484 -1.586 0 O-C-N 120.193 -1.567 . . . . 55.17 107.856 174.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.78 120.57 1.29 Allowed Pre-proline 0 N--CA 1.43 -1.461 0 CA-C-N 112.216 -2.266 . . . . 54.31 105.715 -176.595 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -64.06 -21.92 68.0 Favored 'Trans proline' 0 CA--C 1.56 1.802 0 O-C-N 123.696 1.366 . . . . 59.36 111.526 -172.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -94.04 18.01 11.41 Favored 'General case' 0 C--O 1.153 -3.996 0 N-CA-C 115.497 1.666 . . . . 59.09 115.497 178.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 77.1 t -126.68 103.86 11.86 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.895 0 N-CA-C 103.786 -2.672 . . . . 64.69 103.786 179.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . . . -91.61 151.1 20.85 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 118.152 -1.419 . . . . 69.81 110.472 -166.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . . . -76.71 12.08 1.44 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.603 0.761 . . . . 77.85 111.978 -174.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.432 0 C-N-CA 125.826 1.651 . . . . 78.61 113.856 171.768 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.336 0 CA-C-O 118.504 -0.76 . . . . 53.13 109.362 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 23.2 mm -104.59 140.62 22.1 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.871 0 CA-C-O 118.703 -0.665 . . . . 59.69 112.28 165.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 70.5 p -130.03 171.21 13.04 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 114.209 1.189 . . . . 52.23 114.209 173.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 7.5 mp -126.09 143.66 51.03 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-O 117.92 -1.038 . . . . 56.19 108.489 174.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 77.7 p -70.57 159.96 33.37 Favored 'General case' 0 CA--C 1.587 2.399 0 CA-C-N 119.407 1.003 . . . . 56.52 112.887 170.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -49.79 -47.88 50.94 Favored 'General case' 0 N--CA 1.537 3.892 0 N-CA-C 115.105 1.52 . . . . 70.28 115.105 171.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.2 p -58.71 -42.33 88.42 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 115.506 -2.478 . . . . 67.43 116.559 172.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.78 -42.07 74.28 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 117.304 -1.758 . . . . 58.74 113.448 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.59 -40.9 63.14 Favored 'General case' 0 C--O 1.191 -2.023 0 CA-C-N 114.897 -1.047 . . . . 62.66 112.849 171.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.08 -42.63 65.97 Favored 'General case' 0 N--CA 1.502 2.157 0 N-CA-C 106.671 -1.603 . . . . 64.87 106.671 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ARG . . . . . 0.511 ' NH2' ' CE1' ' B' ' 16' ' ' PHE . 0.0 OUTLIER -64.22 -42.99 96.35 Favored 'General case' 0 C--N 1.384 2.1 0 CA-C-O 121.949 0.88 . . . . 77.44 109.211 -178.734 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 19.3 t -77.95 -31.3 16.75 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-O 121.401 0.619 . . . . 62.17 109.794 -171.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 -61.73 -45.48 93.77 Favored 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 122.055 0.931 . . . . 65.68 110.848 174.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' THR . . . . . 0.415 ' O ' ' C ' ' B' ' 16' ' ' PHE . 84.8 m -52.75 -53.85 42.12 Favored 'General case' 0 C--O 1.201 -1.474 0 CA-C-N 114.555 -1.202 . . . . 71.66 112.555 164.514 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' PHE . . . . . 0.511 ' CE1' ' NH2' ' B' ' 12' ' ' ARG . 22.6 m-85 -61.35 -18.51 59.03 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 115.234 -2.586 . . . . 71.0 107.532 -169.163 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 mt -82.75 -56.44 3.84 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-N 114.666 -1.152 . . . . 73.99 113.681 -166.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ALA . . . . . 0.805 ' O ' ' N ' ' B' ' 20' ' ' ARG . . . -32.32 -98.31 0.0 OUTLIER 'General case' 0 CA--C 1.585 2.307 0 O-C-N 125.561 1.788 . . . . 77.26 108.369 149.251 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ASN . . . . . 0.424 ' C ' ' O ' ' B' ' 18' ' ' ALA . 1.3 m120 -23.61 -19.18 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 119.879 3.289 . . . . 81.11 119.879 -178.354 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ARG . . . . . 0.805 ' N ' ' O ' ' B' ' 18' ' ' ALA . 8.5 ptm180 -117.04 -3.53 11.56 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-N 122.281 2.31 . . . . 80.06 111.343 177.899 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' B' ' 18' ' ' ALA . . . 16.72 37.65 0.0 OUTLIER Glycine 0 C--N 1.353 1.514 0 C-N-CA 129.007 3.194 . . . . 80.48 120.09 -169.404 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . . . -114.58 -50.7 2.78 Favored 'General case' 0 N--CA 1.509 2.523 0 N-CA-C 113.771 1.026 . . . . 80.65 113.771 -164.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -100.23 178.63 29.31 Favored Glycine 0 CA--C 1.573 3.705 1 N-CA-C 126.496 5.359 . . . . 76.42 126.496 -172.212 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PHE . . . . . 0.597 ' CB ' ' O ' ' B' ' 46' ' ' ASP . 69.3 t80 -79.77 -40.13 29.43 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 112.141 -2.029 . . . . 68.57 113.596 -178.216 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 167.2 -156.36 28.1 Favored Glycine 0 C--O 1.257 1.534 0 O-C-N 120.277 -1.514 . . . . 63.59 109.577 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 32.8 mt -99.22 138.72 35.91 Favored 'General case' 0 C--O 1.187 -2.191 0 CA-C-O 118.089 -0.958 . . . . 65.33 108.788 -176.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -93.27 131.89 37.96 Favored 'General case' 0 CA--C 1.562 1.414 0 N-CA-C 115.886 1.81 . . . . 52.59 115.886 155.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 32.0 tp -112.23 121.69 45.63 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.847 -1.069 . . . . 53.49 109.445 172.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.36 -178.98 16.38 Favored Glycine 0 C--O 1.183 -3.081 0 CA-C-O 123.025 1.347 . . . . 45.76 114.074 -176.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 24.7 m -136.2 147.97 27.73 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.263 0 C-N-CA 124.2 1.0 . . . . 48.18 110.143 172.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 42.1 ptt85 -141.11 167.82 21.26 Favored 'General case' 1 N--CA 1.372 -4.341 0 CA-C-O 125.252 2.453 . . . . 55.5 109.873 174.23 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.6 144.38 54.54 Favored 'General case' 1 C--O 1.151 -4.113 0 CA-C-N 112.391 -2.186 . . . . 56.55 111.631 173.021 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 46.9 t -138.24 77.14 1.61 Allowed 'General case' 0 C--O 1.245 0.834 0 C-N-CA 125.401 1.48 . . . . 57.03 111.763 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.64 -171.79 49.4 Favored Glycine 0 N--CA 1.474 1.227 0 CA-C-O 123.468 1.593 . . . . 60.39 111.414 -169.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 30.4 p -96.1 0.2 51.09 Favored 'General case' 0 C--N 1.307 -1.249 0 O-C-N 119.804 -1.998 . . . . 62.39 112.449 -167.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' SER . . . . . 0.56 ' CB ' ' O ' ' B' ' 118' ' ' HOH . . . -119.53 10.9 11.94 Favored 'General case' 0 C--O 1.279 2.628 0 O-C-N 125.201 1.563 . . . . 60.84 114.867 175.947 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . -167.99 -172.36 34.91 Favored Glycine 0 C--O 1.199 -2.074 0 N-CA-C 118.704 2.242 . . . . 57.67 118.704 174.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' MET . . . . . . . . . . . . . 30.9 mtp -140.7 153.44 45.95 Favored 'General case' 0 C--O 1.284 2.884 0 CA-C-O 122.146 0.974 . . . . 49.01 110.481 -171.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -126.39 151.59 47.46 Favored 'General case' 0 CA--C 1.476 -1.898 0 N-CA-C 106.824 -1.547 . . . . 45.2 106.824 177.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -70.98 147.31 48.8 Favored 'General case' 0 C--O 1.168 -3.185 0 C-N-CA 126.555 1.942 . . . . 45.92 107.333 172.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 73.7 t -117.36 136.51 54.27 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.806 0 O-C-N 119.868 -1.77 . . . . 52.39 106.374 163.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -139.86 111.54 7.3 Favored 'General case' 1 C--O 1.145 -4.425 0 N-CA-C 104.497 -2.408 . . . . 54.11 104.497 -177.004 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -144.52 171.89 13.72 Favored 'General case' 0 CA--C 1.6 2.904 0 CA-C-N 119.596 1.089 . . . . 63.63 112.055 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.28 139.72 30.75 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-O 119.6 -0.238 . . . . 57.93 110.589 167.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . 0.282 0.0 OUTLIER -124.43 145.2 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.556 0 N-CA-C 106.772 -1.566 . . . . 63.9 106.772 175.127 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASP . . . . . 0.597 ' O ' ' CB ' ' B' ' 24' ' ' PHE . 59.7 m-20 -84.21 -57.2 3.27 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.565 -1.198 . . . . 75.3 108.779 175.482 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -119.54 131.39 24.4 Favored Pre-proline 0 CA--C 1.566 1.577 0 N-CA-C 114.6 1.333 . . . . 79.4 114.6 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -58.51 162.39 12.56 Favored 'Trans proline' 0 CA--C 1.481 -2.175 0 C-N-CA 121.869 1.713 . . . . 70.63 112.438 168.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 3.9 p -108.4 166.99 9.89 Favored Pre-proline 0 CA--C 1.481 -1.706 0 C-N-CA 119.759 -0.776 . . . . 64.09 111.096 165.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -60.98 -12.19 21.49 Favored 'Trans proline' 0 CA--C 1.562 1.883 0 O-C-N 124.311 1.69 . . . . 61.14 114.881 168.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 25.9 mp0 -85.69 -5.95 59.2 Favored 'General case' 0 N--CA 1.499 1.975 0 C-N-CA 120.31 -0.556 . . . . 74.56 112.172 175.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -97.77 160.37 14.35 Favored 'General case' 0 C--O 1.175 -2.854 0 CA-C-O 122.025 0.916 . . . . 57.2 111.732 -169.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mm -118.5 123.09 71.01 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.267 0 N-CA-C 105.492 -2.04 . . . . 50.34 105.492 169.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 81.0 t -106.55 121.85 59.71 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.491 0 N-CA-C 108.345 -0.983 . . . . 43.36 108.345 -172.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -103.59 154.87 19.02 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 106.933 -1.506 . . . . 48.67 106.933 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -133.71 126.47 30.82 Favored 'General case' 0 C--O 1.187 -2.185 0 O-C-N 120.574 -1.329 . . . . 64.98 113.08 170.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -142.16 128.0 19.37 Favored 'General case' 0 C--O 1.252 1.193 0 N-CA-C 100.63 -3.841 . . . . 62.1 100.63 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LYS . . . . . 0.48 ' CE ' ' O ' ' B' ' 120' ' ' HOH . 23.4 mttt 46.35 44.14 12.35 Favored 'General case' 0 C--O 1.187 -2.186 0 CA-C-N 113.919 -1.492 . . . . 60.0 112.471 178.906 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.76 -0.89 89.16 Favored Glycine 0 CA--C 1.497 -1.074 0 N-CA-C 117.973 1.949 . . . . 57.31 117.973 171.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . 0.404 0.2 OUTLIER -113.85 125.3 71.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.865 0 N-CA-C 108.155 -1.054 . . . . 61.1 108.155 176.781 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -76.22 125.83 29.89 Favored 'General case' 0 N--CA 1.383 -3.823 0 CA-C-N 113.617 -1.629 . . . . 64.64 107.77 174.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 86.8 t -111.21 124.32 67.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 N-CA-C 105.861 -1.903 . . . . 51.61 105.861 177.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 84.8 t -102.02 127.7 55.27 Favored 'Isoleucine or valine' 1 CA--C 1.635 4.219 0 N-CA-C 106.105 -1.813 . . . . 45.63 106.105 -173.807 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 48.0 t -130.69 117.22 37.82 Favored 'Isoleucine or valine' 1 N--CA 1.589 6.506 0 CA-C-N 119.897 1.226 . . . . 47.93 112.915 178.313 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -51.41 137.33 23.9 Favored 'General case' 0 C--O 1.175 -2.831 0 O-C-N 119.491 -2.006 . . . . 64.05 110.237 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -61.71 -29.2 71.43 Favored Glycine 1 C--O 1.165 -4.217 0 C-N-CA 124.314 0.959 . . . . 52.67 111.384 -170.246 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -85.33 -7.17 59.11 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 121.068 -1.254 . . . . 73.83 110.305 -176.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 7.1 m -94.93 -8.56 36.71 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 115.354 1.612 . . . . 48.18 115.354 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 69.5 mmm -56.93 -36.08 69.81 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 122.213 1.006 . . . . 48.87 111.191 -176.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -60.47 -28.99 68.77 Favored 'General case' 0 C--O 1.274 2.371 0 CA-C-N 115.715 -0.675 . . . . 56.93 110.486 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -84.83 -18.64 34.25 Favored 'General case' 0 CA--C 1.588 2.434 0 N-CA-C 117.322 2.341 . . . . 45.31 117.322 176.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 65.4 mt -121.84 -27.08 4.71 Favored 'General case' 0 C--O 1.159 -3.68 0 CA-C-N 114.696 -1.138 . . . . 47.12 112.713 -155.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -57.6 137.65 56.13 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 115.007 1.484 . . . . 57.27 115.007 -171.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . 76.95 -0.57 65.92 Favored Glycine 0 C--O 1.176 -3.524 0 C-N-CA 126.365 1.936 . . . . 46.9 112.622 -166.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 6.3 m -66.37 136.21 55.44 Favored 'General case' 0 C--O 1.18 -2.584 0 O-C-N 120.123 -1.81 . . . . 47.57 113.133 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -107.08 125.43 51.04 Favored 'General case' 0 N--CA 1.397 -3.086 0 CA-C-N 116.324 -0.398 . . . . 58.11 111.989 167.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 18.6 tp -83.38 133.15 34.95 Favored 'General case' 0 CA--C 1.479 -1.783 0 CA-C-O 122.99 1.376 . . . . 52.13 107.936 171.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ASP . . . . . 0.546 ' OD2' ' O ' ' B' ' 121' ' ' HOH . 0.5 OUTLIER -136.46 168.07 20.16 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 114.569 -1.196 . . . . 64.93 107.918 -162.708 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -152.53 137.3 17.03 Favored 'General case' 1 C--O 1.151 -4.125 0 C-N-CA 119.663 -0.815 . . . . 59.36 112.548 -178.109 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' VAL . . . . . . . . . . . . . 11.1 t -115.62 117.77 56.66 Favored 'Isoleucine or valine' 0 C--O 1.259 1.568 0 N-CA-C 101.598 -3.482 . . . . 62.23 101.598 -173.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . . . -72.47 -32.04 65.91 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 125.128 1.518 . . . . 60.54 113.934 -173.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -134.47 160.15 38.91 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 117.071 2.248 . . . . 80.0 117.071 -164.025 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 84.81 177.77 51.09 Favored Glycine 0 CA--C 1.553 2.435 0 C-N-CA 118.667 -1.73 . . . . 59.99 114.621 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -23.55 65.17 Favored 'General case' 0 CA--C 1.558 1.276 0 N-CA-C 114.313 1.227 . . . . 61.36 114.313 -173.057 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ASN . . . . . 0.522 ' O ' ' C ' ' B' ' 86' ' ' GLU . 70.7 m-20 -90.88 16.14 9.98 Favored 'General case' 0 C--O 1.19 -2.048 0 N-CA-C 116.48 2.03 . . . . 70.28 116.48 170.148 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLU . . . . . 0.522 ' C ' ' O ' ' B' ' 85' ' ' ASN . 24.9 tt0 -44.49 132.48 6.12 Favored 'General case' 1 C--O 1.152 -4.042 0 C-N-CA 116.007 -2.277 . . . . 56.88 110.952 177.119 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . 150.58 -175.79 29.45 Favored Glycine 0 C--O 1.201 -1.955 0 N-CA-C 111.353 -0.699 . . . . 47.19 111.353 168.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -70.78 148.73 47.61 Favored 'General case' 0 C--O 1.172 -2.977 0 CA-C-N 116.994 0.397 . . . . 58.26 111.493 170.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.37 159.11 43.8 Favored 'General case' 0 N--CA 1.417 -2.117 0 CA-C-N 115.988 -0.551 . . . . 70.49 112.038 173.88 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' PHE . . . . . 0.459 ' N ' ' CD2' ' B' ' 90' ' ' PHE . 4.4 m-85 -119.24 135.53 54.64 Favored 'General case' 0 C--O 1.155 -3.892 0 N-CA-C 108.218 -1.03 . . . . 56.59 108.218 -171.684 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 98.4 m -117.95 102.72 9.29 Favored 'General case' 0 N--CA 1.419 -2.006 0 N-CA-C 104.72 -2.326 . . . . 52.39 104.72 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -123.2 108.84 31.78 Favored Pre-proline 0 C--O 1.185 -2.319 0 CA-C-N 113.906 -1.497 . . . . 46.49 109.797 -164.753 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -64.34 -18.78 64.38 Favored 'Trans proline' 0 CA--C 1.576 2.596 0 C-N-CA 123.48 2.787 . . . . 49.74 117.191 -176.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -78.09 -16.19 58.22 Favored 'General case' 0 C--O 1.181 -2.51 0 C-N-CA 127.916 2.486 . . . . 48.29 112.62 178.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 52.8 t -115.72 135.91 54.29 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 C-N-CA 127.352 2.261 . . . . 50.4 108.727 -171.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -92.68 145.91 24.06 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 119.582 1.083 . . . . 68.28 108.314 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.96 121.25 22.43 Favored 'General case' 0 C--O 1.171 -3.027 0 N-CA-C 116.278 1.955 . . . . 70.49 116.278 173.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.532 3.628 0 CA-C-O 124.897 2.284 . . . . 76.64 111.729 142.172 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . 0.609 ' O ' ' CG ' ' A' ' 69' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . 0.788 ' O ' ' CB ' ' A' ' 82' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.739 ' O ' ' CG2' ' A' ' 15' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.45 ' O ' ' ND2' ' A' ' 85' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.47 ' O ' ' N ' ' A' ' 36' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . 0.56 ' O ' ' CB ' ' B' ' 36' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HOH . . . . . 0.48 ' O ' ' CE ' ' B' ' 58' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HOH . . . . . 0.546 ' O ' ' OD2' ' B' ' 78' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.212 -0.888 0 N-CA-C 109.149 -0.686 . . . . 52.21 109.149 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 mt -99.83 122.09 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.466 -2.251 0 N-CA-C 106.446 -1.687 . . . . 55.29 106.446 172.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.2 p -135.93 163.38 30.4 Favored 'General case' 0 C--O 1.188 -2.176 0 C-N-CA 114.452 -2.899 . . . . 57.16 114.915 -175.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.5 mp -108.93 143.91 37.56 Favored 'General case' 0 C--O 1.16 -3.655 0 N-CA-C 107.499 -1.297 . . . . 58.27 107.499 173.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 89.7 p -71.19 164.79 24.95 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 104.54 -2.393 . . . . 59.75 104.54 171.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -54.31 -50.09 68.16 Favored 'General case' 0 N--CA 1.51 2.549 0 CA-C-O 121.504 0.668 . . . . 64.88 112.654 174.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.5 p -64.33 -30.21 71.26 Favored 'General case' 0 C--O 1.209 -1.026 0 C-N-CA 118.916 -1.114 . . . . 58.22 112.25 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . 0.5 ' O ' HG23 ' A' ' 13' ' ' VAL . . . -75.23 -48.17 24.72 Favored 'General case' 0 C--O 1.186 -2.284 0 N-CA-C 104.471 -2.418 . . . . 52.33 104.471 -173.457 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.27 -48.03 65.52 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 117.331 2.345 . . . . 57.02 117.331 171.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . 0.493 ' O ' HG23 ' A' ' 15' ' ' THR . . . -63.41 -36.53 84.03 Favored 'General case' 0 C--N 1.299 -1.626 0 C-N-CA 117.733 -1.587 . . . . 59.15 108.775 178.176 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ARG . . . . . 0.465 ' HD2' ' CZ ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -70.32 -44.84 67.43 Favored 'General case' 0 C--N 1.36 1.041 0 CA-C-O 123.292 1.52 . . . . 68.98 107.764 -175.718 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 9' ' ' ALA . 79.8 t -65.79 -33.42 63.48 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.838 0 CA-C-N 113.227 -1.806 . . . . 56.97 106.468 -173.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.6 m-20 -72.52 -37.16 68.43 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 116.689 -2.004 . . . . 62.64 107.967 -173.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' THR . . . . . 0.873 HG21 ' O ' ' A' ' 116' ' ' HOH 0.365 0.1 OUTLIER -68.05 -25.16 65.22 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 117.019 2.229 . . . . 67.94 117.019 175.392 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PHE . . . . . 0.496 ' O ' ' HB3' ' A' ' 20' ' ' ARG . 13.3 m-85 -73.48 -38.15 65.5 Favored 'General case' 0 C--O 1.174 -2.903 0 CA-C-N 120.881 1.673 . . . . 70.23 114.379 166.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.7 mt -71.08 -40.23 71.69 Favored 'General case' 0 CA--C 1.591 2.537 0 CA-C-N 118.847 0.749 . . . . 73.55 111.669 -177.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.14 -74.69 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.256 1.422 . . . . 76.94 112.355 165.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -44.7 -15.37 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 115.975 1.843 . . . . 79.49 115.975 169.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ARG . . . . . 0.496 ' HB3' ' O ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -105.23 -13.5 15.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 118.522 -2.611 . . . . 79.18 104.434 -179.567 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.06 -71.01 2.27 Favored Glycine 0 C--O 1.262 1.897 0 CA-C-N 113.966 -1.47 . . . . 78.61 112.533 175.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . 1.049 ' HA ' ' HE3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -86.35 148.0 25.79 Favored 'General case' 0 CA--C 1.611 3.307 0 O-C-N 125.473 1.337 . . . . 80.43 114.063 -172.954 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 157.69 168.17 19.72 Favored Glycine 0 C--N 1.361 1.96 0 N-CA-C 120.382 2.913 . . . . 77.58 120.382 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -109.97 -58.89 2.0 Favored 'General case' 0 C--N 1.312 -1.063 0 O-C-N 121.484 -1.009 . . . . 71.34 108.33 170.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 176.87 -150.91 10.66 Favored Glycine 0 C--O 1.195 -2.317 0 N-CA-C 116.19 1.236 . . . . 67.94 116.19 175.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 76.0 mt -96.93 141.08 30.55 Favored 'General case' 0 C--O 1.208 -1.111 0 N-CA-C 112.459 0.54 . . . . 66.24 112.459 179.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 35.4 ttm-85 -85.2 128.69 34.77 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 113.7 1.0 . . . . 59.04 113.7 153.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . 0.45 HD21 ' HE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -99.16 136.26 39.37 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 109.153 -0.684 . . . . 61.17 109.153 159.17 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -150.26 165.08 29.84 Favored Glycine 0 N--CA 1.491 2.303 0 C-N-CA 119.602 -1.285 . . . . 49.09 112.922 -176.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -135.05 132.49 53.21 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.97 0 C-N-CA 117.097 -1.841 . . . . 42.54 108.663 171.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 37.4 ptt85 -126.97 165.93 18.5 Favored 'General case' 0 C--O 1.293 3.373 0 O-C-N 123.906 0.754 . . . . 53.12 111.545 -179.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 70.7 p -69.51 150.07 47.56 Favored 'General case' 0 C--O 1.215 -0.723 0 O-C-N 124.179 0.924 . . . . 48.56 109.093 173.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.7 t -145.45 98.84 3.21 Favored 'General case' 0 C--O 1.256 1.418 0 CA-C-O 122.226 1.012 . . . . 57.28 109.03 173.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.77 -165.58 54.31 Favored Glycine 0 C--O 1.196 -2.244 0 CA-C-O 123.288 1.493 . . . . 61.75 110.399 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 p -88.65 -19.26 26.43 Favored 'General case' 0 N--CA 1.421 -1.915 0 C-N-CA 114.289 -2.965 . . . . 65.33 111.632 -172.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 97.7 p -125.14 19.08 8.34 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 119.734 3.235 . . . . 59.03 119.734 177.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -121.89 162.76 15.54 Favored Glycine 0 CA--C 1.536 1.385 0 CA-C-O 122.373 0.985 . . . . 54.08 111.658 -172.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.8 141.69 40.85 Favored 'General case' 0 C--O 1.189 -2.125 0 N-CA-C 100.208 -3.997 . . . . 47.49 100.208 -177.322 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -133.5 130.17 38.16 Favored 'General case' 0 CA--C 1.457 -2.601 0 N-CA-C 106.415 -1.698 . . . . 44.37 106.415 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -59.3 135.56 57.69 Favored 'General case' 0 CA--C 1.563 1.449 0 CA-C-N 113.922 -1.49 . . . . 46.21 112.772 166.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.7 t -109.86 133.12 56.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.022 0 N-CA-C 107.395 -1.335 . . . . 50.85 107.395 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.25 104.85 4.15 Favored 'General case' 0 C--O 1.192 -1.922 0 N-CA-C 107.931 -1.137 . . . . 58.03 107.931 -171.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -148.96 168.36 23.29 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.592 1.33 . . . . 68.97 114.592 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -79.01 145.73 33.73 Favored 'General case' 0 C--O 1.174 -2.873 0 N-CA-C 109.617 -0.512 . . . . 60.77 109.617 172.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -133.22 147.88 31.25 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.93 0 CA-C-O 118.07 -0.967 . . . . 68.61 109.624 173.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.9 m-20 -98.59 -13.85 20.19 Favored 'General case' 0 N--CA 1.512 2.671 0 CA-C-O 123.047 1.404 . . . . 76.39 111.201 -175.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.18 149.69 10.3 Favored Pre-proline 0 C--O 1.21 -1.012 0 CA-C-N 113.738 -1.574 . . . . 78.43 110.386 175.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -67.99 152.53 76.7 Favored 'Trans proline' 0 N--CA 1.433 -2.086 0 C-N-CA 122.307 2.004 . . . . 70.61 111.122 166.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . 0.894 HG22 ' H ' ' A' ' 51' ' ' GLU 0.261 0.8 OUTLIER -100.31 159.89 28.52 Favored Pre-proline 0 N--CA 1.43 -1.44 0 N-CA-C 103.134 -2.913 . . . . 70.0 103.134 -176.688 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.03 -8.39 2.34 Favored 'Trans proline' 0 CA--C 1.578 2.705 0 C-N-CA 122.226 1.951 . . . . 67.72 115.341 169.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . 0.894 ' H ' HG22 ' A' ' 49' ' ' THR . 10.7 mp0 -100.18 -11.84 20.09 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.604 0.762 . . . . 72.77 111.792 -177.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . 0.521 ' OD2' ' HB ' ' A' ' 49' ' ' THR . 48.0 m-20 -93.5 159.21 15.34 Favored 'General case' 0 C--O 1.204 -1.304 0 N-CA-C 118.043 2.609 . . . . 57.59 118.043 -177.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . 0.896 ' CB ' ' CE ' ' A' ' 69' ' ' MET . . . -116.27 140.28 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.967 0 N-CA-C 101.075 -3.676 . . . . 53.09 101.075 168.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 49.4 t -107.68 126.02 64.07 Favored 'Isoleucine or valine' 0 C--O 1.181 -2.536 0 CA-C-N 119.299 0.954 . . . . 50.03 112.113 178.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -109.75 160.12 16.59 Favored 'General case' 0 CA--C 1.446 -3.057 0 N-CA-C 106.211 -1.774 . . . . 53.49 106.211 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -139.32 133.26 30.94 Favored 'General case' 1 C--O 1.146 -4.374 0 C-N-CA 117.93 -1.508 . . . . 64.72 109.998 175.705 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -145.65 147.56 32.14 Favored 'General case' 0 C--O 1.261 1.71 0 N-CA-C 109.146 -0.687 . . . . 57.41 109.146 175.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 27.5 mttp 35.15 41.96 0.08 Allowed 'General case' 0 C--O 1.158 -3.745 0 CA-C-N 113.823 -1.535 . . . . 66.48 111.623 -173.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.97 0.33 85.13 Favored Glycine 0 N--CA 1.421 -2.352 0 O-C-N 119.131 -2.231 . . . . 51.37 118.439 173.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -112.93 137.07 47.19 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.094 0 N-CA-C 116.058 1.873 . . . . 53.08 116.058 170.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -81.13 125.08 29.8 Favored 'General case' 0 N--CA 1.401 -2.915 0 CA-C-N 112.731 -2.031 . . . . 69.34 110.741 -178.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . 0.304 0.3 OUTLIER -118.81 113.89 43.1 Favored 'Isoleucine or valine' 1 C--O 1.147 -4.327 0 N-CA-C 109.358 -0.608 . . . . 47.67 109.358 -178.711 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.3 t -94.46 130.7 42.96 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.763 0 N-CA-C 109.112 -0.699 . . . . 50.7 109.112 -173.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 99.3 t -138.73 126.07 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.057 0 N-CA-C 108.453 -0.943 . . . . 49.92 108.453 -170.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -60.4 136.41 58.04 Favored 'General case' 0 C--O 1.264 1.864 0 N-CA-C 107.415 -1.328 . . . . 57.5 107.415 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -59.05 -40.1 95.14 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 128.297 2.856 . . . . 50.18 113.365 -173.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 39.0 mttp -74.14 -5.74 43.56 Favored 'General case' 0 C--O 1.172 -2.985 0 N-CA-C 113.281 0.845 . . . . 69.03 113.281 176.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 73.5 m -114.49 5.08 15.44 Favored 'General case' 0 C--O 1.185 -2.342 0 N-CA-C 116.763 2.135 . . . . 48.85 116.763 172.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' MET . . . . . 1.016 ' HG2' ' O ' ' A' ' 109' ' ' HOH . 8.7 ttm -61.23 -53.79 52.39 Favored 'General case' 0 C--O 1.2 -1.533 0 C-N-CA 127.31 2.244 . . . . 52.64 108.213 -173.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -60.85 -43.8 97.87 Favored 'General case' 0 C--O 1.182 -2.46 0 N-CA-C 113.55 0.944 . . . . 67.53 113.55 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -51.7 -48.73 63.41 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-O 122.477 1.132 . . . . 47.23 112.312 172.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.9 mt -87.2 -13.77 42.99 Favored 'General case' 0 C--O 1.163 -3.492 0 CA-C-N 115.388 -0.823 . . . . 50.45 110.669 -166.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -52.14 138.94 24.62 Favored 'General case' 0 C--O 1.207 -1.136 0 CA-C-N 118.854 0.752 . . . . 58.3 109.673 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.5 -10.38 69.74 Favored Glycine 0 C--O 1.183 -3.084 0 N-CA-C 120.296 2.878 . . . . 51.53 120.296 -172.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . 0.415 HG22 HD21 ' A' ' 92' ' ' ASN . 41.4 p -79.57 141.51 36.54 Favored 'General case' 0 C--O 1.182 -2.498 0 O-C-N 119.942 -1.917 . . . . 58.06 108.186 -179.428 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -113.31 126.05 54.96 Favored 'General case' 0 N--CA 1.407 -2.621 0 CA-C-N 113.711 -1.586 . . . . 59.17 109.718 168.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.3 tp -78.95 116.78 19.48 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 114.409 1.262 . . . . 51.13 114.409 163.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -110.77 164.48 12.72 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 109.375 -0.602 . . . . 62.39 109.375 177.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -135.06 127.63 30.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 124.384 1.073 . . . . 59.46 110.009 173.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 47.3 t -99.68 119.64 47.99 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.087 0 N-CA-C 103.902 -2.629 . . . . 57.65 103.902 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . . . -83.39 -28.12 29.13 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.678 0.992 . . . . 61.31 113.678 -168.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLU . . . . . 0.788 ' CB ' ' O ' ' A' ' 110' ' ' HOH . . . -137.41 156.73 47.84 Favored 'General case' 0 CA--C 1.58 2.105 0 CA-C-N 114.062 -1.426 . . . . 62.75 114.458 -174.382 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 100.48 -177.42 28.34 Favored Glycine 0 CA--C 1.565 3.187 0 CA-C-O 122.858 1.254 . . . . 60.21 110.404 173.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.17 -24.42 63.14 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-O 118.494 -0.765 . . . . 55.05 111.617 -173.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASN . . . . . 0.489 ' O ' ' HE3' ' A' ' 89' ' ' LYS . 0.2 OUTLIER -101.73 32.44 3.39 Favored 'General case' 0 C--O 1.208 -1.107 0 N-CA-C 119.944 3.313 . . . . 67.14 119.944 169.577 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -44.94 141.35 2.23 Favored 'General case' 0 C--O 1.186 -2.246 0 N-CA-C 111.942 0.349 . . . . 59.14 111.942 165.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 131.6 -176.04 19.37 Favored Glycine 0 C--O 1.19 -2.608 0 O-C-N 123.573 0.545 . . . . 50.69 112.452 176.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -85.69 157.58 20.27 Favored 'General case' 0 C--O 1.179 -2.647 0 N-CA-C 112.417 0.525 . . . . 56.72 112.417 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . 0.489 ' HE3' ' O ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -150.99 151.03 31.49 Favored 'General case' 0 C--O 1.176 -2.771 0 N-CA-C 105.403 -2.073 . . . . 65.36 105.403 -164.283 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PHE . . . . . 0.45 ' HE1' HD21 ' A' ' 28' ' ' LEU . 10.5 m-85 -123.47 140.8 52.64 Favored 'General case' 0 C--O 1.162 -3.514 0 C-N-CA 124.958 1.303 . . . . 54.9 113.743 174.439 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 55.9 p -139.46 165.38 27.38 Favored 'General case' 0 CA--C 1.484 -1.586 0 O-C-N 120.193 -1.567 . . . . 55.17 107.856 174.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . 0.415 HD21 HG22 ' A' ' 75' ' ' THR . 29.2 t-20 -162.78 120.57 1.29 Allowed Pre-proline 0 N--CA 1.43 -1.461 0 CA-C-N 112.216 -2.266 . . . . 54.31 105.715 -176.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -64.06 -21.92 68.0 Favored 'Trans proline' 0 CA--C 1.56 1.802 0 O-C-N 123.696 1.366 . . . . 59.36 111.526 -172.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -94.04 18.01 11.41 Favored 'General case' 0 C--O 1.153 -3.996 0 N-CA-C 115.497 1.666 . . . . 59.09 115.497 178.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' VAL . . . . . 0.424 HG11 ' HG2' ' B' ' 38' ' ' MET . 77.1 t -126.68 103.86 11.86 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.895 0 N-CA-C 103.786 -2.672 . . . . 64.69 103.786 179.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . . . -91.61 151.1 20.85 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 118.152 -1.419 . . . . 69.81 110.472 -166.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASP . . . . . 0.432 ' HA ' ' HB ' ' B' ' 32' ' ' THR . . . -76.71 12.08 1.44 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.603 0.761 . . . . 77.85 111.978 -174.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.432 0 C-N-CA 125.826 1.651 . . . . 78.61 113.856 171.768 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.336 0 CA-C-O 118.504 -0.76 . . . . 53.13 109.362 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 23.2 mm -104.59 140.62 22.1 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.871 0 CA-C-O 118.703 -0.665 . . . . 59.69 112.28 165.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 70.5 p -130.03 171.21 13.04 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 114.209 1.189 . . . . 52.23 114.209 173.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 7.5 mp -126.09 143.66 51.03 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-O 117.92 -1.038 . . . . 56.19 108.489 174.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 77.7 p -70.57 159.96 33.37 Favored 'General case' 0 CA--C 1.587 2.399 0 CA-C-N 119.407 1.003 . . . . 56.52 112.887 170.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -49.79 -47.88 50.94 Favored 'General case' 0 N--CA 1.537 3.892 0 N-CA-C 115.105 1.52 . . . . 70.28 115.105 171.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.2 p -58.71 -42.33 88.42 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 115.506 -2.478 . . . . 67.43 116.559 172.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.78 -42.07 74.28 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 117.304 -1.758 . . . . 58.74 113.448 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.59 -40.9 63.14 Favored 'General case' 0 C--O 1.191 -2.023 0 CA-C-N 114.897 -1.047 . . . . 62.66 112.849 171.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.08 -42.63 65.97 Favored 'General case' 0 N--CA 1.502 2.157 0 N-CA-C 106.671 -1.603 . . . . 64.87 106.671 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ARG . . . . . 0.511 ' NH2' ' CE1' ' B' ' 16' ' ' PHE . 0.0 OUTLIER -64.22 -42.99 96.35 Favored 'General case' 0 C--N 1.384 2.1 0 CA-C-O 121.949 0.88 . . . . 77.44 109.211 -178.734 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 19.3 t -77.95 -31.3 16.75 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-O 121.401 0.619 . . . . 62.17 109.794 -171.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 -61.73 -45.48 93.77 Favored 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 122.055 0.931 . . . . 65.68 110.848 174.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' THR . . . . . 0.415 ' O ' ' C ' ' B' ' 16' ' ' PHE . 84.8 m -52.75 -53.85 42.12 Favored 'General case' 0 C--O 1.201 -1.474 0 CA-C-N 114.555 -1.202 . . . . 71.66 112.555 164.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' PHE . . . . . 0.511 ' CE1' ' NH2' ' B' ' 12' ' ' ARG . 22.6 m-85 -61.35 -18.51 59.03 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 115.234 -2.586 . . . . 71.0 107.532 -169.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 mt -82.75 -56.44 3.84 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-N 114.666 -1.152 . . . . 73.99 113.681 -166.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ALA . . . . . 0.805 ' O ' ' N ' ' B' ' 20' ' ' ARG . . . -32.32 -98.31 0.0 OUTLIER 'General case' 0 CA--C 1.585 2.307 0 O-C-N 125.561 1.788 . . . . 77.26 108.369 149.251 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ASN . . . . . 0.424 ' C ' ' O ' ' B' ' 18' ' ' ALA . 3.1 m-20 -23.61 -19.18 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 119.879 3.289 . . . . 81.11 119.879 -178.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ARG . . . . . 0.805 ' N ' ' O ' ' B' ' 18' ' ' ALA . 8.5 ptm180 -117.04 -3.53 11.56 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-N 122.281 2.31 . . . . 80.06 111.343 177.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . 16.72 37.65 0.0 OUTLIER Glycine 0 C--N 1.353 1.514 0 C-N-CA 129.007 3.194 . . . . 80.48 120.09 -169.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . . . -114.58 -50.7 2.78 Favored 'General case' 0 N--CA 1.509 2.523 0 N-CA-C 113.771 1.026 . . . . 80.65 113.771 -164.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -100.23 178.63 29.31 Favored Glycine 0 CA--C 1.573 3.705 1 N-CA-C 126.496 5.359 . . . . 76.42 126.496 -172.212 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PHE . . . . . 0.715 ' HB2' ' O ' ' B' ' 46' ' ' ASP . 69.3 t80 -79.77 -40.13 29.43 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 112.141 -2.029 . . . . 68.57 113.596 -178.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 167.2 -156.36 28.1 Favored Glycine 0 C--O 1.257 1.534 0 O-C-N 120.277 -1.514 . . . . 63.59 109.577 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 32.8 mt -99.22 138.72 35.91 Favored 'General case' 0 C--O 1.187 -2.191 0 CA-C-O 118.089 -0.958 . . . . 65.33 108.788 -176.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -93.27 131.89 37.96 Favored 'General case' 0 CA--C 1.562 1.414 0 N-CA-C 115.886 1.81 . . . . 52.59 115.886 155.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 32.0 tp -112.23 121.69 45.63 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.847 -1.069 . . . . 53.49 109.445 172.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.36 -178.98 16.38 Favored Glycine 0 C--O 1.183 -3.081 0 CA-C-O 123.025 1.347 . . . . 45.76 114.074 -176.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 24.7 m -136.2 147.97 27.73 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.263 0 C-N-CA 124.2 1.0 . . . . 48.18 110.143 172.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 42.1 ptt85 -141.11 167.82 21.26 Favored 'General case' 1 N--CA 1.372 -4.341 0 CA-C-O 125.252 2.453 . . . . 55.5 109.873 174.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' THR . . . . . 0.432 ' HB ' ' HA ' ' A' ' 97' ' ' ASP . 0.6 OUTLIER -68.6 144.38 54.54 Favored 'General case' 1 C--O 1.151 -4.113 0 CA-C-N 112.391 -2.186 . . . . 56.55 111.631 173.021 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 46.9 t -138.24 77.14 1.61 Allowed 'General case' 0 C--O 1.245 0.834 0 C-N-CA 125.401 1.48 . . . . 57.03 111.763 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.64 -171.79 49.4 Favored Glycine 0 N--CA 1.474 1.227 0 CA-C-O 123.468 1.593 . . . . 60.39 111.414 -169.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 30.4 p -96.1 0.2 51.09 Favored 'General case' 0 C--N 1.307 -1.249 0 O-C-N 119.804 -1.998 . . . . 62.39 112.449 -167.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' SER . . . . . 0.56 ' CB ' ' O ' ' B' ' 118' ' ' HOH . . . -119.53 10.9 11.94 Favored 'General case' 0 C--O 1.279 2.628 0 O-C-N 125.201 1.563 . . . . 60.84 114.867 175.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . -167.99 -172.36 34.91 Favored Glycine 0 C--O 1.199 -2.074 0 N-CA-C 118.704 2.242 . . . . 57.67 118.704 174.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' MET . . . . . 0.424 ' HG2' HG11 ' A' ' 95' ' ' VAL . 30.9 mtp -140.7 153.44 45.95 Favored 'General case' 0 C--O 1.284 2.884 0 CA-C-O 122.146 0.974 . . . . 49.01 110.481 -171.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -126.39 151.59 47.46 Favored 'General case' 0 CA--C 1.476 -1.898 0 N-CA-C 106.824 -1.547 . . . . 45.2 106.824 177.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -70.98 147.31 48.8 Favored 'General case' 0 C--O 1.168 -3.185 0 C-N-CA 126.555 1.942 . . . . 45.92 107.333 172.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 73.7 t -117.36 136.51 54.27 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.806 0 O-C-N 119.868 -1.77 . . . . 52.39 106.374 163.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -139.86 111.54 7.3 Favored 'General case' 1 C--O 1.145 -4.425 0 N-CA-C 104.497 -2.408 . . . . 54.11 104.497 -177.004 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -144.52 171.89 13.72 Favored 'General case' 0 CA--C 1.6 2.904 0 CA-C-N 119.596 1.089 . . . . 63.63 112.055 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.28 139.72 30.75 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-O 119.6 -0.238 . . . . 57.93 110.589 167.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . 0.282 0.0 OUTLIER -124.43 145.2 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.556 0 N-CA-C 106.772 -1.566 . . . . 63.9 106.772 175.127 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASP . . . . . 0.715 ' O ' ' HB2' ' B' ' 24' ' ' PHE . 59.7 m-20 -84.21 -57.2 3.27 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.565 -1.198 . . . . 75.3 108.779 175.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -119.54 131.39 24.4 Favored Pre-proline 0 CA--C 1.566 1.577 0 N-CA-C 114.6 1.333 . . . . 79.4 114.6 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' PRO . . . . . 0.538 ' HD3' ' CD2' ' B' ' 24' ' ' PHE . 14.1 Cg_endo -58.51 162.39 12.56 Favored 'Trans proline' 0 CA--C 1.481 -2.175 0 C-N-CA 121.869 1.713 . . . . 70.63 112.438 168.391 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' THR . . . . . 0.684 ' HB ' ' HD2' ' B' ' 50' ' ' PRO . 3.9 p -108.4 166.99 9.89 Favored Pre-proline 0 CA--C 1.481 -1.706 0 C-N-CA 119.759 -0.776 . . . . 64.09 111.096 165.171 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' PRO . . . . . 0.684 ' HD2' ' HB ' ' B' ' 49' ' ' THR . 17.7 Cg_endo -60.98 -12.19 21.49 Favored 'Trans proline' 0 CA--C 1.562 1.883 0 O-C-N 124.311 1.69 . . . . 61.14 114.881 168.512 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 25.9 mp0 -85.69 -5.95 59.2 Favored 'General case' 0 N--CA 1.499 1.975 0 C-N-CA 120.31 -0.556 . . . . 74.56 112.172 175.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -97.77 160.37 14.35 Favored 'General case' 0 C--O 1.175 -2.854 0 CA-C-O 122.025 0.916 . . . . 57.2 111.732 -169.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mm -118.5 123.09 71.01 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.267 0 N-CA-C 105.492 -2.04 . . . . 50.34 105.492 169.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 81.0 t -106.55 121.85 59.71 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.491 0 N-CA-C 108.345 -0.983 . . . . 43.36 108.345 -172.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -103.59 154.87 19.02 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 106.933 -1.506 . . . . 48.67 106.933 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -133.71 126.47 30.82 Favored 'General case' 0 C--O 1.187 -2.185 0 O-C-N 120.574 -1.329 . . . . 64.98 113.08 170.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -142.16 128.0 19.37 Favored 'General case' 0 C--O 1.252 1.193 0 N-CA-C 100.63 -3.841 . . . . 62.1 100.63 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LYS . . . . . 0.566 ' HE2' ' O ' ' B' ' 120' ' ' HOH . 23.4 mttt 46.35 44.14 12.35 Favored 'General case' 0 C--O 1.187 -2.186 0 CA-C-N 113.919 -1.492 . . . . 60.0 112.471 178.906 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.76 -0.89 89.16 Favored Glycine 0 CA--C 1.497 -1.074 0 N-CA-C 117.973 1.949 . . . . 57.31 117.973 171.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . 0.404 0.2 OUTLIER -113.85 125.3 71.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.865 0 N-CA-C 108.155 -1.054 . . . . 61.1 108.155 176.781 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -76.22 125.83 29.89 Favored 'General case' 0 N--CA 1.383 -3.823 0 CA-C-N 113.617 -1.629 . . . . 64.64 107.77 174.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 86.8 t -111.21 124.32 67.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 N-CA-C 105.861 -1.903 . . . . 51.61 105.861 177.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 84.8 t -102.02 127.7 55.27 Favored 'Isoleucine or valine' 1 CA--C 1.635 4.219 0 N-CA-C 106.105 -1.813 . . . . 45.63 106.105 -173.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 48.0 t -130.69 117.22 37.82 Favored 'Isoleucine or valine' 1 N--CA 1.589 6.506 0 CA-C-N 119.897 1.226 . . . . 47.93 112.915 178.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -51.41 137.33 23.9 Favored 'General case' 0 C--O 1.175 -2.831 0 O-C-N 119.491 -2.006 . . . . 64.05 110.237 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -61.71 -29.2 71.43 Favored Glycine 1 C--O 1.165 -4.217 0 C-N-CA 124.314 0.959 . . . . 52.67 111.384 -170.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -85.33 -7.17 59.11 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 121.068 -1.254 . . . . 73.83 110.305 -176.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 7.1 m -94.93 -8.56 36.71 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 115.354 1.612 . . . . 48.18 115.354 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 69.5 mmm -56.93 -36.08 69.81 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 122.213 1.006 . . . . 48.87 111.191 -176.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -60.47 -28.99 68.77 Favored 'General case' 0 C--O 1.274 2.371 0 CA-C-N 115.715 -0.675 . . . . 56.93 110.486 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -84.83 -18.64 34.25 Favored 'General case' 0 CA--C 1.588 2.434 0 N-CA-C 117.322 2.341 . . . . 45.31 117.322 176.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 65.4 mt -121.84 -27.08 4.71 Favored 'General case' 0 C--O 1.159 -3.68 0 CA-C-N 114.696 -1.138 . . . . 47.12 112.713 -155.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -57.6 137.65 56.13 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 115.007 1.484 . . . . 57.27 115.007 -171.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . 76.95 -0.57 65.92 Favored Glycine 0 C--O 1.176 -3.524 0 C-N-CA 126.365 1.936 . . . . 46.9 112.622 -166.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 6.3 m -66.37 136.21 55.44 Favored 'General case' 0 C--O 1.18 -2.584 0 O-C-N 120.123 -1.81 . . . . 47.57 113.133 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -107.08 125.43 51.04 Favored 'General case' 0 N--CA 1.397 -3.086 0 CA-C-N 116.324 -0.398 . . . . 58.11 111.989 167.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 18.6 tp -83.38 133.15 34.95 Favored 'General case' 0 CA--C 1.479 -1.783 0 CA-C-O 122.99 1.376 . . . . 52.13 107.936 171.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ASP . . . . . 0.546 ' OD2' ' O ' ' B' ' 121' ' ' HOH . 0.5 OUTLIER -136.46 168.07 20.16 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 114.569 -1.196 . . . . 64.93 107.918 -162.708 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -152.53 137.3 17.03 Favored 'General case' 1 C--O 1.151 -4.125 0 C-N-CA 119.663 -0.815 . . . . 59.36 112.548 -178.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' VAL . . . . . . . . . . . . . 11.1 t -115.62 117.77 56.66 Favored 'Isoleucine or valine' 0 C--O 1.259 1.568 0 N-CA-C 101.598 -3.482 . . . . 62.23 101.598 -173.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . . . -72.47 -32.04 65.91 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 125.128 1.518 . . . . 60.54 113.934 -173.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -134.47 160.15 38.91 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 117.071 2.248 . . . . 80.0 117.071 -164.025 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 84.81 177.77 51.09 Favored Glycine 0 CA--C 1.553 2.435 0 C-N-CA 118.667 -1.73 . . . . 59.99 114.621 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -23.55 65.17 Favored 'General case' 0 CA--C 1.558 1.276 0 N-CA-C 114.313 1.227 . . . . 61.36 114.313 -173.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ASN . . . . . 0.522 ' O ' ' C ' ' B' ' 86' ' ' GLU . 70.7 m-20 -90.88 16.14 9.98 Favored 'General case' 0 C--O 1.19 -2.048 0 N-CA-C 116.48 2.03 . . . . 70.28 116.48 170.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLU . . . . . 0.522 ' C ' ' O ' ' B' ' 85' ' ' ASN . 24.9 tt0 -44.49 132.48 6.12 Favored 'General case' 1 C--O 1.152 -4.042 0 C-N-CA 116.007 -2.277 . . . . 56.88 110.952 177.119 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . 150.58 -175.79 29.45 Favored Glycine 0 C--O 1.201 -1.955 0 N-CA-C 111.353 -0.699 . . . . 47.19 111.353 168.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -70.78 148.73 47.61 Favored 'General case' 0 C--O 1.172 -2.977 0 CA-C-N 116.994 0.397 . . . . 58.26 111.493 170.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.37 159.11 43.8 Favored 'General case' 0 N--CA 1.417 -2.117 0 CA-C-N 115.988 -0.551 . . . . 70.49 112.038 173.88 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' PHE . . . . . 0.459 ' CD2' ' N ' ' B' ' 90' ' ' PHE . 4.4 m-85 -119.24 135.53 54.64 Favored 'General case' 0 C--O 1.155 -3.892 0 N-CA-C 108.218 -1.03 . . . . 56.59 108.218 -171.684 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 98.4 m -117.95 102.72 9.29 Favored 'General case' 0 N--CA 1.419 -2.006 0 N-CA-C 104.72 -2.326 . . . . 52.39 104.72 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -123.2 108.84 31.78 Favored Pre-proline 0 C--O 1.185 -2.319 0 CA-C-N 113.906 -1.497 . . . . 46.49 109.797 -164.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -64.34 -18.78 64.38 Favored 'Trans proline' 0 CA--C 1.576 2.596 0 C-N-CA 123.48 2.787 . . . . 49.74 117.191 -176.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -78.09 -16.19 58.22 Favored 'General case' 0 C--O 1.181 -2.51 0 C-N-CA 127.916 2.486 . . . . 48.29 112.62 178.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 52.8 t -115.72 135.91 54.29 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 C-N-CA 127.352 2.261 . . . . 50.4 108.727 -171.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -92.68 145.91 24.06 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 119.582 1.083 . . . . 68.28 108.314 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.96 121.25 22.43 Favored 'General case' 0 C--O 1.171 -3.027 0 N-CA-C 116.278 1.955 . . . . 70.49 116.278 173.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.532 3.628 0 CA-C-O 124.897 2.284 . . . . 76.64 111.729 142.172 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . 1.016 ' O ' ' HG2' ' A' ' 69' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . 0.788 ' O ' ' CB ' ' A' ' 82' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.873 ' O ' HG21 ' A' ' 15' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.45 ' O ' ' ND2' ' A' ' 85' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . 0.56 ' O ' ' CB ' ' B' ' 36' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HOH . . . . . 0.566 ' O ' ' HE2' ' B' ' 58' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HOH . . . . . 0.546 ' O ' ' OD2' ' B' ' 78' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.212 -0.888 0 N-CA-C 109.149 -0.686 . . . . 52.21 109.149 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 mt -99.83 122.09 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.466 -2.251 0 N-CA-C 106.446 -1.687 . . . . 55.29 106.446 172.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.2 p -135.93 163.38 30.4 Favored 'General case' 0 C--O 1.188 -2.176 0 C-N-CA 114.452 -2.899 . . . . 57.16 114.915 -175.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.5 mp -108.93 143.91 37.56 Favored 'General case' 0 C--O 1.16 -3.655 0 N-CA-C 107.499 -1.297 . . . . 58.27 107.499 173.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 89.7 p -71.19 164.79 24.95 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 104.54 -2.393 . . . . 59.75 104.54 171.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -54.31 -50.09 68.16 Favored 'General case' 0 N--CA 1.51 2.549 0 CA-C-O 121.504 0.668 . . . . 64.88 112.654 174.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.5 p -64.33 -30.21 71.26 Favored 'General case' 0 C--O 1.209 -1.026 0 C-N-CA 118.916 -1.114 . . . . 58.22 112.25 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.5 ' O ' HG23 ' A' ' 13' ' ' VAL . . . -75.23 -48.17 24.72 Favored 'General case' 0 C--O 1.186 -2.284 0 N-CA-C 104.471 -2.418 . . . . 52.33 104.471 -173.457 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.27 -48.03 65.52 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 117.331 2.345 . . . . 57.02 117.331 171.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.493 ' O ' HG23 ' A' ' 15' ' ' THR . . . -63.41 -36.53 84.03 Favored 'General case' 0 C--N 1.299 -1.626 0 C-N-CA 117.733 -1.587 . . . . 59.15 108.775 178.176 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.465 ' HD2' ' CZ ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -70.32 -44.84 67.43 Favored 'General case' 0 C--N 1.36 1.041 0 CA-C-O 123.292 1.52 . . . . 68.98 107.764 -175.718 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 9' ' ' ALA . 79.8 t -65.79 -33.42 63.48 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.838 0 CA-C-N 113.227 -1.806 . . . . 56.97 106.468 -173.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.6 m-20 -72.52 -37.16 68.43 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 116.689 -2.004 . . . . 62.64 107.967 -173.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' THR . . . . . 0.873 HG21 ' O ' ' A' ' 116' ' ' HOH 0.365 0.1 OUTLIER -68.05 -25.16 65.22 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 117.019 2.229 . . . . 67.94 117.019 175.392 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.496 ' O ' ' HB3' ' A' ' 20' ' ' ARG . 13.3 m-85 -73.48 -38.15 65.5 Favored 'General case' 0 C--O 1.174 -2.903 0 CA-C-N 120.881 1.673 . . . . 70.23 114.379 166.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.7 mt -71.08 -40.23 71.69 Favored 'General case' 0 CA--C 1.591 2.537 0 CA-C-N 118.847 0.749 . . . . 73.55 111.669 -177.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.14 -74.69 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.256 1.422 . . . . 76.94 112.355 165.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.425 HD22 ' H ' ' A' ' 19' ' ' ASN . 0.8 OUTLIER -44.7 -15.37 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 115.975 1.843 . . . . 79.49 115.975 169.241 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.496 ' HB3' ' O ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -105.23 -13.5 15.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 118.522 -2.611 . . . . 79.18 104.434 -179.567 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.06 -71.01 2.27 Favored Glycine 0 C--O 1.262 1.897 0 CA-C-N 113.966 -1.47 . . . . 78.61 112.533 175.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . 1.049 ' HA ' ' HE3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -86.35 148.0 25.79 Favored 'General case' 0 CA--C 1.611 3.307 0 O-C-N 125.473 1.337 . . . . 80.43 114.063 -172.954 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 157.69 168.17 19.72 Favored Glycine 0 C--N 1.361 1.96 0 N-CA-C 120.382 2.913 . . . . 77.58 120.382 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -109.97 -58.89 2.0 Favored 'General case' 0 C--N 1.312 -1.063 0 O-C-N 121.484 -1.009 . . . . 71.34 108.33 170.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 176.87 -150.91 10.66 Favored Glycine 0 C--O 1.195 -2.317 0 N-CA-C 116.19 1.236 . . . . 67.94 116.19 175.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 76.0 mt -96.93 141.08 30.55 Favored 'General case' 0 C--O 1.208 -1.111 0 N-CA-C 112.459 0.54 . . . . 66.24 112.459 179.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 35.4 ttm-85 -85.2 128.69 34.77 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 113.7 1.0 . . . . 59.04 113.7 153.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.45 HD21 ' HE1' ' A' ' 90' ' ' PHE . 0.1 OUTLIER -99.16 136.26 39.37 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 109.153 -0.684 . . . . 61.17 109.153 159.17 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -150.26 165.08 29.84 Favored Glycine 0 N--CA 1.491 2.303 0 C-N-CA 119.602 -1.285 . . . . 49.09 112.922 -176.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -135.05 132.49 53.21 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.97 0 C-N-CA 117.097 -1.841 . . . . 42.54 108.663 171.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 37.4 ptt85 -126.97 165.93 18.5 Favored 'General case' 0 C--O 1.293 3.373 0 O-C-N 123.906 0.754 . . . . 53.12 111.545 -179.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 70.7 p -69.51 150.07 47.56 Favored 'General case' 0 C--O 1.215 -0.723 0 O-C-N 124.179 0.924 . . . . 48.56 109.093 173.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.7 t -145.45 98.84 3.21 Favored 'General case' 0 C--O 1.256 1.418 0 CA-C-O 122.226 1.012 . . . . 57.28 109.03 173.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.77 -165.58 54.31 Favored Glycine 0 C--O 1.196 -2.244 0 CA-C-O 123.288 1.493 . . . . 61.75 110.399 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 p -88.65 -19.26 26.43 Favored 'General case' 0 N--CA 1.421 -1.915 0 C-N-CA 114.289 -2.965 . . . . 65.33 111.632 -172.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 97.7 p -125.14 19.08 8.34 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 119.734 3.235 . . . . 59.03 119.734 177.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -121.89 162.76 15.54 Favored Glycine 0 CA--C 1.536 1.385 0 CA-C-O 122.373 0.985 . . . . 54.08 111.658 -172.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.8 141.69 40.85 Favored 'General case' 0 C--O 1.189 -2.125 0 N-CA-C 100.208 -3.997 . . . . 47.49 100.208 -177.322 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -133.5 130.17 38.16 Favored 'General case' 0 CA--C 1.457 -2.601 0 N-CA-C 106.415 -1.698 . . . . 44.37 106.415 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -59.3 135.56 57.69 Favored 'General case' 0 CA--C 1.563 1.449 0 CA-C-N 113.922 -1.49 . . . . 46.21 112.772 166.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.7 t -109.86 133.12 56.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.022 0 N-CA-C 107.395 -1.335 . . . . 50.85 107.395 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.25 104.85 4.15 Favored 'General case' 0 C--O 1.192 -1.922 0 N-CA-C 107.931 -1.137 . . . . 58.03 107.931 -171.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -148.96 168.36 23.29 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.592 1.33 . . . . 68.97 114.592 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -79.01 145.73 33.73 Favored 'General case' 0 C--O 1.174 -2.873 0 N-CA-C 109.617 -0.512 . . . . 60.77 109.617 172.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -133.22 147.88 31.25 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.93 0 CA-C-O 118.07 -0.967 . . . . 68.61 109.624 173.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.9 m-20 -98.59 -13.85 20.19 Favored 'General case' 0 N--CA 1.512 2.671 0 CA-C-O 123.047 1.404 . . . . 76.39 111.201 -175.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.18 149.69 10.3 Favored Pre-proline 0 C--O 1.21 -1.012 0 CA-C-N 113.738 -1.574 . . . . 78.43 110.386 175.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -67.99 152.53 76.7 Favored 'Trans proline' 0 N--CA 1.433 -2.086 0 C-N-CA 122.307 2.004 . . . . 70.61 111.122 166.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . 0.894 HG22 ' H ' ' A' ' 51' ' ' GLU 0.261 0.8 OUTLIER -100.31 159.89 28.52 Favored Pre-proline 0 N--CA 1.43 -1.44 0 N-CA-C 103.134 -2.913 . . . . 70.0 103.134 -176.688 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.03 -8.39 2.34 Favored 'Trans proline' 0 CA--C 1.578 2.705 0 C-N-CA 122.226 1.951 . . . . 67.72 115.341 169.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.894 ' H ' HG22 ' A' ' 49' ' ' THR . 10.7 mp0 -100.18 -11.84 20.09 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.604 0.762 . . . . 72.77 111.792 -177.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.521 ' OD2' ' HB ' ' A' ' 49' ' ' THR . 48.0 m-20 -93.5 159.21 15.34 Favored 'General case' 0 C--O 1.204 -1.304 0 N-CA-C 118.043 2.609 . . . . 57.59 118.043 -177.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.896 ' CB ' ' CE ' ' A' ' 69' ' ' MET . . . -116.27 140.28 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.967 0 N-CA-C 101.075 -3.676 . . . . 53.09 101.075 168.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 49.4 t -107.68 126.02 64.07 Favored 'Isoleucine or valine' 0 C--O 1.181 -2.536 0 CA-C-N 119.299 0.954 . . . . 50.03 112.113 178.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -109.75 160.12 16.59 Favored 'General case' 0 CA--C 1.446 -3.057 0 N-CA-C 106.211 -1.774 . . . . 53.49 106.211 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -139.32 133.26 30.94 Favored 'General case' 1 C--O 1.146 -4.374 0 C-N-CA 117.93 -1.508 . . . . 64.72 109.998 175.705 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -145.65 147.56 32.14 Favored 'General case' 0 C--O 1.261 1.71 0 N-CA-C 109.146 -0.687 . . . . 57.41 109.146 175.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 27.5 mttp 35.15 41.96 0.08 Allowed 'General case' 0 C--O 1.158 -3.745 0 CA-C-N 113.823 -1.535 . . . . 66.48 111.623 -173.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.97 0.33 85.13 Favored Glycine 0 N--CA 1.421 -2.352 0 O-C-N 119.131 -2.231 . . . . 51.37 118.439 173.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -112.93 137.07 47.19 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.094 0 N-CA-C 116.058 1.873 . . . . 53.08 116.058 170.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -81.13 125.08 29.8 Favored 'General case' 0 N--CA 1.401 -2.915 0 CA-C-N 112.731 -2.031 . . . . 69.34 110.741 -178.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . 0.304 0.3 OUTLIER -118.81 113.89 43.1 Favored 'Isoleucine or valine' 1 C--O 1.147 -4.327 0 N-CA-C 109.358 -0.608 . . . . 47.67 109.358 -178.711 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.3 t -94.46 130.7 42.96 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.763 0 N-CA-C 109.112 -0.699 . . . . 50.7 109.112 -173.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 99.3 t -138.73 126.07 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.057 0 N-CA-C 108.453 -0.943 . . . . 49.92 108.453 -170.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -60.4 136.41 58.04 Favored 'General case' 0 C--O 1.264 1.864 0 N-CA-C 107.415 -1.328 . . . . 57.5 107.415 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -59.05 -40.1 95.14 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 128.297 2.856 . . . . 50.18 113.365 -173.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 39.0 mttp -74.14 -5.74 43.56 Favored 'General case' 0 C--O 1.172 -2.985 0 N-CA-C 113.281 0.845 . . . . 69.03 113.281 176.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 73.5 m -114.49 5.08 15.44 Favored 'General case' 0 C--O 1.185 -2.342 0 N-CA-C 116.763 2.135 . . . . 48.85 116.763 172.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' MET . . . . . 1.016 ' HG2' ' O ' ' A' ' 109' ' ' HOH . 8.7 ttm -61.23 -53.79 52.39 Favored 'General case' 0 C--O 1.2 -1.533 0 C-N-CA 127.31 2.244 . . . . 52.64 108.213 -173.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -60.85 -43.8 97.87 Favored 'General case' 0 C--O 1.182 -2.46 0 N-CA-C 113.55 0.944 . . . . 67.53 113.55 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -51.7 -48.73 63.41 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-O 122.477 1.132 . . . . 47.23 112.312 172.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.9 mt -87.2 -13.77 42.99 Favored 'General case' 0 C--O 1.163 -3.492 0 CA-C-N 115.388 -0.823 . . . . 50.45 110.669 -166.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -52.14 138.94 24.62 Favored 'General case' 0 C--O 1.207 -1.136 0 CA-C-N 118.854 0.752 . . . . 58.3 109.673 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.5 -10.38 69.74 Favored Glycine 0 C--O 1.183 -3.084 0 N-CA-C 120.296 2.878 . . . . 51.53 120.296 -172.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.4 p -79.57 141.51 36.54 Favored 'General case' 0 C--O 1.182 -2.498 0 O-C-N 119.942 -1.917 . . . . 58.06 108.186 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -113.31 126.05 54.96 Favored 'General case' 0 N--CA 1.407 -2.621 0 CA-C-N 113.711 -1.586 . . . . 59.17 109.718 168.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.3 tp -78.95 116.78 19.48 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 114.409 1.262 . . . . 51.13 114.409 163.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -110.77 164.48 12.72 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 109.375 -0.602 . . . . 62.39 109.375 177.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -135.06 127.63 30.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 124.384 1.073 . . . . 59.46 110.009 173.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 47.3 t -99.68 119.64 47.99 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.087 0 N-CA-C 103.902 -2.629 . . . . 57.65 103.902 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . . . -83.39 -28.12 29.13 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.678 0.992 . . . . 61.31 113.678 -168.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.788 ' CB ' ' O ' ' A' ' 110' ' ' HOH . . . -137.41 156.73 47.84 Favored 'General case' 0 CA--C 1.58 2.105 0 CA-C-N 114.062 -1.426 . . . . 62.75 114.458 -174.382 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 100.48 -177.42 28.34 Favored Glycine 0 CA--C 1.565 3.187 0 CA-C-O 122.858 1.254 . . . . 60.21 110.404 173.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.17 -24.42 63.14 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-O 118.494 -0.765 . . . . 55.05 111.617 -173.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.489 ' O ' ' HE3' ' A' ' 89' ' ' LYS . 0.2 OUTLIER -101.73 32.44 3.39 Favored 'General case' 0 C--O 1.208 -1.107 0 N-CA-C 119.944 3.313 . . . . 67.14 119.944 169.577 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -44.94 141.35 2.23 Favored 'General case' 0 C--O 1.186 -2.246 0 N-CA-C 111.942 0.349 . . . . 59.14 111.942 165.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 131.6 -176.04 19.37 Favored Glycine 0 C--O 1.19 -2.608 0 O-C-N 123.573 0.545 . . . . 50.69 112.452 176.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -85.69 157.58 20.27 Favored 'General case' 0 C--O 1.179 -2.647 0 N-CA-C 112.417 0.525 . . . . 56.72 112.417 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.489 ' HE3' ' O ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -150.99 151.03 31.49 Favored 'General case' 0 C--O 1.176 -2.771 0 N-CA-C 105.403 -2.073 . . . . 65.36 105.403 -164.283 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.45 ' HE1' HD21 ' A' ' 28' ' ' LEU . 10.5 m-85 -123.47 140.8 52.64 Favored 'General case' 0 C--O 1.162 -3.514 0 C-N-CA 124.958 1.303 . . . . 54.9 113.743 174.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 55.9 p -139.46 165.38 27.38 Favored 'General case' 0 CA--C 1.484 -1.586 0 O-C-N 120.193 -1.567 . . . . 55.17 107.856 174.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.713 HD22 ' H ' ' A' ' 94' ' ' ASN . 0.2 OUTLIER -162.78 120.57 1.29 Allowed Pre-proline 0 N--CA 1.43 -1.461 0 CA-C-N 112.216 -2.266 . . . . 54.31 105.715 -176.595 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -64.06 -21.92 68.0 Favored 'Trans proline' 0 CA--C 1.56 1.802 0 O-C-N 123.696 1.366 . . . . 59.36 111.526 -172.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.713 ' H ' HD22 ' A' ' 92' ' ' ASN . 31.6 m120 -94.04 18.01 11.41 Favored 'General case' 0 C--O 1.153 -3.996 0 N-CA-C 115.497 1.666 . . . . 59.09 115.497 178.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.424 HG11 ' HG2' ' B' ' 38' ' ' MET . 77.1 t -126.68 103.86 11.86 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.895 0 N-CA-C 103.786 -2.672 . . . . 64.69 103.786 179.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . . . -91.61 151.1 20.85 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 118.152 -1.419 . . . . 69.81 110.472 -166.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.432 ' HA ' ' HB ' ' B' ' 32' ' ' THR . . . -76.71 12.08 1.44 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.603 0.761 . . . . 77.85 111.978 -174.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.432 0 C-N-CA 125.826 1.651 . . . . 78.61 113.856 171.768 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.336 0 CA-C-O 118.504 -0.76 . . . . 53.13 109.362 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 23.2 mm -104.59 140.62 22.1 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.871 0 CA-C-O 118.703 -0.665 . . . . 59.69 112.28 165.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 70.5 p -130.03 171.21 13.04 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 114.209 1.189 . . . . 52.23 114.209 173.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 7.5 mp -126.09 143.66 51.03 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-O 117.92 -1.038 . . . . 56.19 108.489 174.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 77.7 p -70.57 159.96 33.37 Favored 'General case' 0 CA--C 1.587 2.399 0 CA-C-N 119.407 1.003 . . . . 56.52 112.887 170.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -49.79 -47.88 50.94 Favored 'General case' 0 N--CA 1.537 3.892 0 N-CA-C 115.105 1.52 . . . . 70.28 115.105 171.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.2 p -58.71 -42.33 88.42 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 115.506 -2.478 . . . . 67.43 116.559 172.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.78 -42.07 74.28 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 117.304 -1.758 . . . . 58.74 113.448 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.59 -40.9 63.14 Favored 'General case' 0 C--O 1.191 -2.023 0 CA-C-N 114.897 -1.047 . . . . 62.66 112.849 171.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.08 -42.63 65.97 Favored 'General case' 0 N--CA 1.502 2.157 0 N-CA-C 106.671 -1.603 . . . . 64.87 106.671 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ARG . . . . . 0.511 ' NH2' ' CE1' ' B' ' 16' ' ' PHE . 0.0 OUTLIER -64.22 -42.99 96.35 Favored 'General case' 0 C--N 1.384 2.1 0 CA-C-O 121.949 0.88 . . . . 77.44 109.211 -178.734 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 19.3 t -77.95 -31.3 16.75 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-O 121.401 0.619 . . . . 62.17 109.794 -171.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 -61.73 -45.48 93.77 Favored 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 122.055 0.931 . . . . 65.68 110.848 174.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' THR . . . . . 0.415 ' O ' ' C ' ' B' ' 16' ' ' PHE . 84.8 m -52.75 -53.85 42.12 Favored 'General case' 0 C--O 1.201 -1.474 0 CA-C-N 114.555 -1.202 . . . . 71.66 112.555 164.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' PHE . . . . . 0.511 ' CE1' ' NH2' ' B' ' 12' ' ' ARG . 22.6 m-85 -61.35 -18.51 59.03 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 115.234 -2.586 . . . . 71.0 107.532 -169.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 mt -82.75 -56.44 3.84 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-N 114.666 -1.152 . . . . 73.99 113.681 -166.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ALA . . . . . 0.805 ' O ' ' N ' ' B' ' 20' ' ' ARG . . . -32.32 -98.31 0.0 OUTLIER 'General case' 0 CA--C 1.585 2.307 0 O-C-N 125.561 1.788 . . . . 77.26 108.369 149.251 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ASN . . . . . 0.424 ' C ' ' O ' ' B' ' 18' ' ' ALA . 1.3 m120 -23.61 -19.18 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 119.879 3.289 . . . . 81.11 119.879 -178.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.805 ' N ' ' O ' ' B' ' 18' ' ' ALA . 8.5 ptm180 -117.04 -3.53 11.56 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-N 122.281 2.31 . . . . 80.06 111.343 177.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . 16.72 37.65 0.0 OUTLIER Glycine 0 C--N 1.353 1.514 0 C-N-CA 129.007 3.194 . . . . 80.48 120.09 -169.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . . . -114.58 -50.7 2.78 Favored 'General case' 0 N--CA 1.509 2.523 0 N-CA-C 113.771 1.026 . . . . 80.65 113.771 -164.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -100.23 178.63 29.31 Favored Glycine 0 CA--C 1.573 3.705 1 N-CA-C 126.496 5.359 . . . . 76.42 126.496 -172.212 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PHE . . . . . 0.715 ' HB2' ' O ' ' B' ' 46' ' ' ASP . 69.3 t80 -79.77 -40.13 29.43 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 112.141 -2.029 . . . . 68.57 113.596 -178.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 167.2 -156.36 28.1 Favored Glycine 0 C--O 1.257 1.534 0 O-C-N 120.277 -1.514 . . . . 63.59 109.577 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 32.8 mt -99.22 138.72 35.91 Favored 'General case' 0 C--O 1.187 -2.191 0 CA-C-O 118.089 -0.958 . . . . 65.33 108.788 -176.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -93.27 131.89 37.96 Favored 'General case' 0 CA--C 1.562 1.414 0 N-CA-C 115.886 1.81 . . . . 52.59 115.886 155.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 32.0 tp -112.23 121.69 45.63 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.847 -1.069 . . . . 53.49 109.445 172.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -137.36 -178.98 16.38 Favored Glycine 0 C--O 1.183 -3.081 0 CA-C-O 123.025 1.347 . . . . 45.76 114.074 -176.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 24.7 m -136.2 147.97 27.73 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.263 0 C-N-CA 124.2 1.0 . . . . 48.18 110.143 172.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 42.1 ptt85 -141.11 167.82 21.26 Favored 'General case' 1 N--CA 1.372 -4.341 0 CA-C-O 125.252 2.453 . . . . 55.5 109.873 174.23 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' THR . . . . . 0.432 ' HB ' ' HA ' ' A' ' 97' ' ' ASP . 0.6 OUTLIER -68.6 144.38 54.54 Favored 'General case' 1 C--O 1.151 -4.113 0 CA-C-N 112.391 -2.186 . . . . 56.55 111.631 173.021 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 46.9 t -138.24 77.14 1.61 Allowed 'General case' 0 C--O 1.245 0.834 0 C-N-CA 125.401 1.48 . . . . 57.03 111.763 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 72.64 -171.79 49.4 Favored Glycine 0 N--CA 1.474 1.227 0 CA-C-O 123.468 1.593 . . . . 60.39 111.414 -169.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 30.4 p -96.1 0.2 51.09 Favored 'General case' 0 C--N 1.307 -1.249 0 O-C-N 119.804 -1.998 . . . . 62.39 112.449 -167.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' SER . . . . . 0.56 ' CB ' ' O ' ' B' ' 118' ' ' HOH . . . -119.53 10.9 11.94 Favored 'General case' 0 C--O 1.279 2.628 0 O-C-N 125.201 1.563 . . . . 60.84 114.867 175.947 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . -167.99 -172.36 34.91 Favored Glycine 0 C--O 1.199 -2.074 0 N-CA-C 118.704 2.242 . . . . 57.67 118.704 174.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' MET . . . . . 0.424 ' HG2' HG11 ' A' ' 95' ' ' VAL . 30.9 mtp -140.7 153.44 45.95 Favored 'General case' 0 C--O 1.284 2.884 0 CA-C-O 122.146 0.974 . . . . 49.01 110.481 -171.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -126.39 151.59 47.46 Favored 'General case' 0 CA--C 1.476 -1.898 0 N-CA-C 106.824 -1.547 . . . . 45.2 106.824 177.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -70.98 147.31 48.8 Favored 'General case' 0 C--O 1.168 -3.185 0 C-N-CA 126.555 1.942 . . . . 45.92 107.333 172.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 73.7 t -117.36 136.51 54.27 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.806 0 O-C-N 119.868 -1.77 . . . . 52.39 106.374 163.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -139.86 111.54 7.3 Favored 'General case' 1 C--O 1.145 -4.425 0 N-CA-C 104.497 -2.408 . . . . 54.11 104.497 -177.004 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -144.52 171.89 13.72 Favored 'General case' 0 CA--C 1.6 2.904 0 CA-C-N 119.596 1.089 . . . . 63.63 112.055 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.28 139.72 30.75 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-O 119.6 -0.238 . . . . 57.93 110.589 167.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . 0.282 0.0 OUTLIER -124.43 145.2 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.556 0 N-CA-C 106.772 -1.566 . . . . 63.9 106.772 175.127 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASP . . . . . 0.715 ' O ' ' HB2' ' B' ' 24' ' ' PHE . 59.7 m-20 -84.21 -57.2 3.27 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.565 -1.198 . . . . 75.3 108.779 175.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -119.54 131.39 24.4 Favored Pre-proline 0 CA--C 1.566 1.577 0 N-CA-C 114.6 1.333 . . . . 79.4 114.6 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' PRO . . . . . 0.538 ' HD3' ' CD2' ' B' ' 24' ' ' PHE . 14.1 Cg_endo -58.51 162.39 12.56 Favored 'Trans proline' 0 CA--C 1.481 -2.175 0 C-N-CA 121.869 1.713 . . . . 70.63 112.438 168.391 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' THR . . . . . 0.684 ' HB ' ' HD2' ' B' ' 50' ' ' PRO . 3.9 p -108.4 166.99 9.89 Favored Pre-proline 0 CA--C 1.481 -1.706 0 C-N-CA 119.759 -0.776 . . . . 64.09 111.096 165.171 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' PRO . . . . . 0.684 ' HD2' ' HB ' ' B' ' 49' ' ' THR . 17.7 Cg_endo -60.98 -12.19 21.49 Favored 'Trans proline' 0 CA--C 1.562 1.883 0 O-C-N 124.311 1.69 . . . . 61.14 114.881 168.512 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 25.9 mp0 -85.69 -5.95 59.2 Favored 'General case' 0 N--CA 1.499 1.975 0 C-N-CA 120.31 -0.556 . . . . 74.56 112.172 175.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -97.77 160.37 14.35 Favored 'General case' 0 C--O 1.175 -2.854 0 CA-C-O 122.025 0.916 . . . . 57.2 111.732 -169.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mm -118.5 123.09 71.01 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.267 0 N-CA-C 105.492 -2.04 . . . . 50.34 105.492 169.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 81.0 t -106.55 121.85 59.71 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.491 0 N-CA-C 108.345 -0.983 . . . . 43.36 108.345 -172.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -103.59 154.87 19.02 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 106.933 -1.506 . . . . 48.67 106.933 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -133.71 126.47 30.82 Favored 'General case' 0 C--O 1.187 -2.185 0 O-C-N 120.574 -1.329 . . . . 64.98 113.08 170.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -142.16 128.0 19.37 Favored 'General case' 0 C--O 1.252 1.193 0 N-CA-C 100.63 -3.841 . . . . 62.1 100.63 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.566 ' HE2' ' O ' ' B' ' 120' ' ' HOH . 23.4 mttt 46.35 44.14 12.35 Favored 'General case' 0 C--O 1.187 -2.186 0 CA-C-N 113.919 -1.492 . . . . 60.0 112.471 178.906 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.76 -0.89 89.16 Favored Glycine 0 CA--C 1.497 -1.074 0 N-CA-C 117.973 1.949 . . . . 57.31 117.973 171.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . 0.404 0.2 OUTLIER -113.85 125.3 71.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.865 0 N-CA-C 108.155 -1.054 . . . . 61.1 108.155 176.781 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -76.22 125.83 29.89 Favored 'General case' 0 N--CA 1.383 -3.823 0 CA-C-N 113.617 -1.629 . . . . 64.64 107.77 174.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 86.8 t -111.21 124.32 67.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 N-CA-C 105.861 -1.903 . . . . 51.61 105.861 177.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 84.8 t -102.02 127.7 55.27 Favored 'Isoleucine or valine' 1 CA--C 1.635 4.219 0 N-CA-C 106.105 -1.813 . . . . 45.63 106.105 -173.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 48.0 t -130.69 117.22 37.82 Favored 'Isoleucine or valine' 1 N--CA 1.589 6.506 0 CA-C-N 119.897 1.226 . . . . 47.93 112.915 178.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -51.41 137.33 23.9 Favored 'General case' 0 C--O 1.175 -2.831 0 O-C-N 119.491 -2.006 . . . . 64.05 110.237 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -61.71 -29.2 71.43 Favored Glycine 1 C--O 1.165 -4.217 0 C-N-CA 124.314 0.959 . . . . 52.67 111.384 -170.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -85.33 -7.17 59.11 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 121.068 -1.254 . . . . 73.83 110.305 -176.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 7.1 m -94.93 -8.56 36.71 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 115.354 1.612 . . . . 48.18 115.354 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' MET . . . . . . . . . . . . . 69.5 mmm -56.93 -36.08 69.81 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 122.213 1.006 . . . . 48.87 111.191 -176.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -60.47 -28.99 68.77 Favored 'General case' 0 C--O 1.274 2.371 0 CA-C-N 115.715 -0.675 . . . . 56.93 110.486 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -84.83 -18.64 34.25 Favored 'General case' 0 CA--C 1.588 2.434 0 N-CA-C 117.322 2.341 . . . . 45.31 117.322 176.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 65.4 mt -121.84 -27.08 4.71 Favored 'General case' 0 C--O 1.159 -3.68 0 CA-C-N 114.696 -1.138 . . . . 47.12 112.713 -155.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -57.6 137.65 56.13 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 115.007 1.484 . . . . 57.27 115.007 -171.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . 76.95 -0.57 65.92 Favored Glycine 0 C--O 1.176 -3.524 0 C-N-CA 126.365 1.936 . . . . 46.9 112.622 -166.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 6.3 m -66.37 136.21 55.44 Favored 'General case' 0 C--O 1.18 -2.584 0 O-C-N 120.123 -1.81 . . . . 47.57 113.133 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -107.08 125.43 51.04 Favored 'General case' 0 N--CA 1.397 -3.086 0 CA-C-N 116.324 -0.398 . . . . 58.11 111.989 167.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 18.6 tp -83.38 133.15 34.95 Favored 'General case' 0 CA--C 1.479 -1.783 0 CA-C-O 122.99 1.376 . . . . 52.13 107.936 171.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ASP . . . . . 0.546 ' OD2' ' O ' ' B' ' 121' ' ' HOH . 0.5 OUTLIER -136.46 168.07 20.16 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 114.569 -1.196 . . . . 64.93 107.918 -162.708 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -152.53 137.3 17.03 Favored 'General case' 1 C--O 1.151 -4.125 0 C-N-CA 119.663 -0.815 . . . . 59.36 112.548 -178.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' VAL . . . . . . . . . . . . . 11.1 t -115.62 117.77 56.66 Favored 'Isoleucine or valine' 0 C--O 1.259 1.568 0 N-CA-C 101.598 -3.482 . . . . 62.23 101.598 -173.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . . . -72.47 -32.04 65.91 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 125.128 1.518 . . . . 60.54 113.934 -173.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -134.47 160.15 38.91 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 117.071 2.248 . . . . 80.0 117.071 -164.025 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 84.81 177.77 51.09 Favored Glycine 0 CA--C 1.553 2.435 0 C-N-CA 118.667 -1.73 . . . . 59.99 114.621 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -23.55 65.17 Favored 'General case' 0 CA--C 1.558 1.276 0 N-CA-C 114.313 1.227 . . . . 61.36 114.313 -173.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.522 ' O ' ' C ' ' B' ' 86' ' ' GLU . 70.7 m-20 -90.88 16.14 9.98 Favored 'General case' 0 C--O 1.19 -2.048 0 N-CA-C 116.48 2.03 . . . . 70.28 116.48 170.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.522 ' C ' ' O ' ' B' ' 85' ' ' ASN . 24.9 tt0 -44.49 132.48 6.12 Favored 'General case' 1 C--O 1.152 -4.042 0 C-N-CA 116.007 -2.277 . . . . 56.88 110.952 177.119 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . 150.58 -175.79 29.45 Favored Glycine 0 C--O 1.201 -1.955 0 N-CA-C 111.353 -0.699 . . . . 47.19 111.353 168.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -70.78 148.73 47.61 Favored 'General case' 0 C--O 1.172 -2.977 0 CA-C-N 116.994 0.397 . . . . 58.26 111.493 170.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.37 159.11 43.8 Favored 'General case' 0 N--CA 1.417 -2.117 0 CA-C-N 115.988 -0.551 . . . . 70.49 112.038 173.88 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' PHE . . . . . 0.459 ' CD2' ' N ' ' B' ' 90' ' ' PHE . 4.4 m-85 -119.24 135.53 54.64 Favored 'General case' 0 C--O 1.155 -3.892 0 N-CA-C 108.218 -1.03 . . . . 56.59 108.218 -171.684 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 98.4 m -117.95 102.72 9.29 Favored 'General case' 0 N--CA 1.419 -2.006 0 N-CA-C 104.72 -2.326 . . . . 52.39 104.72 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.844 HD21 HD22 ' B' ' 94' ' ' ASN . 0.3 OUTLIER -123.2 108.84 31.78 Favored Pre-proline 0 C--O 1.185 -2.319 0 CA-C-N 113.906 -1.497 . . . . 46.49 109.797 -164.753 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -64.34 -18.78 64.38 Favored 'Trans proline' 0 CA--C 1.576 2.596 0 C-N-CA 123.48 2.787 . . . . 49.74 117.191 -176.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ASN . . . . . 0.844 HD22 HD21 ' B' ' 92' ' ' ASN . 68.9 m-80 -78.09 -16.19 58.22 Favored 'General case' 0 C--O 1.181 -2.51 0 C-N-CA 127.916 2.486 . . . . 48.29 112.62 178.258 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 52.8 t -115.72 135.91 54.29 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 C-N-CA 127.352 2.261 . . . . 50.4 108.727 -171.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -92.68 145.91 24.06 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 119.582 1.083 . . . . 68.28 108.314 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.96 121.25 22.43 Favored 'General case' 0 C--O 1.171 -3.027 0 N-CA-C 116.278 1.955 . . . . 70.49 116.278 173.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.532 3.628 0 CA-C-O 124.897 2.284 . . . . 76.64 111.729 142.172 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . 1.016 ' O ' ' HG2' ' A' ' 69' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . 0.788 ' O ' ' CB ' ' A' ' 82' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.873 ' O ' HG21 ' A' ' 15' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.45 ' O ' ' ND2' ' A' ' 85' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . 0.56 ' O ' ' CB ' ' B' ' 36' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HOH . . . . . 0.566 ' O ' ' HE2' ' B' ' 58' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HOH . . . . . 0.546 ' O ' ' OD2' ' B' ' 78' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_