data_4ov1_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 4ov1 _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 ' 4' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 C--O 1.19 -2.038 0 N-CA-C 116.251 1.945 . . . . 46.32 116.251 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.1 mt -117.8 142.78 46.91 Favored 'General case' 0 C--O 1.181 -2.52 0 CA-C-O 122.344 1.069 . . . . 27.56 113.777 -177.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 31.1 p -130.94 159.11 38.4 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.005 -0.998 . . . . 25.36 111.078 169.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 7.1 mt -119.55 135.51 59.65 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 112.32 0.489 . . . . 34.41 112.32 -174.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -128.46 133.88 48.61 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 114.265 1.209 . . . . 25.69 114.265 174.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.2 t -101.11 122.01 52.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 N-CA-C 113.178 0.807 . . . . 22.35 113.178 170.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -78.71 110.43 13.85 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.744 0.783 . . . . 34.71 109.423 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -60.96 -36.44 79.39 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.817 -1.083 . . . . 41.59 113.248 -177.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -58.29 -49.01 78.65 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-O 120.91 0.386 . . . . 70.21 111.378 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -74.0 -42.44 60.38 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 112.778 0.659 . . . . 39.88 112.778 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 45.2 t -49.17 125.9 11.68 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 114.516 1.302 . . . . 38.36 114.516 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.5 mm-40 -117.11 21.9 12.9 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.39 0.885 . . . . 35.41 113.39 175.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.5 40.34 98.98 Favored Glycine 0 C--O 1.239 0.41 0 N-CA-C 116.216 1.246 . . . . 30.75 116.216 175.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HIS . . . . . 0.593 ' CE1' ' OE1' ' A' ' 61' ' ' GLU . 40.9 m80 -65.97 -33.04 74.91 Favored 'General case' 0 C--O 1.162 -3.519 0 CA-C-N 117.246 0.523 . . . . 31.16 110.41 176.439 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 72.13 18.05 4.9 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 115.61 1.707 . . . . 23.74 115.61 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 29.8 mtp85 -63.83 -47.11 82.09 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 111.826 0.306 . . . . 31.7 111.826 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.3 p -50.44 -47.87 56.62 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.599 0.76 . . . . 21.83 112.017 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -62.82 -48.65 78.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.943 -0.571 . . . . 29.82 112.141 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.93 -39.49 74.6 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.392 0.886 . . . . 30.61 113.392 178.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . 0.831 ' CD1' ' ND2' ' A' ' 58' ' ' ASN . 47.0 mt -82.99 -47.17 12.01 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.18 0.807 . . . . 32.7 113.18 -177.265 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -123.83 63.57 29.72 Favored Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 112.326 0.491 . . . . 36.66 112.326 -176.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.12 -39.51 41.69 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.145 2.564 . . . . 27.42 112.278 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -68.08 -19.5 64.87 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.857 -0.61 . . . . 34.34 110.778 -176.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 82.3 mt -101.47 -29.64 11.88 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.789 1.403 . . . . 30.07 114.789 -174.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -121.66 155.95 34.05 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.196 0.813 . . . . 24.87 113.196 -176.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -129.99 141.03 50.8 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 109.177 -0.675 . . . . 34.49 109.177 167.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.1 mt -94.35 144.45 25.53 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 110.109 -0.33 . . . . 23.37 110.109 174.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.4 p30 -83.92 -176.27 6.2 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 119.713 -0.795 . . . . 28.76 109.421 171.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -60.1 -29.36 68.55 Favored 'General case' 0 C--O 1.222 -0.364 0 N-CA-C 111.89 0.33 . . . . 24.25 111.89 -176.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -94.98 8.88 41.46 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 113.981 1.104 . . . . 27.67 113.981 -172.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.39 -7.44 77.94 Favored Glycine 0 CA--C 1.531 1.04 0 N-CA-C 120.52 2.968 . . . . 25.54 120.52 178.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -82.28 146.37 29.48 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 118.368 1.084 . . . . 30.89 112.416 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.81 154.75 17.06 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.973 1.101 . . . . 23.2 113.973 -178.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 p-80 -155.32 148.53 24.79 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.951 -1.022 . . . . 34.63 108.542 173.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . 0.509 ' N ' ' OE1' ' A' ' 38' ' ' GLU . 8.1 pm0 -55.27 145.2 22.36 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 123.867 0.729 . . . . 27.51 112.79 -179.505 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.6 mtpt -85.16 119.05 25.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.462 -0.79 . . . . 41.15 112.557 -176.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 33.01 -90.27 0.01 OUTLIER Glycine 0 C--O 1.226 -0.382 0 N-CA-C 116.115 1.206 . . . . 66.73 116.115 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -54.9 -53.86 50.04 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.681 0.623 . . . . 50.54 112.681 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.61 -26.32 7.42 Favored Glycine 0 C--O 1.227 -0.337 0 C-N-CA 121.113 -0.565 . . . . 43.07 112.701 -174.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.87 132.46 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 112.277 0.473 . . . . 52.41 112.277 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.9 t -87.34 115.55 63.15 Favored Pre-proline 0 C--O 1.239 0.505 0 N-CA-C 112.506 0.558 . . . . 29.63 112.506 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -63.65 155.8 61.0 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 124.202 3.268 . . . . 26.45 109.441 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.23 -39.37 90.02 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 123.998 0.811 . . . . 23.33 111.962 -172.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -73.12 -9.47 58.75 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 116.436 2.013 . . . . 38.25 116.436 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 62.3 mt -112.75 11.42 19.4 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.075 1.139 . . . . 29.3 114.075 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.4 mt -68.39 -36.35 74.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.083 0.468 . . . . 28.6 112.199 -175.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -71.67 -38.07 70.68 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.303 -0.559 . . . . 40.31 112.109 175.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.7 mttm -66.45 -28.63 68.75 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.323 0.582 . . . . 40.6 111.378 177.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.72 -61.66 2.42 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 115.299 -0.864 . . . . 24.38 111.209 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -58.27 -34.49 70.56 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.408 0.892 . . . . 30.55 113.408 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 96.2 mt -62.7 -49.0 76.83 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.232 0.827 . . . . 39.98 113.232 174.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.5 -44.07 96.39 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.384 -0.371 . . . . 18.92 110.273 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -58.55 -48.74 79.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 35.14 112.002 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.7 t -59.71 -36.64 76.94 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.45 -0.341 . . . . 33.04 111.325 178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASN . . . . . 0.831 ' ND2' ' CD1' ' A' ' 23' ' ' LEU . 98.6 m-20 -81.97 -23.2 36.19 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 117.405 2.372 . . . . 52.39 117.405 -172.565 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 45.3 t -61.33 122.65 71.78 Favored Pre-proline 0 C--O 1.221 -0.405 0 C-N-CA 119.746 -0.782 . . . . 35.99 110.667 -179.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -67.82 -19.88 46.35 Favored 'Trans proline' 0 N--CA 1.47 0.101 0 C-N-CA 120.631 0.887 . . . . 27.68 112.938 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . 0.593 ' OE1' ' CE1' ' A' ' 17' ' ' HIS . 60.2 mm-40 -103.65 -4.09 24.26 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.579 0.549 . . . . 37.53 111.41 -171.496 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 58.98 44.57 16.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 122.04 0.924 . . . . 44.61 110.01 -179.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -92.91 -11.19 34.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.638 -1.165 . . . . 27.63 113.239 -173.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 88.8 mt -98.6 133.49 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 N-CA-C 113.243 0.831 . . . . 31.39 113.243 -175.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -114.03 135.73 53.69 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.342 -0.844 . . . . 44.21 109.543 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.1 mt -122.48 118.79 56.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 119.927 -0.709 . . . . 38.07 110.726 172.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 77.7 p -93.97 144.63 25.29 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.065 0.46 . . . . 37.49 111.323 178.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -126.02 118.42 25.29 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.147 0.795 . . . . 62.27 113.147 -175.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 . . . . . 0 C--O 1.237 0.44 0 CA-C-N 115.395 -0.821 . . . . 70.4 110.972 175.494 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' F3S . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 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 build full ' A' A ' 4' ' ' MET . . . . . 0.684 ' HB2' ' O ' ' A' ' 69' ' ' ASP . . . . . . . . 0 C--O 1.19 -2.038 0 N-CA-C 116.251 1.945 . . . . 46.32 116.251 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.1 mt -117.8 142.78 46.91 Favored 'General case' 0 C--O 1.181 -2.52 0 CA-C-O 122.344 1.069 . . . . 27.559999999999999 113.777 -177.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 31.1 p -130.94 159.11 38.4 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.005 -0.998 . . . . 25.359999999999999 111.078 169.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 7.1 mt -119.55 135.51 59.65 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 112.32 0.489 . . . . 34.409999999999997 112.32 -174.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -128.46 133.88 48.61 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 114.265 1.209 . . . . 25.690000000000001 114.265 174.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.2 t -101.11 122.01 52.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 N-CA-C 113.178 0.807 . . . . 22.350000000000001 113.178 170.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -78.71 110.43 13.85 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.744 0.783 . . . . 34.710000000000001 109.423 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -60.96 -36.44 79.39 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.817 -1.083 . . . . 41.590000000000003 113.248 -177.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -58.29 -49.01 78.65 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-O 120.91 0.386 . . . . 70.209999999999994 111.378 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -74.0 -42.44 60.38 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 112.778 0.659 . . . . 39.880000000000003 112.778 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 45.2 t -49.17 125.9 11.68 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 114.516 1.302 . . . . 38.359999999999999 114.516 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.5 mm-40 -117.11 21.9 12.9 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.39 0.885 . . . . 35.409999999999997 113.39 175.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.5 40.34 98.98 Favored Glycine 0 C--O 1.239 0.41 0 N-CA-C 116.216 1.246 . . . . 30.75 116.216 175.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 59.3 m-70 -65.97 -33.04 74.91 Favored 'General case' 0 C--O 1.162 -3.519 0 CA-C-N 117.246 0.523 . . . . 31.16 110.41 176.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 72.13 18.05 4.9 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 115.61 1.707 . . . . 23.739999999999998 115.61 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . 0.435 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 29.8 mtp85 -63.83 -47.11 82.09 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 111.826 0.306 . . . . 31.699999999999999 111.826 173.646 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.3 p -50.44 -47.87 56.62 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.599 0.76 . . . . 21.829999999999998 112.017 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -62.82 -48.65 78.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.943 -0.571 . . . . 29.82 112.141 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.93 -39.49 74.6 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.392 0.886 . . . . 30.609999999999999 113.392 178.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . 0.668 ' CD1' ' OD1' ' A' ' 58' ' ' ASN . 47.0 mt -82.99 -47.17 12.01 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.18 0.807 . . . . 32.700000000000003 113.18 -177.265 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -123.83 63.57 29.72 Favored Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 112.326 0.491 . . . . 36.659999999999997 112.326 -176.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.12 -39.51 41.69 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.145 2.564 . . . . 27.420000000000002 112.278 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -68.08 -19.5 64.87 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.857 -0.61 . . . . 34.340000000000003 110.778 -176.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 82.3 mt -101.47 -29.64 11.88 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.789 1.403 . . . . 30.07 114.789 -174.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -121.66 155.95 34.05 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.196 0.813 . . . . 24.870000000000001 113.196 -176.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -129.99 141.03 50.8 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 109.177 -0.675 . . . . 34.490000000000002 109.177 167.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.1 mt -94.35 144.45 25.53 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 110.109 -0.33 . . . . 23.370000000000001 110.109 174.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.4 p30 -83.92 -176.27 6.2 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 119.713 -0.795 . . . . 28.760000000000002 109.421 171.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -60.1 -29.36 68.55 Favored 'General case' 0 C--O 1.222 -0.364 0 N-CA-C 111.89 0.33 . . . . 24.25 111.89 -176.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -94.98 8.88 41.46 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 113.981 1.104 . . . . 27.670000000000002 113.981 -172.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.39 -7.44 77.94 Favored Glycine 0 CA--C 1.531 1.04 0 N-CA-C 120.52 2.968 . . . . 25.539999999999999 120.52 178.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -82.28 146.37 29.48 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 118.368 1.084 . . . . 30.890000000000001 112.416 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.81 154.75 17.06 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.973 1.101 . . . . 23.199999999999999 113.973 -178.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 p-80 -155.32 148.53 24.79 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.951 -1.022 . . . . 34.630000000000003 108.542 173.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -55.27 145.2 22.36 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 123.867 0.729 . . . . 27.510000000000002 112.79 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.6 mtpt -85.16 119.05 25.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.462 -0.79 . . . . 41.149999999999999 112.557 -176.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 33.01 -90.27 0.01 OUTLIER Glycine 0 C--O 1.226 -0.382 0 N-CA-C 116.115 1.206 . . . . 66.730000000000004 116.115 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -54.9 -53.86 50.04 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.681 0.623 . . . . 50.539999999999999 112.681 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.61 -26.32 7.42 Favored Glycine 0 C--O 1.227 -0.337 0 C-N-CA 121.113 -0.565 . . . . 43.07 112.701 -174.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.87 132.46 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 112.277 0.473 . . . . 52.409999999999997 112.277 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.9 t -87.34 115.55 63.15 Favored Pre-proline 0 C--O 1.239 0.505 0 N-CA-C 112.506 0.558 . . . . 29.629999999999999 112.506 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -63.65 155.8 61.0 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 124.202 3.268 . . . . 26.449999999999999 109.441 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . 0.479 ' HA ' HD12 ' A' ' 49' ' ' ILE . . . -61.23 -39.37 90.02 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 123.998 0.811 . . . . 23.329999999999998 111.962 -172.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -73.12 -9.47 58.75 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 116.436 2.013 . . . . 38.25 116.436 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 62.3 mt -112.75 11.42 19.4 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.075 1.139 . . . . 29.300000000000001 114.075 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ILE . . . . . 0.479 HD12 ' HA ' ' A' ' 46' ' ' ALA . 4.4 mt -68.39 -36.35 74.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.083 0.468 . . . . 28.600000000000001 112.199 -175.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . 0.646 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 70.7 m-20 -71.67 -38.07 70.68 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.303 -0.559 . . . . 40.310000000000002 112.109 175.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.7 mttm -66.45 -28.63 68.75 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.323 0.582 . . . . 40.600000000000001 111.378 177.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.72 -61.66 2.42 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 115.299 -0.864 . . . . 24.379999999999999 111.209 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -58.27 -34.49 70.56 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.408 0.892 . . . . 30.550000000000001 113.408 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . 0.646 ' HG ' ' O ' ' A' ' 50' ' ' ASP . 96.2 mt -62.7 -49.0 76.83 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.232 0.827 . . . . 39.979999999999997 113.232 174.352 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.5 -44.07 96.39 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.384 -0.371 . . . . 18.920000000000002 110.273 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -58.55 -48.74 79.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 35.140000000000001 112.002 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.7 t -59.71 -36.64 76.94 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.45 -0.341 . . . . 33.039999999999999 111.325 178.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASN . . . . . 0.668 ' OD1' ' CD1' ' A' ' 23' ' ' LEU . 9.6 m120 -81.97 -23.2 36.19 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 117.405 2.372 . . . . 52.390000000000001 117.405 -172.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 45.3 t -61.33 122.65 71.78 Favored Pre-proline 0 C--O 1.221 -0.405 0 C-N-CA 119.746 -0.782 . . . . 35.990000000000002 110.667 -179.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -67.82 -19.88 46.35 Favored 'Trans proline' 0 N--CA 1.47 0.101 0 C-N-CA 120.631 0.887 . . . . 27.68 112.938 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -103.65 -4.09 24.26 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.579 0.549 . . . . 37.530000000000001 111.41 -171.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 58.98 44.57 16.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 122.04 0.924 . . . . 44.609999999999999 110.01 -179.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -92.91 -11.19 34.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.638 -1.165 . . . . 27.629999999999999 113.239 -173.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 88.8 mt -98.6 133.49 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 N-CA-C 113.243 0.831 . . . . 31.390000000000001 113.243 -175.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -114.03 135.73 53.69 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.342 -0.844 . . . . 44.210000000000001 109.543 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.1 mt -122.48 118.79 56.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 119.927 -0.709 . . . . 38.07 110.726 172.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 77.7 p -93.97 144.63 25.29 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.065 0.46 . . . . 37.490000000000002 111.323 178.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -126.02 118.42 25.29 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.147 0.795 . . . . 62.270000000000003 113.147 -175.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . 0.684 ' O ' ' HB2' ' A' ' 4' ' ' MET . 18.2 m-20 . . . . . 0 C--O 1.237 0.44 0 CA-C-N 115.395 -0.821 . . . . 70.400000000000006 110.972 175.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' F3S . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 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 nobuild full ' A' A ' 4' ' ' MET . . . . . 0.684 ' HB2' ' O ' ' A' ' 69' ' ' ASP . . . . . . . . 0 C--O 1.19 -2.038 0 N-CA-C 116.251 1.945 . . . . 46.32 116.251 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.1 mt -117.8 142.78 46.91 Favored 'General case' 0 C--O 1.181 -2.52 0 CA-C-O 122.344 1.069 . . . . 27.559999999999999 113.777 -177.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 31.1 p -130.94 159.11 38.4 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.005 -0.998 . . . . 25.359999999999999 111.078 169.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 7.1 mt -119.55 135.51 59.65 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 112.32 0.489 . . . . 34.409999999999997 112.32 -174.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -128.46 133.88 48.61 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 114.265 1.209 . . . . 25.690000000000001 114.265 174.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.2 t -101.11 122.01 52.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 N-CA-C 113.178 0.807 . . . . 22.350000000000001 113.178 170.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -78.71 110.43 13.85 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.744 0.783 . . . . 34.710000000000001 109.423 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -60.96 -36.44 79.39 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.817 -1.083 . . . . 41.590000000000003 113.248 -177.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -58.29 -49.01 78.65 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-O 120.91 0.386 . . . . 70.209999999999994 111.378 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -74.0 -42.44 60.38 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 112.778 0.659 . . . . 39.880000000000003 112.778 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 45.2 t -49.17 125.9 11.68 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 114.516 1.302 . . . . 38.359999999999999 114.516 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.5 mm-40 -117.11 21.9 12.9 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.39 0.885 . . . . 35.409999999999997 113.39 175.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.5 40.34 98.98 Favored Glycine 0 C--O 1.239 0.41 0 N-CA-C 116.216 1.246 . . . . 30.75 116.216 175.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.71 ' HE1' ' OE1' ' A' ' 61' ' ' GLU . 40.9 m80 -65.97 -33.04 74.91 Favored 'General case' 0 C--O 1.162 -3.519 0 CA-C-N 117.246 0.523 . . . . 31.16 110.41 176.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 72.13 18.05 4.9 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 115.61 1.707 . . . . 23.739999999999998 115.61 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.435 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 29.8 mtp85 -63.83 -47.11 82.09 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 111.826 0.306 . . . . 31.699999999999999 111.826 173.646 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.3 p -50.44 -47.87 56.62 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.599 0.76 . . . . 21.829999999999998 112.017 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -62.82 -48.65 78.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.943 -0.571 . . . . 29.82 112.141 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.93 -39.49 74.6 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.392 0.886 . . . . 30.609999999999999 113.392 178.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . 1.084 ' CD1' HD22 ' A' ' 58' ' ' ASN . 47.0 mt -82.99 -47.17 12.01 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.18 0.807 . . . . 32.700000000000003 113.18 -177.265 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -123.83 63.57 29.72 Favored Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 112.326 0.491 . . . . 36.659999999999997 112.326 -176.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.12 -39.51 41.69 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.145 2.564 . . . . 27.420000000000002 112.278 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -68.08 -19.5 64.87 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.857 -0.61 . . . . 34.340000000000003 110.778 -176.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 82.3 mt -101.47 -29.64 11.88 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.789 1.403 . . . . 30.07 114.789 -174.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -121.66 155.95 34.05 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.196 0.813 . . . . 24.870000000000001 113.196 -176.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -129.99 141.03 50.8 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 109.177 -0.675 . . . . 34.490000000000002 109.177 167.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.1 mt -94.35 144.45 25.53 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 110.109 -0.33 . . . . 23.370000000000001 110.109 174.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.4 p30 -83.92 -176.27 6.2 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 119.713 -0.795 . . . . 28.760000000000002 109.421 171.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -60.1 -29.36 68.55 Favored 'General case' 0 C--O 1.222 -0.364 0 N-CA-C 111.89 0.33 . . . . 24.25 111.89 -176.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -94.98 8.88 41.46 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 113.981 1.104 . . . . 27.670000000000002 113.981 -172.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.39 -7.44 77.94 Favored Glycine 0 CA--C 1.531 1.04 0 N-CA-C 120.52 2.968 . . . . 25.539999999999999 120.52 178.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -82.28 146.37 29.48 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 118.368 1.084 . . . . 30.890000000000001 112.416 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.81 154.75 17.06 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.973 1.101 . . . . 23.199999999999999 113.973 -178.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 p-80 -155.32 148.53 24.79 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.951 -1.022 . . . . 34.630000000000003 108.542 173.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -55.27 145.2 22.36 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 123.867 0.729 . . . . 27.510000000000002 112.79 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.6 mtpt -85.16 119.05 25.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.462 -0.79 . . . . 41.149999999999999 112.557 -176.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 33.01 -90.27 0.01 OUTLIER Glycine 0 C--O 1.226 -0.382 0 N-CA-C 116.115 1.206 . . . . 66.730000000000004 116.115 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -54.9 -53.86 50.04 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.681 0.623 . . . . 50.539999999999999 112.681 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.61 -26.32 7.42 Favored Glycine 0 C--O 1.227 -0.337 0 C-N-CA 121.113 -0.565 . . . . 43.07 112.701 -174.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.87 132.46 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 112.277 0.473 . . . . 52.409999999999997 112.277 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.9 t -87.34 115.55 63.15 Favored Pre-proline 0 C--O 1.239 0.505 0 N-CA-C 112.506 0.558 . . . . 29.629999999999999 112.506 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -63.65 155.8 61.0 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 124.202 3.268 . . . . 26.449999999999999 109.441 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.479 ' HA ' HD12 ' A' ' 49' ' ' ILE . . . -61.23 -39.37 90.02 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 123.998 0.811 . . . . 23.329999999999998 111.962 -172.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -73.12 -9.47 58.75 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 116.436 2.013 . . . . 38.25 116.436 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 62.3 mt -112.75 11.42 19.4 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.075 1.139 . . . . 29.300000000000001 114.075 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.479 HD12 ' HA ' ' A' ' 46' ' ' ALA . 4.4 mt -68.39 -36.35 74.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.083 0.468 . . . . 28.600000000000001 112.199 -175.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.646 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 70.7 m-20 -71.67 -38.07 70.68 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.303 -0.559 . . . . 40.310000000000002 112.109 175.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.7 mttm -66.45 -28.63 68.75 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.323 0.582 . . . . 40.600000000000001 111.378 177.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.72 -61.66 2.42 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 115.299 -0.864 . . . . 24.379999999999999 111.209 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -58.27 -34.49 70.56 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.408 0.892 . . . . 30.550000000000001 113.408 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.646 ' HG ' ' O ' ' A' ' 50' ' ' ASP . 96.2 mt -62.7 -49.0 76.83 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.232 0.827 . . . . 39.979999999999997 113.232 174.352 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.5 -44.07 96.39 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.384 -0.371 . . . . 18.920000000000002 110.273 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -58.55 -48.74 79.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 35.140000000000001 112.002 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.7 t -59.71 -36.64 76.94 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.45 -0.341 . . . . 33.039999999999999 111.325 178.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASN . . . . . 1.084 HD22 ' CD1' ' A' ' 23' ' ' LEU . 98.6 m-20 -81.97 -23.2 36.19 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 117.405 2.372 . . . . 52.390000000000001 117.405 -172.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 45.3 t -61.33 122.65 71.78 Favored Pre-proline 0 C--O 1.221 -0.405 0 C-N-CA 119.746 -0.782 . . . . 35.990000000000002 110.667 -179.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -67.82 -19.88 46.35 Favored 'Trans proline' 0 N--CA 1.47 0.101 0 C-N-CA 120.631 0.887 . . . . 27.68 112.938 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.71 ' OE1' ' HE1' ' A' ' 17' ' ' HIS . 60.2 mm-40 -103.65 -4.09 24.26 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.579 0.549 . . . . 37.530000000000001 111.41 -171.496 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 58.98 44.57 16.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 122.04 0.924 . . . . 44.609999999999999 110.01 -179.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -92.91 -11.19 34.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.638 -1.165 . . . . 27.629999999999999 113.239 -173.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 88.8 mt -98.6 133.49 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 N-CA-C 113.243 0.831 . . . . 31.390000000000001 113.243 -175.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -114.03 135.73 53.69 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.342 -0.844 . . . . 44.210000000000001 109.543 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.1 mt -122.48 118.79 56.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 119.927 -0.709 . . . . 38.07 110.726 172.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 77.7 p -93.97 144.63 25.29 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.065 0.46 . . . . 37.490000000000002 111.323 178.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -126.02 118.42 25.29 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.147 0.795 . . . . 62.270000000000003 113.147 -175.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.684 ' O ' ' HB2' ' A' ' 4' ' ' MET . 18.2 m-20 . . . . . 0 C--O 1.237 0.44 0 CA-C-N 115.395 -0.821 . . . . 70.400000000000006 110.972 175.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' F3S . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 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 stop_ save_