data_3ebq_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 3ebq _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 ' 5' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 119.135 -0.459 . . . . 71.84 111.117 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.0 mt -110.0 138.87 45.77 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 123.853 0.721 . . . . 59.2 112.811 176.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -125.87 128.78 24.48 Favored Pre-proline 0 CA--C 1.534 0.344 0 O-C-N 123.685 0.616 . . . . 55.41 110.129 -176.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.75 138.14 44.09 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 C-N-CA 122.0 1.8 . . . . 45.38 111.419 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.2 t -114.22 127.4 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 124.834 1.334 . . . . 37.77 109.973 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -120.37 149.27 42.62 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 121.023 0.439 . . . . 44.48 110.941 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 28.8 tp -105.91 113.04 26.34 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 106.547 -1.649 . . . . 33.25 106.547 169.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -81.07 126.32 31.29 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 109.565 -0.531 . . . . 40.15 109.565 170.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.5 t -117.15 126.39 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 115.856 -0.611 . . . . 36.09 109.812 -173.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -125.13 135.2 52.42 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.802 0.689 . . . . 40.21 110.655 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -88.83 103.66 16.19 Favored 'General case' 0 C--O 1.253 1.238 0 O-C-N 124.335 1.022 . . . . 38.9 109.97 169.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.7 mt -58.76 -25.26 62.87 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 121.076 0.465 . . . . 44.38 112.075 -176.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.7 p -86.45 -4.95 59.26 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 114.255 1.206 . . . . 46.47 114.255 -177.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.1 mmtt 51.19 44.21 28.85 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-O 120.935 0.397 . . . . 64.14 111.689 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.35 -6.95 82.5 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 115.851 1.1 . . . . 51.66 115.851 178.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.3 mt -68.46 -37.11 79.89 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.963 1.097 . . . . 58.42 113.963 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.39 -46.32 83.57 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.271 0.558 . . . . 46.2 110.418 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.7 ttp-105 -56.76 -44.46 81.78 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.757 -0.656 . . . . 80.64 111.645 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.7 ttp-105 -75.25 -47.27 28.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.966 -1.015 . . . . 84.3 112.636 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.1 mt -97.94 -13.96 20.89 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 116.105 1.891 . . . . 75.69 116.105 -167.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.0 p -57.0 -45.03 100.0 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.71 1.374 . . . . 60.89 114.71 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.24 -42.91 61.62 Favored 'Trans proline' 0 CA--C 1.553 1.457 0 C-N-CA 117.265 -1.357 . . . . 55.84 115.169 176.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.3 tp -78.08 -38.4 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 119.82 -0.752 . . . . 67.6 112.163 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.4 mtp -72.86 -44.03 61.86 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.3 -0.56 . . . . 76.4 110.932 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 72.3 mt -115.52 -15.02 11.5 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 115.338 1.607 . . . . 62.65 115.338 -165.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 77.52 18.74 77.32 Favored Glycine 0 N--CA 1.478 1.491 0 N-CA-C 114.408 0.523 . . . . 62.4 114.408 -177.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . . . -159.39 148.96 18.52 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.549 0.74 . . . . 61.21 110.653 -169.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -91.03 110.78 22.05 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-O 121.493 0.663 . . . . 59.84 111.809 -175.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.5 mt -110.07 149.89 29.36 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.57 -1.27 . . . . 63.27 107.57 170.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -97.09 -23.76 16.09 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.698 0.624 . . . . 62.98 112.322 -175.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -168.99 164.27 37.93 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.596 -0.812 . . . . 50.45 112.34 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 36.9 mm -104.09 96.06 4.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 105.349 -2.093 . . . . 47.68 105.349 172.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -84.85 117.78 24.09 Favored 'General case' 0 C--O 1.255 1.347 0 N-CA-C 112.906 0.706 . . . . 45.34 112.906 -160.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HIS . . . . . 0.556 ' ND1' ' SG ' ' A' ' 108' ' ' CYS . 26.9 t60 -106.94 137.72 44.47 Favored 'General case' 0 C--O 1.243 0.737 0 O-C-N 124.101 0.876 . . . . 40.23 110.517 162.481 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 71.2 p -130.91 165.39 23.18 Favored 'General case' 0 C--O 1.252 1.196 0 N-CA-C 113.36 0.874 . . . . 33.97 113.36 178.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 80.8 p -150.93 161.67 42.26 Favored 'General case' 0 C--O 1.245 0.829 0 N-CA-C 105.259 -2.126 . . . . 34.11 105.259 178.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 11.5 mm -104.84 129.85 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 109.467 -0.568 . . . . 35.11 109.467 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 55.8 t -110.74 118.54 57.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.504 0 N-CA-C 107.073 -1.455 . . . . 37.73 107.073 175.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.1 p -156.9 149.2 10.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 N-CA-C 106.346 -1.724 . . . . 39.08 106.346 -179.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 49.91 41.1 22.32 Favored 'General case' 0 C--O 1.214 -0.813 0 CA-C-O 120.915 0.388 . . . . 48.68 111.861 -178.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt 67.2 16.32 10.17 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 120.343 3.46 . . . . 59.36 120.343 174.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -136.78 156.98 47.79 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 109.689 -0.486 . . . . 55.84 109.689 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -106.25 118.9 37.84 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 124.552 1.158 . . . . 41.86 109.231 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -109.54 136.02 49.6 Favored 'General case' 0 CA--C 1.506 -0.735 0 C-N-CA 123.444 0.698 . . . . 41.99 109.812 -173.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -152.98 172.03 17.45 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.63 0.729 . . . . 48.61 111.186 -178.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -111.76 179.78 3.92 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.087 -1.449 . . . . 40.72 107.087 -173.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 163.7 -175.78 39.86 Favored Glycine 0 CA--C 1.502 -0.738 0 N-CA-C 105.009 -3.236 . . . . 42.13 105.009 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 78.6 p -72.03 -15.81 62.04 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-N 116.575 0.188 . . . . 57.15 110.792 -175.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.43 -3.47 90.52 Favored Glycine 0 C--O 1.249 1.078 0 N-CA-C 114.977 0.751 . . . . 49.75 114.977 172.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 96.12 -163.16 23.08 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 113.856 0.302 . . . . 43.74 113.856 -170.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 60.4 mt -77.26 131.99 33.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 N-CA-C 109.059 -0.719 . . . . 40.67 109.059 177.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.8 m -131.85 160.99 34.06 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-N 115.462 -0.79 . . . . 51.04 111.176 177.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.8 p -134.68 146.28 49.33 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 113.638 0.977 . . . . 52.99 113.638 167.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 15.7 m -128.17 167.77 17.68 Favored Pre-proline 0 C--O 1.245 0.845 0 N-CA-C 108.924 -0.769 . . . . 52.28 108.924 167.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -55.74 146.94 63.47 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 116.238 -2.041 . . . . 54.26 110.495 165.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -55.11 127.73 27.53 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 O-C-N 122.532 0.754 . . . . 52.77 113.461 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.48 1.58 82.52 Favored Glycine 0 CA--C 1.522 0.481 0 CA-C-N 115.568 -0.742 . . . . 59.44 112.42 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -101.46 17.78 54.72 Favored Glycine 0 C--N 1.337 0.623 0 N-CA-C 117.354 1.702 . . . . 63.41 117.354 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -76.39 177.38 7.38 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.315 1.057 . . . . 62.03 110.903 166.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -25.53 65.75 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.63 0.604 . . . . 67.58 112.63 178.183 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.6 mt -71.5 -23.87 61.88 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.05 0.94 . . . . 61.53 112.065 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 83.53 -151.6 28.19 Favored Glycine 0 N--CA 1.462 0.392 0 CA-C-N 116.336 -0.393 . . . . 59.22 113.01 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.44 141.26 50.5 Favored 'Trans proline' 0 C--O 1.249 1.038 0 C-N-CA 124.057 3.172 . . . . 59.56 112.024 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.83 157.62 61.11 Favored 'Trans proline' 0 C--N 1.348 0.521 0 O-C-N 122.957 0.977 . . . . 48.31 112.592 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -75.87 -32.28 59.65 Favored 'General case' 0 C--O 1.242 0.679 0 O-C-N 124.394 1.059 . . . . 56.87 113.293 172.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.4 t -150.03 147.82 28.29 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 106.984 -1.487 . . . . 43.28 106.984 173.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.7 t -114.79 114.06 45.47 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 105.211 -2.144 . . . . 42.46 105.211 174.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 44.5 t -105.6 135.43 43.8 Favored 'Isoleucine or valine' 0 C--O 1.263 1.788 0 N-CA-C 108.959 -0.756 . . . . 34.77 108.959 -174.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -80.95 118.61 22.58 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 123.451 0.47 . . . . 46.44 111.252 177.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.0 t -87.54 -49.77 14.34 Favored 'Isoleucine or valine' 0 C--O 1.249 1.048 0 CA-C-O 121.348 0.594 . . . . 38.63 110.924 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 159.89 -158.01 29.27 Favored Glycine 0 CA--C 1.505 -0.555 0 N-CA-C 106.998 -2.441 . . . . 47.57 106.998 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.4 m -120.12 153.09 36.65 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 107.148 -1.427 . . . . 52.73 107.148 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.6 t -130.26 147.41 51.98 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 124.335 1.022 . . . . 45.35 110.553 -179.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -81.64 -16.79 50.31 Favored 'General case' 0 C--O 1.216 -0.71 0 C-N-CA 124.736 1.214 . . . . 72.69 111.984 169.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.6 t -67.74 121.4 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 112.017 0.377 . . . . 43.77 112.017 -173.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 55.5 p -77.32 163.93 26.01 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 123.197 0.599 . . . . 54.2 110.091 -176.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -54.96 -44.55 74.46 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 111.891 0.33 . . . . 71.63 111.891 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -63.39 -41.79 98.77 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 119.133 -1.027 . . . . 68.65 113.736 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.8 mm -70.35 -42.99 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-O 121.231 0.539 . . . . 57.53 111.142 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -56.92 -41.14 77.61 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.221 0.823 . . . . 42.17 113.221 175.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 77.4 mt -68.75 -35.38 77.02 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 119.627 -0.829 . . . . 47.85 112.175 178.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -62.38 -40.92 98.02 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.985 0.897 . . . . 57.93 110.685 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -64.38 -48.14 76.59 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-N 115.531 -0.758 . . . . 35.58 109.331 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 31.4 mt -61.78 -37.1 83.08 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.448 -0.901 . . . . 35.53 112.971 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.4 t -60.9 -43.82 97.99 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 116.187 -0.46 . . . . 46.52 110.297 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.5 t -58.3 -48.29 80.98 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.209 0.528 . . . . 34.73 110.885 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.8 mt -55.75 -45.84 77.98 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 116.378 -0.373 . . . . 32.48 111.208 178.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -72.72 -14.47 78.01 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 115.373 0.909 . . . . 39.26 115.373 -171.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -97.12 -5.48 37.21 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.13 -0.693 . . . . 56.81 109.13 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 82.8 p -127.07 -75.46 0.58 Allowed 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 113.584 0.957 . . . . 35.47 113.584 -170.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 89.8 mt -103.61 -10.15 18.65 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.24 -0.912 . . . . 35.31 111.889 -175.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -126.22 39.71 3.88 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 122.961 1.362 . . . . 36.21 112.776 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 81.2 mtt-85 -64.7 146.64 54.46 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.589 -1.641 . . . . 68.58 106.937 160.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -54.72 -34.0 55.98 Favored Glycine 0 N--CA 1.477 1.373 0 C-N-CA 120.884 -0.675 . . . . 41.72 112.85 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -58.74 -28.14 65.6 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.154 1.168 . . . . 69.53 114.154 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -80.05 -6.6 57.92 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 115.314 1.598 . . . . 41.02 115.314 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -59.99 128.1 35.19 Favored 'General case' 0 C--O 1.253 1.285 0 N-CA-C 107.996 -1.113 . . . . 44.45 107.996 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -140.56 126.78 19.76 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.982 -1.118 . . . . 52.68 107.982 172.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 59.8 tp -57.75 -38.68 75.79 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.407 -0.517 . . . . 43.53 111.489 -169.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -90.43 -34.13 15.74 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 115.739 1.755 . . . . 52.19 115.739 -177.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 -112.48 -22.24 10.92 Favored 'General case' 0 C--O 1.258 1.551 0 N-CA-C 114.89 1.441 . . . . 61.47 114.89 -164.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -151.85 75.8 1.16 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.443 -0.947 . . . . 39.3 108.443 -175.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -117.66 -169.25 1.64 Allowed 'General case' 0 C--O 1.242 0.665 0 O-C-N 123.83 0.707 . . . . 33.53 111.406 -167.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' CYS . . . . . 0.556 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 8.3 m -58.03 -34.57 70.19 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 113.133 0.79 . . . . 33.05 113.133 179.435 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -73.76 -35.58 65.01 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 119.633 -0.827 . . . . 31.75 111.838 177.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 11.5 m -52.6 -49.47 64.98 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 108.942 -0.762 . . . . 32.62 108.942 169.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -58.25 -53.57 56.81 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.035 0.383 . . . . 32.98 112.035 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 58.0 m -60.62 -43.06 97.92 Favored 'General case' 0 CA--C 1.509 -0.634 0 C-N-CA 120.498 -0.481 . . . . 34.26 109.786 -174.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -57.49 -49.32 76.68 Favored 'General case' 0 CA--C 1.555 1.139 0 N-CA-C 112.95 0.722 . . . . 32.75 112.95 177.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . 0.491 ' CG ' ' O ' ' A' ' 257' ' ' HOH . 37.5 mt-10 -62.48 -43.82 97.89 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 119.101 -1.039 . . . . 35.84 112.493 -178.154 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 74.4 t -63.1 -46.9 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 122.139 0.175 . . . . 31.84 110.594 175.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -49.89 -47.59 51.98 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.091 0.775 . . . . 32.43 113.091 172.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -62.52 -43.04 99.8 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.268 -0.424 . . . . 42.53 111.229 -179.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -63.46 -47.17 82.93 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.917 -0.771 . . . . 37.33 108.917 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 82.3 mt -75.12 -36.25 61.64 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.519 1.303 . . . . 39.39 114.519 -173.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.7 p -131.07 -8.2 3.87 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.805 1.039 . . . . 38.94 113.805 -168.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 75.37 3.54 71.24 Favored Glycine 0 N--CA 1.428 -1.877 0 CA-C-O 118.914 -0.937 . . . . 38.91 113.627 -174.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -105.06 145.27 30.72 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 118.798 1.299 . . . . 50.92 112.472 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -84.81 160.6 20.19 Favored 'General case' 0 C--O 1.25 1.08 0 O-C-N 124.084 0.865 . . . . 46.91 111.689 167.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 17.4 pt -84.48 159.54 58.46 Favored Pre-proline 0 CA--C 1.553 1.074 0 N-CA-C 106.77 -1.567 . . . . 32.81 106.77 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.2 140.01 92.89 Favored 'Trans proline' 0 C--O 1.254 1.286 0 N-CA-C 115.142 1.17 . . . . 33.0 115.142 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 98.8 p -61.18 -25.84 67.3 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.097 -0.956 . . . . 36.06 112.352 -178.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -66.27 -24.95 66.66 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 117.593 -1.643 . . . . 35.2 109.563 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 85.7 mt -77.79 -53.66 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 O-C-N 123.091 0.244 . . . . 36.82 111.468 170.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 31.2 p -66.55 -28.95 68.93 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.939 0.718 . . . . 40.25 112.939 -175.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASP . . . . . 0.617 ' OD1' ' O ' ' A' ' 249' ' ' HOH . 93.9 m-20 -82.72 -6.6 59.47 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 115.122 1.527 . . . . 54.45 115.122 -179.214 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 59.5 tp -53.78 -52.51 66.89 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 113.442 0.904 . . . . 66.79 113.442 -175.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_exo -54.14 -40.42 81.93 Favored 'Trans proline' 0 C--O 1.243 0.755 0 C-N-CA 118.083 -0.811 . . . . 53.41 112.739 -178.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 89.4 p -64.88 -38.92 92.58 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 120.193 -0.603 . . . . 53.77 112.361 178.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.3 -43.93 92.58 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 120.994 0.426 . . . . 73.19 111.256 175.935 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 76.6 t -65.26 -43.92 95.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 CA-C-N 115.848 -0.614 . . . . 51.98 109.348 -179.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 20.4 mt -67.17 -30.3 70.23 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 113.307 0.854 . . . . 65.09 113.307 -174.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 88.4 p -70.47 16.02 0.09 Allowed 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 113.268 0.84 . . . . 58.44 113.268 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 32.5 p -125.0 153.35 71.21 Favored Pre-proline 0 C--O 1.241 0.628 0 O-C-N 121.062 -1.023 . . . . 51.74 110.178 -177.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.93 -42.87 37.15 Favored 'Trans proline' 0 C--N 1.356 0.955 0 O-C-N 122.904 0.949 . . . . 61.06 113.676 172.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -56.75 -57.12 13.81 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.101 0.961 . . . . 70.15 110.854 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.61 -40.25 78.15 Favored Glycine 0 N--CA 1.471 0.973 0 O-C-N 123.482 0.489 . . . . 57.51 112.792 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -72.06 -33.12 67.69 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.682 0.623 . . . . 74.87 112.682 -179.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -76.78 -32.92 58.0 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 112.671 0.619 . . . . 71.89 112.671 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 9.7 mt -97.48 -1.55 43.9 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.617 0.969 . . . . 72.28 113.617 -177.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . . . -52.72 -50.54 80.38 Favored Pre-proline 0 CA--C 1.545 0.771 0 N-CA-C 115.031 1.493 . . . . 83.07 115.031 178.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -67.46 -34.96 24.78 Favored 'Trans proline' 0 CA--C 1.557 1.633 0 C-N-CA 117.238 -1.374 . . . . 101.55 110.63 -171.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 24.0 tp -50.17 -47.51 54.41 Favored 'General case' 0 N--CA 1.402 -2.848 1 CA-C-O 128.919 4.2 . . . . 111.34 113.097 173.828 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 1 C--O 1.405 9.239 2 O-C-N 114.948 -4.845 . . . . 130.42 123.554 163.593 . . . . . . . . 2 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' HG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' HG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HOH . . . . . 0.617 ' O ' ' OD1' ' A' ' 130' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . 0.491 ' O ' ' CG ' ' A' ' 114' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 119.135 -0.459 . . . . 71.84 111.117 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.0 mt -110.0 138.87 45.77 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 123.853 0.721 . . . . 59.2 112.811 176.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -125.87 128.78 24.48 Favored Pre-proline 0 CA--C 1.534 0.344 0 O-C-N 123.685 0.616 . . . . 55.41 110.129 -176.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.75 138.14 44.09 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 C-N-CA 122.0 1.8 . . . . 45.38 111.419 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.2 t -114.22 127.4 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 124.834 1.334 . . . . 37.77 109.973 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -120.37 149.27 42.62 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 121.023 0.439 . . . . 44.48 110.941 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 28.8 tp -105.91 113.04 26.34 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 106.547 -1.649 . . . . 33.25 106.547 169.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -81.07 126.32 31.29 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 109.565 -0.531 . . . . 40.15 109.565 170.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.5 t -117.15 126.39 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 115.856 -0.611 . . . . 36.09 109.812 -173.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -125.13 135.2 52.42 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.802 0.689 . . . . 40.21 110.655 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -88.83 103.66 16.19 Favored 'General case' 0 C--O 1.253 1.238 0 O-C-N 124.335 1.022 . . . . 38.9 109.97 169.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.7 mt -58.76 -25.26 62.87 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 121.076 0.465 . . . . 44.38 112.075 -176.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.7 p -86.45 -4.95 59.26 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 114.255 1.206 . . . . 46.47 114.255 -177.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.1 mmtt 51.19 44.21 28.85 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-O 120.935 0.397 . . . . 64.14 111.689 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.35 -6.95 82.5 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 115.851 1.1 . . . . 51.66 115.851 178.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . 0.471 HD23 ' NH2' ' A' ' 23' ' ' ARG . 31.3 mt -68.46 -37.11 79.89 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.963 1.097 . . . . 58.42 113.963 -178.464 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.39 -46.32 83.57 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.271 0.558 . . . . 46.2 110.418 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.7 ttp-105 -56.76 -44.46 81.78 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.757 -0.656 . . . . 80.64 111.645 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . 0.471 ' NH2' HD23 ' A' ' 20' ' ' LEU . 13.7 ttp-105 -75.25 -47.27 28.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.966 -1.015 . . . . 84.3 112.636 -179.773 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.1 mt -97.94 -13.96 20.89 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 116.105 1.891 . . . . 75.69 116.105 -167.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.0 p -57.0 -45.03 100.0 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.71 1.374 . . . . 60.89 114.71 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.24 -42.91 61.62 Favored 'Trans proline' 0 CA--C 1.553 1.457 0 C-N-CA 117.265 -1.357 . . . . 55.84 115.169 176.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.3 tp -78.08 -38.4 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 119.82 -0.752 . . . . 67.6 112.163 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.4 mtp -72.86 -44.03 61.86 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.3 -0.56 . . . . 76.4 110.932 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 72.3 mt -115.52 -15.02 11.5 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 115.338 1.607 . . . . 62.65 115.338 -165.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 77.52 18.74 77.32 Favored Glycine 0 N--CA 1.478 1.491 0 N-CA-C 114.408 0.523 . . . . 62.4 114.408 -177.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . . . -159.39 148.96 18.52 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.549 0.74 . . . . 61.21 110.653 -169.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -91.03 110.78 22.05 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-O 121.493 0.663 . . . . 59.84 111.809 -175.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.5 mt -110.07 149.89 29.36 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.57 -1.27 . . . . 63.27 107.57 170.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -97.09 -23.76 16.09 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.698 0.624 . . . . 62.98 112.322 -175.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -168.99 164.27 37.93 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.596 -0.812 . . . . 50.45 112.34 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 36.9 mm -104.09 96.06 4.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 105.349 -2.093 . . . . 47.68 105.349 172.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -84.85 117.78 24.09 Favored 'General case' 0 C--O 1.255 1.347 0 N-CA-C 112.906 0.706 . . . . 45.34 112.906 -160.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HIS . . . . . 0.447 ' ND1' ' SG ' ' A' ' 108' ' ' CYS . 26.9 t60 -106.94 137.72 44.47 Favored 'General case' 0 C--O 1.243 0.737 0 O-C-N 124.101 0.876 . . . . 40.23 110.517 162.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 71.2 p -130.91 165.39 23.18 Favored 'General case' 0 C--O 1.252 1.196 0 N-CA-C 113.36 0.874 . . . . 33.97 113.36 178.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 80.8 p -150.93 161.67 42.26 Favored 'General case' 0 C--O 1.245 0.829 0 N-CA-C 105.259 -2.126 . . . . 34.11 105.259 178.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 11.5 mm -104.84 129.85 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 109.467 -0.568 . . . . 35.11 109.467 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 55.8 t -110.74 118.54 57.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.504 0 N-CA-C 107.073 -1.455 . . . . 37.73 107.073 175.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.1 p -156.9 149.2 10.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 N-CA-C 106.346 -1.724 . . . . 39.08 106.346 -179.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 49.91 41.1 22.32 Favored 'General case' 0 C--O 1.214 -0.813 0 CA-C-O 120.915 0.388 . . . . 48.68 111.861 -178.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt 67.2 16.32 10.17 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 120.343 3.46 . . . . 59.36 120.343 174.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -136.78 156.98 47.79 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 109.689 -0.486 . . . . 55.84 109.689 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -106.25 118.9 37.84 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 124.552 1.158 . . . . 41.86 109.231 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -109.54 136.02 49.6 Favored 'General case' 0 CA--C 1.506 -0.735 0 C-N-CA 123.444 0.698 . . . . 41.99 109.812 -173.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -152.98 172.03 17.45 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.63 0.729 . . . . 48.61 111.186 -178.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -111.76 179.78 3.92 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.087 -1.449 . . . . 40.72 107.087 -173.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 163.7 -175.78 39.86 Favored Glycine 0 CA--C 1.502 -0.738 0 N-CA-C 105.009 -3.236 . . . . 42.13 105.009 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 78.6 p -72.03 -15.81 62.04 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-N 116.575 0.188 . . . . 57.15 110.792 -175.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.43 -3.47 90.52 Favored Glycine 0 C--O 1.249 1.078 0 N-CA-C 114.977 0.751 . . . . 49.75 114.977 172.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 96.12 -163.16 23.08 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 113.856 0.302 . . . . 43.74 113.856 -170.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 60.4 mt -77.26 131.99 33.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 N-CA-C 109.059 -0.719 . . . . 40.67 109.059 177.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.8 m -131.85 160.99 34.06 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-N 115.462 -0.79 . . . . 51.04 111.176 177.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.8 p -134.68 146.28 49.33 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 113.638 0.977 . . . . 52.99 113.638 167.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' CYS . . . . . 0.417 ' SG ' HG22 ' A' ' 63' ' ' THR . 15.7 m -128.17 167.77 17.68 Favored Pre-proline 0 C--O 1.245 0.845 0 N-CA-C 108.924 -0.769 . . . . 52.28 108.924 167.556 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -55.74 146.94 63.47 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 116.238 -2.041 . . . . 54.26 110.495 165.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -55.11 127.73 27.53 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 O-C-N 122.532 0.754 . . . . 52.77 113.461 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.48 1.58 82.52 Favored Glycine 0 CA--C 1.522 0.481 0 CA-C-N 115.568 -0.742 . . . . 59.44 112.42 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -101.46 17.78 54.72 Favored Glycine 0 C--N 1.337 0.623 0 N-CA-C 117.354 1.702 . . . . 63.41 117.354 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' THR . . . . . 0.417 HG22 ' SG ' ' A' ' 58' ' ' CYS . 4.6 p -76.39 177.38 7.38 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.315 1.057 . . . . 62.03 110.903 166.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -25.53 65.75 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.63 0.604 . . . . 67.58 112.63 178.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.6 mt -71.5 -23.87 61.88 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.05 0.94 . . . . 61.53 112.065 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 83.53 -151.6 28.19 Favored Glycine 0 N--CA 1.462 0.392 0 CA-C-N 116.336 -0.393 . . . . 59.22 113.01 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.44 141.26 50.5 Favored 'Trans proline' 0 C--O 1.249 1.038 0 C-N-CA 124.057 3.172 . . . . 59.56 112.024 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.83 157.62 61.11 Favored 'Trans proline' 0 C--N 1.348 0.521 0 O-C-N 122.957 0.977 . . . . 48.31 112.592 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -75.87 -32.28 59.65 Favored 'General case' 0 C--O 1.242 0.679 0 O-C-N 124.394 1.059 . . . . 56.87 113.293 172.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.4 t -150.03 147.82 28.29 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 106.984 -1.487 . . . . 43.28 106.984 173.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.7 t -114.79 114.06 45.47 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 105.211 -2.144 . . . . 42.46 105.211 174.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 44.5 t -105.6 135.43 43.8 Favored 'Isoleucine or valine' 0 C--O 1.263 1.788 0 N-CA-C 108.959 -0.756 . . . . 34.77 108.959 -174.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -80.95 118.61 22.58 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 123.451 0.47 . . . . 46.44 111.252 177.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.0 t -87.54 -49.77 14.34 Favored 'Isoleucine or valine' 0 C--O 1.249 1.048 0 CA-C-O 121.348 0.594 . . . . 38.63 110.924 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 159.89 -158.01 29.27 Favored Glycine 0 CA--C 1.505 -0.555 0 N-CA-C 106.998 -2.441 . . . . 47.57 106.998 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.4 m -120.12 153.09 36.65 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 107.148 -1.427 . . . . 52.73 107.148 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.6 t -130.26 147.41 51.98 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 124.335 1.022 . . . . 45.35 110.553 -179.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -81.64 -16.79 50.31 Favored 'General case' 0 C--O 1.216 -0.71 0 C-N-CA 124.736 1.214 . . . . 72.69 111.984 169.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.6 t -67.74 121.4 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 112.017 0.377 . . . . 43.77 112.017 -173.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 55.5 p -77.32 163.93 26.01 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 123.197 0.599 . . . . 54.2 110.091 -176.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -54.96 -44.55 74.46 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 111.891 0.33 . . . . 71.63 111.891 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -63.39 -41.79 98.77 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 119.133 -1.027 . . . . 68.65 113.736 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.8 mm -70.35 -42.99 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-O 121.231 0.539 . . . . 57.53 111.142 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -56.92 -41.14 77.61 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.221 0.823 . . . . 42.17 113.221 175.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 77.4 mt -68.75 -35.38 77.02 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 119.627 -0.829 . . . . 47.85 112.175 178.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -62.38 -40.92 98.02 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.985 0.897 . . . . 57.93 110.685 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -64.38 -48.14 76.59 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-N 115.531 -0.758 . . . . 35.58 109.331 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 31.4 mt -61.78 -37.1 83.08 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.448 -0.901 . . . . 35.53 112.971 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.4 t -60.9 -43.82 97.99 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 116.187 -0.46 . . . . 46.52 110.297 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.5 t -58.3 -48.29 80.98 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.209 0.528 . . . . 34.73 110.885 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.8 mt -55.75 -45.84 77.98 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 116.378 -0.373 . . . . 32.48 111.208 178.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -72.72 -14.47 78.01 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 115.373 0.909 . . . . 39.26 115.373 -171.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -97.12 -5.48 37.21 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.13 -0.693 . . . . 56.81 109.13 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 82.8 p -127.07 -75.46 0.58 Allowed 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 113.584 0.957 . . . . 35.47 113.584 -170.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 89.8 mt -103.61 -10.15 18.65 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.24 -0.912 . . . . 35.31 111.889 -175.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -126.22 39.71 3.88 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 122.961 1.362 . . . . 36.21 112.776 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 81.2 mtt-85 -64.7 146.64 54.46 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.589 -1.641 . . . . 68.58 106.937 160.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -54.72 -34.0 55.98 Favored Glycine 0 N--CA 1.477 1.373 0 C-N-CA 120.884 -0.675 . . . . 41.72 112.85 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 251' ' ' HOH . 17.9 pt-20 -58.74 -28.14 65.6 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.154 1.168 . . . . 69.53 114.154 177.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -80.05 -6.6 57.92 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 115.314 1.598 . . . . 41.02 115.314 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -59.99 128.1 35.19 Favored 'General case' 0 C--O 1.253 1.285 0 N-CA-C 107.996 -1.113 . . . . 44.45 107.996 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -140.56 126.78 19.76 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.982 -1.118 . . . . 52.68 107.982 172.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 59.8 tp -57.75 -38.68 75.79 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.407 -0.517 . . . . 43.53 111.489 -169.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -90.43 -34.13 15.74 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 115.739 1.755 . . . . 52.19 115.739 -177.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 -112.48 -22.24 10.92 Favored 'General case' 0 C--O 1.258 1.551 0 N-CA-C 114.89 1.441 . . . . 61.47 114.89 -164.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -151.85 75.8 1.16 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.443 -0.947 . . . . 39.3 108.443 -175.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -117.66 -169.25 1.64 Allowed 'General case' 0 C--O 1.242 0.665 0 O-C-N 123.83 0.707 . . . . 33.53 111.406 -167.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' CYS . . . . . 0.447 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 8.3 m -58.03 -34.57 70.19 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 113.133 0.79 . . . . 38.93 113.133 179.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -73.76 -35.58 65.01 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 119.633 -0.827 . . . . 31.75 111.838 177.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 11.5 m -52.6 -49.47 64.98 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 108.942 -0.762 . . . . 32.62 108.942 169.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -58.25 -53.57 56.81 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.035 0.383 . . . . 32.98 112.035 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 58.0 m -60.62 -43.06 97.92 Favored 'General case' 0 CA--C 1.509 -0.634 0 C-N-CA 120.498 -0.481 . . . . 34.26 109.786 -174.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -57.49 -49.32 76.68 Favored 'General case' 0 CA--C 1.555 1.139 0 N-CA-C 112.95 0.722 . . . . 32.75 112.95 177.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . 0.806 ' HG3' ' O ' ' A' ' 257' ' ' HOH . 37.5 mt-10 -62.48 -43.82 97.89 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 119.101 -1.039 . . . . 35.84 112.493 -178.154 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 74.4 t -63.1 -46.9 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 122.139 0.175 . . . . 31.84 110.594 175.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -49.89 -47.59 51.98 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.091 0.775 . . . . 32.43 113.091 172.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -62.52 -43.04 99.8 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.268 -0.424 . . . . 42.53 111.229 -179.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -63.46 -47.17 82.93 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.917 -0.771 . . . . 37.33 108.917 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 82.3 mt -75.12 -36.25 61.64 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.519 1.303 . . . . 39.39 114.519 -173.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.7 p -131.07 -8.2 3.87 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.805 1.039 . . . . 38.94 113.805 -168.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 75.37 3.54 71.24 Favored Glycine 0 N--CA 1.428 -1.877 0 CA-C-O 118.914 -0.937 . . . . 38.91 113.627 -174.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -105.06 145.27 30.72 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 118.798 1.299 . . . . 50.92 112.472 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -84.81 160.6 20.19 Favored 'General case' 0 C--O 1.25 1.08 0 O-C-N 124.084 0.865 . . . . 46.91 111.689 167.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 17.4 pt -84.48 159.54 58.46 Favored Pre-proline 0 CA--C 1.553 1.074 0 N-CA-C 106.77 -1.567 . . . . 32.81 106.77 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.2 140.01 92.89 Favored 'Trans proline' 0 C--O 1.254 1.286 0 N-CA-C 115.142 1.17 . . . . 33.0 115.142 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 98.8 p -61.18 -25.84 67.3 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.097 -0.956 . . . . 36.06 112.352 -178.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -66.27 -24.95 66.66 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 117.593 -1.643 . . . . 35.2 109.563 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 85.7 mt -77.79 -53.66 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 O-C-N 123.091 0.244 . . . . 36.82 111.468 170.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 31.2 p -66.55 -28.95 68.93 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.939 0.718 . . . . 40.25 112.939 -175.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASP . . . . . 0.617 ' OD1' ' O ' ' A' ' 249' ' ' HOH . 93.9 m-20 -82.72 -6.6 59.47 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 115.122 1.527 . . . . 54.45 115.122 -179.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LEU . . . . . 0.514 ' HB3' ' HD3' ' A' ' 132' ' ' PRO . 59.5 tp -53.78 -52.51 66.89 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 113.442 0.904 . . . . 66.79 113.442 -175.041 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' PRO . . . . . 0.514 ' HD3' ' HB3' ' A' ' 131' ' ' LEU . 92.1 Cg_exo -54.14 -40.42 81.93 Favored 'Trans proline' 0 C--O 1.243 0.755 0 C-N-CA 118.083 -0.811 . . . . 53.41 112.739 -178.007 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 89.4 p -64.88 -38.92 92.58 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 120.193 -0.603 . . . . 53.77 112.361 178.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 130' ' ' ASP . 0.7 OUTLIER -59.3 -43.93 92.58 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 120.994 0.426 . . . . 73.19 111.256 175.935 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 76.6 t -65.26 -43.92 95.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 CA-C-N 115.848 -0.614 . . . . 51.98 109.348 -179.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 20.4 mt -67.17 -30.3 70.23 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 113.307 0.854 . . . . 65.09 113.307 -174.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 88.4 p -70.47 16.02 0.09 Allowed 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 113.268 0.84 . . . . 58.44 113.268 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 32.5 p -125.0 153.35 71.21 Favored Pre-proline 0 C--O 1.241 0.628 0 O-C-N 121.062 -1.023 . . . . 51.74 110.178 -177.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.93 -42.87 37.15 Favored 'Trans proline' 0 C--N 1.356 0.955 0 O-C-N 122.904 0.949 . . . . 61.06 113.676 172.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -56.75 -57.12 13.81 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.101 0.961 . . . . 70.15 110.854 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.61 -40.25 78.15 Favored Glycine 0 N--CA 1.471 0.973 0 O-C-N 123.482 0.489 . . . . 57.51 112.792 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -72.06 -33.12 67.69 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.682 0.623 . . . . 74.87 112.682 -179.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -76.78 -32.92 58.0 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 112.671 0.619 . . . . 71.89 112.671 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 9.7 mt -97.48 -1.55 43.9 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.617 0.969 . . . . 72.28 113.617 -177.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ARG . . . . . 0.699 ' O ' ' HB2' ' A' ' 148' ' ' LEU . . . -52.72 -50.54 80.38 Favored Pre-proline 0 CA--C 1.545 0.771 0 N-CA-C 115.031 1.493 . . . . 83.07 115.031 178.505 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -67.46 -34.96 24.78 Favored 'Trans proline' 0 CA--C 1.557 1.633 0 C-N-CA 117.238 -1.374 . . . . 101.55 110.63 -171.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 24.0 tp -50.17 -47.51 54.41 Favored 'General case' 0 N--CA 1.402 -2.848 1 CA-C-O 128.919 4.2 . . . . 111.34 113.097 173.828 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' LEU . . . . . 0.699 ' HB2' ' O ' ' A' ' 145' ' ' ARG . 4.7 tt . . . . . 1 C--O 1.405 9.239 2 O-C-N 114.948 -4.845 . . . . 130.42 123.554 163.593 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' HG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' HG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . 0.617 ' O ' ' OD1' ' A' ' 130' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . 0.41 ' O ' ' HG3' ' A' ' 99' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . 0.806 ' O ' ' HG3' ' A' ' 114' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 119.135 -0.459 . . . . 71.840000000000003 111.117 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.0 mt -110.0 138.87 45.77 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 123.853 0.721 . . . . 59.200000000000003 112.811 176.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -125.87 128.78 24.48 Favored Pre-proline 0 CA--C 1.534 0.344 0 O-C-N 123.685 0.616 . . . . 55.409999999999997 110.129 -176.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.75 138.14 44.09 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 C-N-CA 122.0 1.8 . . . . 45.380000000000003 111.419 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.2 t -114.22 127.4 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 124.834 1.334 . . . . 37.770000000000003 109.973 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -120.37 149.27 42.62 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 121.023 0.439 . . . . 44.479999999999997 110.941 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 28.8 tp -105.91 113.04 26.34 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 106.547 -1.649 . . . . 33.25 106.547 169.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -81.07 126.32 31.29 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 109.565 -0.531 . . . . 40.149999999999999 109.565 170.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.5 t -117.15 126.39 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 115.856 -0.611 . . . . 36.090000000000003 109.812 -173.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -125.13 135.2 52.42 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.802 0.689 . . . . 40.210000000000001 110.655 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -88.83 103.66 16.19 Favored 'General case' 0 C--O 1.253 1.238 0 O-C-N 124.335 1.022 . . . . 38.899999999999999 109.97 169.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.7 mt -58.76 -25.26 62.87 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 121.076 0.465 . . . . 44.380000000000003 112.075 -176.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.7 p -86.45 -4.95 59.26 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 114.255 1.206 . . . . 46.469999999999999 114.255 -177.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.1 mmtt 51.19 44.21 28.85 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-O 120.935 0.397 . . . . 64.140000000000001 111.689 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.35 -6.95 82.5 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 115.851 1.1 . . . . 51.659999999999997 115.851 178.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.471 HD23 ' NH2' ' A' ' 23' ' ' ARG . 31.3 mt -68.46 -37.11 79.89 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.963 1.097 . . . . 58.420000000000002 113.963 -178.464 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.39 -46.32 83.57 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.271 0.558 . . . . 46.200000000000003 110.418 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.7 ttp-105 -56.76 -44.46 81.78 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.757 -0.656 . . . . 80.640000000000001 111.645 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.471 ' NH2' HD23 ' A' ' 20' ' ' LEU . 13.7 ttp-105 -75.25 -47.27 28.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.966 -1.015 . . . . 84.299999999999997 112.636 -179.773 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.1 mt -97.94 -13.96 20.89 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 116.105 1.891 . . . . 75.689999999999998 116.105 -167.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.0 p -57.0 -45.03 100.0 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 114.71 1.374 . . . . 60.890000000000001 114.71 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.24 -42.91 61.62 Favored 'Trans proline' 0 CA--C 1.553 1.457 0 C-N-CA 117.265 -1.357 . . . . 55.840000000000003 115.169 176.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.3 tp -78.08 -38.4 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 119.82 -0.752 . . . . 67.599999999999994 112.163 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 82.4 mtp -72.86 -44.03 61.86 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.3 -0.56 . . . . 76.400000000000006 110.932 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 72.3 mt -115.52 -15.02 11.5 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 115.338 1.607 . . . . 62.649999999999999 115.338 -165.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 77.52 18.74 77.32 Favored Glycine 0 N--CA 1.478 1.491 0 N-CA-C 114.408 0.523 . . . . 62.399999999999999 114.408 -177.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . . . -159.39 148.96 18.52 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.549 0.74 . . . . 61.210000000000001 110.653 -169.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -91.03 110.78 22.05 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-O 121.493 0.663 . . . . 59.840000000000003 111.809 -175.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.5 mt -110.07 149.89 29.36 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.57 -1.27 . . . . 63.270000000000003 107.57 170.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -97.09 -23.76 16.09 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.698 0.624 . . . . 62.979999999999997 112.322 -175.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -168.99 164.27 37.93 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.596 -0.812 . . . . 50.450000000000003 112.34 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 36.9 mm -104.09 96.06 4.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 105.349 -2.093 . . . . 47.68 105.349 172.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -84.85 117.78 24.09 Favored 'General case' 0 C--O 1.255 1.347 0 N-CA-C 112.906 0.706 . . . . 45.340000000000003 112.906 -160.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.447 ' ND1' ' SG ' ' A' ' 108' ' ' CYS . 26.9 t60 -106.94 137.72 44.47 Favored 'General case' 0 C--O 1.243 0.737 0 O-C-N 124.101 0.876 . . . . 40.229999999999997 110.517 162.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 71.2 p -130.91 165.39 23.18 Favored 'General case' 0 C--O 1.252 1.196 0 N-CA-C 113.36 0.874 . . . . 33.969999999999999 113.36 178.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 80.8 p -150.93 161.67 42.26 Favored 'General case' 0 C--O 1.245 0.829 0 N-CA-C 105.259 -2.126 . . . . 34.109999999999999 105.259 178.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 11.5 mm -104.84 129.85 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 109.467 -0.568 . . . . 35.109999999999999 109.467 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 55.8 t -110.74 118.54 57.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.504 0 N-CA-C 107.073 -1.455 . . . . 37.729999999999997 107.073 175.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.1 p -156.9 149.2 10.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 N-CA-C 106.346 -1.724 . . . . 39.079999999999998 106.346 -179.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 49.91 41.1 22.32 Favored 'General case' 0 C--O 1.214 -0.813 0 CA-C-O 120.915 0.388 . . . . 48.68 111.861 -178.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt 67.2 16.32 10.17 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 120.343 3.46 . . . . 59.359999999999999 120.343 174.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -136.78 156.98 47.79 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 109.689 -0.486 . . . . 55.840000000000003 109.689 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -106.25 118.9 37.84 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 124.552 1.158 . . . . 41.859999999999999 109.231 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -109.54 136.02 49.6 Favored 'General case' 0 CA--C 1.506 -0.735 0 C-N-CA 123.444 0.698 . . . . 41.990000000000002 109.812 -173.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -152.98 172.03 17.45 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.63 0.729 . . . . 48.609999999999999 111.186 -178.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -111.76 179.78 3.92 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.087 -1.449 . . . . 40.719999999999999 107.087 -173.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 163.7 -175.78 39.86 Favored Glycine 0 CA--C 1.502 -0.738 0 N-CA-C 105.009 -3.236 . . . . 42.130000000000003 105.009 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 78.6 p -72.03 -15.81 62.04 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-N 116.575 0.188 . . . . 57.149999999999999 110.792 -175.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.43 -3.47 90.52 Favored Glycine 0 C--O 1.249 1.078 0 N-CA-C 114.977 0.751 . . . . 49.75 114.977 172.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 96.12 -163.16 23.08 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 113.856 0.302 . . . . 43.740000000000002 113.856 -170.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 60.4 mt -77.26 131.99 33.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 N-CA-C 109.059 -0.719 . . . . 40.670000000000002 109.059 177.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.8 m -131.85 160.99 34.06 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-N 115.462 -0.79 . . . . 51.039999999999999 111.176 177.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.8 p -134.68 146.28 49.33 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 113.638 0.977 . . . . 52.990000000000002 113.638 167.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.417 ' SG ' HG22 ' A' ' 63' ' ' THR . 15.7 m -128.17 167.77 17.68 Favored Pre-proline 0 C--O 1.245 0.845 0 N-CA-C 108.924 -0.769 . . . . 52.280000000000001 108.924 167.556 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -55.74 146.94 63.47 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 116.238 -2.041 . . . . 54.259999999999998 110.495 165.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -55.11 127.73 27.53 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 O-C-N 122.532 0.754 . . . . 52.770000000000003 113.461 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.48 1.58 82.52 Favored Glycine 0 CA--C 1.522 0.481 0 CA-C-N 115.568 -0.742 . . . . 59.439999999999998 112.42 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -101.46 17.78 54.72 Favored Glycine 0 C--N 1.337 0.623 0 N-CA-C 117.354 1.702 . . . . 63.409999999999997 117.354 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' THR . . . . . 0.417 HG22 ' SG ' ' A' ' 58' ' ' CYS . 4.6 p -76.39 177.38 7.38 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.315 1.057 . . . . 62.030000000000001 110.903 166.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -25.53 65.75 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.63 0.604 . . . . 67.579999999999998 112.63 178.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.6 mt -71.5 -23.87 61.88 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.05 0.94 . . . . 61.530000000000001 112.065 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 83.53 -151.6 28.19 Favored Glycine 0 N--CA 1.462 0.392 0 CA-C-N 116.336 -0.393 . . . . 59.219999999999999 113.01 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.44 141.26 50.5 Favored 'Trans proline' 0 C--O 1.249 1.038 0 C-N-CA 124.057 3.172 . . . . 59.560000000000002 112.024 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.83 157.62 61.11 Favored 'Trans proline' 0 C--N 1.348 0.521 0 O-C-N 122.957 0.977 . . . . 48.310000000000002 112.592 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -75.87 -32.28 59.65 Favored 'General case' 0 C--O 1.242 0.679 0 O-C-N 124.394 1.059 . . . . 56.869999999999997 113.293 172.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.4 t -150.03 147.82 28.29 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 106.984 -1.487 . . . . 43.280000000000001 106.984 173.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.7 t -114.79 114.06 45.47 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 105.211 -2.144 . . . . 42.460000000000001 105.211 174.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 44.5 t -105.6 135.43 43.8 Favored 'Isoleucine or valine' 0 C--O 1.263 1.788 0 N-CA-C 108.959 -0.756 . . . . 34.770000000000003 108.959 -174.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -80.95 118.61 22.58 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 123.451 0.47 . . . . 46.439999999999998 111.252 177.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.0 t -87.54 -49.77 14.34 Favored 'Isoleucine or valine' 0 C--O 1.249 1.048 0 CA-C-O 121.348 0.594 . . . . 38.630000000000003 110.924 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 159.89 -158.01 29.27 Favored Glycine 0 CA--C 1.505 -0.555 0 N-CA-C 106.998 -2.441 . . . . 47.57 106.998 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.4 m -120.12 153.09 36.65 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 107.148 -1.427 . . . . 52.729999999999997 107.148 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.6 t -130.26 147.41 51.98 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 124.335 1.022 . . . . 45.350000000000001 110.553 -179.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -81.64 -16.79 50.31 Favored 'General case' 0 C--O 1.216 -0.71 0 C-N-CA 124.736 1.214 . . . . 72.689999999999998 111.984 169.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.6 t -67.74 121.4 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 112.017 0.377 . . . . 43.770000000000003 112.017 -173.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 55.5 p -77.32 163.93 26.01 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 123.197 0.599 . . . . 54.200000000000003 110.091 -176.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -54.96 -44.55 74.46 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 111.891 0.33 . . . . 71.629999999999995 111.891 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -63.39 -41.79 98.77 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 119.133 -1.027 . . . . 68.650000000000006 113.736 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.8 mm -70.35 -42.99 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-O 121.231 0.539 . . . . 57.530000000000001 111.142 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -56.92 -41.14 77.61 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.221 0.823 . . . . 42.170000000000002 113.221 175.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 77.4 mt -68.75 -35.38 77.02 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 119.627 -0.829 . . . . 47.850000000000001 112.175 178.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -62.38 -40.92 98.02 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.985 0.897 . . . . 57.93 110.685 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -64.38 -48.14 76.59 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-N 115.531 -0.758 . . . . 35.579999999999998 109.331 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 31.4 mt -61.78 -37.1 83.08 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.448 -0.901 . . . . 35.530000000000001 112.971 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.4 t -60.9 -43.82 97.99 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 116.187 -0.46 . . . . 46.520000000000003 110.297 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.5 t -58.3 -48.29 80.98 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.209 0.528 . . . . 34.729999999999997 110.885 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.8 mt -55.75 -45.84 77.98 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 116.378 -0.373 . . . . 32.479999999999997 111.208 178.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -72.72 -14.47 78.01 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 115.373 0.909 . . . . 39.259999999999998 115.373 -171.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -97.12 -5.48 37.21 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.13 -0.693 . . . . 56.810000000000002 109.13 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 82.8 p -127.07 -75.46 0.58 Allowed 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 113.584 0.957 . . . . 35.469999999999999 113.584 -170.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 89.8 mt -103.61 -10.15 18.65 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.24 -0.912 . . . . 35.310000000000002 111.889 -175.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -126.22 39.71 3.88 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 122.961 1.362 . . . . 36.210000000000001 112.776 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 81.2 mtt-85 -64.7 146.64 54.46 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.589 -1.641 . . . . 68.579999999999998 106.937 160.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -54.72 -34.0 55.98 Favored Glycine 0 N--CA 1.477 1.373 0 C-N-CA 120.884 -0.675 . . . . 41.719999999999999 112.85 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 251' ' ' HOH . 17.9 pt-20 -58.74 -28.14 65.6 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.154 1.168 . . . . 69.530000000000001 114.154 177.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -80.05 -6.6 57.92 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 115.314 1.598 . . . . 41.020000000000003 115.314 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -59.99 128.1 35.19 Favored 'General case' 0 C--O 1.253 1.285 0 N-CA-C 107.996 -1.113 . . . . 44.450000000000003 107.996 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.765 HD22 ' H ' ' A' ' 105' ' ' GLU . 7.4 t30 -140.56 126.78 19.76 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.982 -1.118 . . . . 52.68 107.982 172.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 59.8 tp -57.75 -38.68 75.79 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.407 -0.517 . . . . 43.530000000000001 111.489 -169.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -90.43 -34.13 15.74 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 115.739 1.755 . . . . 52.189999999999998 115.739 -177.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.765 ' H ' HD22 ' A' ' 102' ' ' ASN . 60.1 mm-40 -112.48 -22.24 10.92 Favored 'General case' 0 C--O 1.258 1.551 0 N-CA-C 114.89 1.441 . . . . 61.469999999999999 114.89 -164.365 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -151.85 75.8 1.16 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.443 -0.947 . . . . 39.299999999999997 108.443 -175.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -117.66 -169.25 1.64 Allowed 'General case' 0 C--O 1.242 0.665 0 O-C-N 123.83 0.707 . . . . 33.530000000000001 111.406 -167.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.447 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 8.3 m -58.03 -34.57 70.19 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 113.133 0.79 . . . . 38.93 113.133 179.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -73.76 -35.58 65.01 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 119.633 -0.827 . . . . 31.75 111.838 177.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 11.5 m -52.6 -49.47 64.98 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 108.942 -0.762 . . . . 32.619999999999997 108.942 169.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -58.25 -53.57 56.81 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.035 0.383 . . . . 32.979999999999997 112.035 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 58.0 m -60.62 -43.06 97.92 Favored 'General case' 0 CA--C 1.509 -0.634 0 C-N-CA 120.498 -0.481 . . . . 34.259999999999998 109.786 -174.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -57.49 -49.32 76.68 Favored 'General case' 0 CA--C 1.555 1.139 0 N-CA-C 112.95 0.722 . . . . 32.75 112.95 177.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.806 ' HG3' ' O ' ' A' ' 257' ' ' HOH . 37.5 mt-10 -62.48 -43.82 97.89 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 119.101 -1.039 . . . . 35.840000000000003 112.493 -178.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 74.4 t -63.1 -46.9 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 122.139 0.175 . . . . 31.84 110.594 175.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -49.89 -47.59 51.98 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.091 0.775 . . . . 32.43 113.091 172.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -62.52 -43.04 99.8 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.268 -0.424 . . . . 42.530000000000001 111.229 -179.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -63.46 -47.17 82.93 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.917 -0.771 . . . . 37.329999999999998 108.917 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 82.3 mt -75.12 -36.25 61.64 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.519 1.303 . . . . 39.390000000000001 114.519 -173.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.7 p -131.07 -8.2 3.87 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.805 1.039 . . . . 38.939999999999998 113.805 -168.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 75.37 3.54 71.24 Favored Glycine 0 N--CA 1.428 -1.877 0 CA-C-O 118.914 -0.937 . . . . 38.909999999999997 113.627 -174.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -105.06 145.27 30.72 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 118.798 1.299 . . . . 50.920000000000002 112.472 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -84.81 160.6 20.19 Favored 'General case' 0 C--O 1.25 1.08 0 O-C-N 124.084 0.865 . . . . 46.909999999999997 111.689 167.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 17.4 pt -84.48 159.54 58.46 Favored Pre-proline 0 CA--C 1.553 1.074 0 N-CA-C 106.77 -1.567 . . . . 32.810000000000002 106.77 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.2 140.01 92.89 Favored 'Trans proline' 0 C--O 1.254 1.286 0 N-CA-C 115.142 1.17 . . . . 33.0 115.142 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 98.8 p -61.18 -25.84 67.3 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.097 -0.956 . . . . 36.060000000000002 112.352 -178.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -66.27 -24.95 66.66 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 117.593 -1.643 . . . . 35.200000000000003 109.563 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 85.7 mt -77.79 -53.66 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 O-C-N 123.091 0.244 . . . . 36.82 111.468 170.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 31.2 p -66.55 -28.95 68.93 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.939 0.718 . . . . 40.25 112.939 -175.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.617 ' OD1' ' O ' ' A' ' 249' ' ' HOH . 93.9 m-20 -82.72 -6.6 59.47 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 115.122 1.527 . . . . 54.450000000000003 115.122 -179.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.514 ' HB3' ' HD3' ' A' ' 132' ' ' PRO . 59.5 tp -53.78 -52.51 66.89 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 113.442 0.904 . . . . 66.790000000000006 113.442 -175.041 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.514 ' HD3' ' HB3' ' A' ' 131' ' ' LEU . 92.1 Cg_exo -54.14 -40.42 81.93 Favored 'Trans proline' 0 C--O 1.243 0.755 0 C-N-CA 118.083 -0.811 . . . . 53.409999999999997 112.739 -178.007 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 89.4 p -64.88 -38.92 92.58 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 120.193 -0.603 . . . . 53.770000000000003 112.361 178.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 130' ' ' ASP . 0.7 OUTLIER -59.3 -43.93 92.58 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 120.994 0.426 . . . . 73.189999999999998 111.256 175.935 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 76.6 t -65.26 -43.92 95.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 CA-C-N 115.848 -0.614 . . . . 51.979999999999997 109.348 -179.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 20.4 mt -67.17 -30.3 70.23 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 113.307 0.854 . . . . 65.090000000000003 113.307 -174.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 88.4 p -70.47 16.02 0.09 Allowed 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 113.268 0.84 . . . . 58.439999999999998 113.268 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 32.5 p -125.0 153.35 71.21 Favored Pre-proline 0 C--O 1.241 0.628 0 O-C-N 121.062 -1.023 . . . . 51.740000000000002 110.178 -177.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.93 -42.87 37.15 Favored 'Trans proline' 0 C--N 1.356 0.955 0 O-C-N 122.904 0.949 . . . . 61.060000000000002 113.676 172.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -56.75 -57.12 13.81 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.101 0.961 . . . . 70.150000000000006 110.854 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -55.61 -40.25 78.15 Favored Glycine 0 N--CA 1.471 0.973 0 O-C-N 123.482 0.489 . . . . 57.509999999999998 112.792 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -72.06 -33.12 67.69 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.682 0.623 . . . . 74.870000000000005 112.682 -179.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -76.78 -32.92 58.0 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 112.671 0.619 . . . . 71.890000000000001 112.671 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 9.7 mt -97.48 -1.55 43.9 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.617 0.969 . . . . 72.280000000000001 113.617 -177.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.699 ' O ' ' HB2' ' A' ' 148' ' ' LEU . . . -52.72 -50.54 80.38 Favored Pre-proline 0 CA--C 1.545 0.771 0 N-CA-C 115.031 1.493 . . . . 83.069999999999993 115.031 178.505 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -67.46 -34.96 24.78 Favored 'Trans proline' 0 CA--C 1.557 1.633 0 C-N-CA 117.238 -1.374 . . . . 101.55 110.63 -171.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 24.0 tp -50.17 -47.51 54.41 Favored 'General case' 0 N--CA 1.402 -2.848 1 CA-C-O 128.919 4.2 . . . . 111.34 113.097 173.828 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.699 ' HB2' ' O ' ' A' ' 145' ' ' ARG . 4.7 tt . . . . . 1 C--O 1.405 9.239 2 O-C-N 114.948 -4.845 . . . . 130.41999999999999 123.554 163.593 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' HG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' HG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . 0.617 ' O ' ' OD1' ' A' ' 130' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . 0.41 ' O ' ' HG3' ' A' ' 99' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . 0.806 ' O ' ' HG3' ' A' ' 114' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_