data_1a8v_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 1a8v _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 ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.921 2 CA-C-O 108.49 -6.728 . . . . 26.88 125.532 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' HIS . . . . . . . . . . . . . 6.0 p-80 -85.22 -8.58 58.49 Favored 'General case' 0 N--CA 1.441 -0.91 1 CA-C-N 131.708 7.754 . . . . 32.66 113.26 177.642 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.7 mtt -92.19 122.78 35.0 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 115.208 -2.597 . . . . 29.74 110.166 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -126.57 123.27 37.31 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 105.78 -1.934 . . . . 29.76 105.78 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 39.6 tp -52.78 -40.67 63.4 Favored 'General case' 0 C--O 1.263 1.79 0 CA-C-O 123.562 1.648 . . . . 27.74 114.471 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.2 m -64.03 -43.14 96.49 Favored 'General case' 0 CA--C 1.519 -0.215 0 O-C-N 117.871 -3.018 . . . . 28.24 111.841 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -65.4 -34.63 78.77 Favored 'General case' 0 C--O 1.239 0.543 0 O-C-N 121.813 -0.554 . . . . 76.83 112.206 176.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 71.0 mt -67.38 -36.82 82.11 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 126.402 3.001 . . . . 27.54 110.656 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . 0.843 ' NZ ' ' OD2' ' A' ' 77' ' ' ASP . 18.7 mtmt -64.51 -28.34 69.59 Favored 'General case' 0 C--N 1.342 0.256 0 O-C-N 118.193 -2.817 . . . . 59.74 110.476 179.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -92.91 3.63 55.37 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 118.683 0.674 . . . . 45.16 111.393 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 99.8 m -87.57 132.19 41.5 Favored Pre-proline 0 N--CA 1.472 0.631 0 O-C-N 119.214 -2.178 . . . . 31.44 111.129 177.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.5 143.91 43.29 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.812 2.341 . . . . 32.65 109.5 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 5.2 t -64.67 -32.04 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 O-C-N 119.858 -1.776 . . . . 41.27 112.818 -174.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.7 p -62.72 -38.01 88.8 Favored 'General case' 0 C--N 1.354 0.795 0 CA-C-O 116.617 -1.658 . . . . 30.2 111.309 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -69.77 -28.88 66.13 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 115.859 1.799 . . . . 58.21 115.859 174.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.6 mt -71.37 -40.88 70.35 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 126.302 2.954 . . . . 29.33 111.043 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 84.6 mt -64.52 -41.73 93.13 Favored 'Isoleucine or valine' 0 C--O 1.246 0.876 0 C-N-CA 117.319 -1.752 . . . . 33.3 109.984 176.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -59.63 -46.11 89.97 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 118.794 -1.162 . . . . 40.27 112.243 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.8 tp -60.57 -48.65 80.84 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 124.78 2.229 . . . . 33.65 110.533 -179.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.95 -49.11 82.26 Favored Glycine 0 C--O 1.238 0.361 0 O-C-N 120.156 -1.59 . . . . 33.2 110.769 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.51 -37.68 88.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 118.539 -1.264 . . . . 47.11 110.269 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -61.49 -33.79 74.38 Favored 'General case' 0 C--O 1.252 1.192 0 N-CA-C 113.813 1.042 . . . . 66.38 113.813 174.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 98.0 mtp -74.67 -2.89 28.26 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 120.751 -1.218 . . . . 32.78 112.825 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.0 12.22 50.37 Favored Glycine 0 N--CA 1.461 0.318 0 CA-C-O 123.227 1.459 . . . . 38.91 109.754 174.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.0 mt -82.83 123.61 29.52 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 105.698 -1.964 . . . . 55.67 105.698 -176.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . 0.603 ' N ' ' OE1' ' A' ' 24' ' ' GLU . 20.2 mp0 -95.0 132.8 39.46 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 123.874 1.797 . . . . 85.89 114.484 -171.879 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 31.59 86.65 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 126.957 3.265 . . . . 85.57 114.339 -175.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 68.0 mt -84.83 -16.21 42.16 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 111.097 -2.774 . . . . 47.28 107.362 167.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.2 -23.73 62.52 Favored 'General case' 0 C--O 1.248 0.998 0 N-CA-C 115.967 1.84 . . . . 44.86 115.967 -176.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . 0.526 ' O ' ' CG ' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -86.92 -6.79 58.66 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 121.543 1.974 . . . . 90.3 113.893 170.45 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 11.7 mtp -91.82 156.1 17.75 Favored 'General case' 0 CA--C 1.501 -0.942 0 O-C-N 120.175 -1.578 . . . . 49.24 114.372 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.1 mtt180 -63.85 146.02 54.74 Favored 'General case' 0 N--CA 1.434 -1.227 0 O-C-N 120.008 -1.682 . . . . 80.38 109.043 163.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -48.53 -49.58 35.61 Favored 'General case' 0 C--O 1.253 1.243 0 C-N-CA 126.191 1.796 . . . . 34.34 112.892 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -55.98 -38.74 70.83 Favored 'General case' 0 N--CA 1.507 2.392 0 CA-C-O 124.447 2.07 . . . . 54.81 113.997 176.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -73.03 -38.19 66.63 Favored 'General case' 0 C--O 1.244 0.807 0 O-C-N 117.882 -3.011 . . . . 38.59 111.44 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 76.7 mt -56.83 -47.7 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 O-C-N 119.723 -1.861 . . . . 25.21 110.148 174.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.7 mt -53.84 -50.66 50.93 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.874 0 O-C-N 119.459 -2.026 . . . . 24.93 111.984 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -58.2 -46.95 84.9 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 125.085 2.374 . . . . 44.08 113.532 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.54 -48.61 66.0 Favored 'General case' 0 C--O 1.212 -0.889 0 O-C-N 120.082 -1.636 . . . . 24.82 111.16 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.6 mt -62.33 -48.92 86.09 Favored 'Isoleucine or valine' 0 C--N 1.348 0.526 0 CA-C-O 118.661 -0.685 . . . . 28.1 111.512 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 77.5 mt -61.71 -42.44 98.95 Favored 'General case' 0 C--O 1.253 1.253 0 C-N-CA 117.935 -1.506 . . . . 20.77 112.366 -176.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -60.12 -43.55 95.57 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 123.285 1.517 . . . . 39.32 111.956 -178.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 62.0 tp60 -68.0 -46.32 71.62 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.19 1.472 . . . . 52.45 108.717 -178.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -61.6 -36.73 81.53 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.517 -1.365 . . . . 30.14 111.978 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.64 -26.22 68.52 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 120.202 -1.561 . . . . 25.67 114.357 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -63.42 -19.54 64.78 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 116.402 2.001 . . . . 51.42 116.402 175.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 64.9 p -79.75 -5.91 56.21 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 119.716 -1.865 . . . . 24.89 113.714 172.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.74 -3.7 81.42 Favored Glycine 0 C--N 1.346 1.13 0 CA-C-N 120.107 1.321 . . . . 25.37 113.848 -176.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -69.86 150.81 46.41 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 119.053 1.427 . . . . 28.5 113.554 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -76.66 140.2 40.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 123.856 1.789 . . . . 33.18 112.028 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.45 144.7 37.16 Favored 'Isoleucine or valine' 0 C--N 1.342 0.25 0 CA-C-O 116.145 -1.883 . . . . 40.14 106.095 174.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -117.59 165.93 12.99 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-O 124.105 1.907 . . . . 31.49 115.215 -173.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -158.6 167.3 34.6 Favored Glycine 0 CA--C 1.543 1.793 0 N-CA-C 104.938 -3.265 . . . . 20.48 104.938 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -161.39 160.43 29.48 Favored 'General case' 0 C--O 1.245 0.832 0 C-N-CA 118.317 -1.353 . . . . 35.52 107.976 -178.396 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.12 -176.43 46.54 Favored Glycine 0 N--CA 1.48 1.582 0 N-CA-C 107.624 -2.19 . . . . 21.14 107.624 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.64 122.84 63.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 C-N-CA 126.162 1.785 . . . . 26.12 106.775 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.2 tp -72.51 135.69 45.72 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 118.676 -1.21 . . . . 22.15 114.045 -176.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . 0.753 ' CD ' ' O ' ' A' ' 147' ' ' HOH . 39.0 mt-10 -129.79 129.47 44.11 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 113.322 -1.763 . . . . 53.48 110.759 163.179 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 40.5 mm -98.03 130.33 46.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 O-C-N 125.486 1.741 . . . . 38.67 106.609 -176.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.8 mt -96.69 172.68 7.75 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.082 -0.963 . . . . 45.95 110.288 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.3 mp0 -61.45 -32.0 71.97 Favored 'General case' 0 C--O 1.253 1.258 0 N-CA-C 114.464 1.283 . . . . 34.73 114.464 -175.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -74.83 -2.0 24.76 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.176 1.176 . . . . 49.77 114.176 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.06 -10.46 69.95 Favored Glycine 0 CA--C 1.536 1.38 0 CA-C-O 114.916 -3.158 . . . . 30.99 113.801 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 43.2 p90 -91.01 174.21 7.54 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 116.917 -1.913 . . . . 34.78 107.544 175.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.43 172.57 23.2 Favored Glycine 0 C--O 1.216 -0.994 0 C-N-CA 117.459 -2.305 . . . . 19.36 113.485 173.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -122.5 147.84 45.88 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 115.295 -0.452 . . . . 24.03 110.35 167.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.96 110.43 21.68 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 126.866 2.604 . . . . 27.88 108.26 167.988 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -89.12 155.78 19.22 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 117.41 -1.281 . . . . 28.77 111.339 -175.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.5 m -69.21 127.39 32.9 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.001 -1.481 . . . . 54.12 107.001 171.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 118.82 0.736 . . . . 59.6 111.082 -179.86 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 122.931 1.348 . . . . 74.45 108.181 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -45.44 -51.86 9.27 Favored Glycine 0 N--CA 1.424 -2.109 1 N-CA-C 125.38 4.912 . . . . 61.92 125.38 -177.136 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -55.33 -22.3 32.85 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.893 1.729 . . . . 43.84 115.755 -168.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . 0.843 ' OD2' ' NZ ' ' A' ' 7' ' ' LYS . 4.7 p-10 -110.7 13.62 22.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 119.38 -2.075 . . . . 64.55 111.712 177.786 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -62.46 145.6 53.71 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 124.786 1.304 . . . . 35.03 107.653 167.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 55.2 mt -100.74 125.09 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-O 118.254 -0.879 . . . . 23.32 109.046 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -70.59 139.06 51.35 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-O 124.573 2.13 . . . . 34.39 112.888 176.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 46.3 t -129.23 121.11 52.98 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 O-C-N 118.135 -2.853 . . . . 22.0 105.966 -176.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 83.0 p -75.72 161.39 76.26 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 117.572 -1.651 . . . . 26.62 111.617 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.09 -38.28 87.22 Favored 'Trans proline' 0 N--CA 1.446 -1.265 0 C-N-CA 123.325 2.683 . . . . 27.26 114.378 167.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -34.48 64.94 Favored 'General case' 0 CA--C 1.492 -1.281 0 CA-C-N 120.93 1.695 . . . . 44.71 111.022 -174.38 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -65.17 -45.32 85.39 Favored 'General case' 0 C--N 1.374 1.633 0 CA-C-O 116.663 -1.637 . . . . 37.35 108.678 175.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.9 mm -58.07 -44.87 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 118.074 -1.45 . . . . 37.68 109.483 -177.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.67 -36.42 57.31 Favored 'General case' 0 C--N 1.369 1.444 0 C-N-CA 116.416 -2.113 . . . . 38.21 114.425 -175.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.62 -32.1 70.6 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 116.111 1.893 . . . . 77.88 116.111 178.409 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -106.25 8.14 31.77 Favored 'General case' 0 C--N 1.347 0.5 0 O-C-N 120.4 -1.437 . . . . 41.8 112.976 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 54.37 53.29 11.07 Favored 'General case' 0 CA--C 1.551 0.989 0 O-C-N 125.015 1.447 . . . . 26.63 112.232 176.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 11.8 mt -91.23 146.37 23.88 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 118.005 -0.997 . . . . 23.47 109.776 178.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 -134.79 153.7 51.91 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 117.67 -1.157 . . . . 36.67 108.808 -168.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.3 m -51.42 123.8 10.56 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 126.267 2.229 . . . . 27.29 114.411 173.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 96.28 -0.75 62.08 Favored Glycine 0 C--N 1.341 0.847 0 CA-C-O 115.763 -2.687 . . . . 20.42 113.011 176.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -67.23 146.51 54.1 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 106.591 -1.633 . . . . 19.51 106.591 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 40.5 m -94.14 117.5 30.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 107.09 -1.448 . . . . 32.3 107.09 169.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 8.4 mt -116.06 137.77 48.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 126.828 2.58 . . . . 30.99 112.406 -172.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.3 m -122.79 150.04 43.33 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 125.478 1.736 . . . . 43.88 108.695 168.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -175.26 175.77 47.19 Favored Glycine 0 N--CA 1.477 1.369 0 C-N-CA 116.367 -2.825 . . . . 21.87 107.351 174.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . 0.481 ' NZ ' ' NZ ' ' A' ' 115' ' ' LYS . 52.5 mttt -75.73 129.62 37.37 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 105.494 -2.039 . . . . 49.27 105.494 175.634 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 15.6 pt -116.34 167.12 9.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 O-C-N 125.547 1.78 . . . . 21.79 108.81 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 47.8 ptt85 -136.05 146.24 55.77 Favored Pre-proline 0 C--N 1.303 -1.426 0 CA-C-O 122.423 1.106 . . . . 33.09 109.696 172.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.19 156.07 42.13 Favored 'Trans proline' 0 N--CA 1.444 -1.422 0 C-N-CA 122.733 2.289 . . . . 34.89 111.037 172.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -63.27 137.7 62.33 Favored 'Trans proline' 0 C--N 1.331 -0.343 0 C-N-CA 120.89 1.06 . . . . 26.46 109.964 179.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.0 pttt -88.33 -166.64 1.64 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 112.817 -3.553 . . . . 59.28 105.962 168.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -65.11 129.31 39.23 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 120.412 -1.43 . . . . 74.29 113.889 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.58 -24.83 27.59 Favored Glycine 0 N--CA 1.47 0.91 0 CA-C-O 116.847 -2.085 . . . . 39.28 108.055 -179.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -98.28 158.93 15.27 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 124.388 2.042 . . . . 35.36 108.978 -175.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.3 mtp85 -120.12 -14.94 8.79 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.583 -1.189 . . . . 26.71 109.466 -174.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -128.02 147.12 50.5 Favored 'General case' 0 C--O 1.254 1.312 0 CA-C-N 120.331 1.423 . . . . 28.06 111.002 -170.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -54.42 152.73 6.21 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 105.988 -1.856 . . . . 35.5 105.988 167.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -135.35 140.32 44.95 Favored 'General case' 0 N--CA 1.441 -0.891 0 O-C-N 119.591 -1.943 . . . . 21.48 109.744 -176.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 20.0 tp -65.13 130.81 44.72 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 114.032 -1.44 . . . . 27.26 108.458 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 9.6 tp -101.35 -51.58 3.45 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 125.224 1.577 . . . . 33.42 111.485 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . 1.141 ' CB ' ' OE2' ' A' ' 118' ' ' GLU . 23.2 mttt -138.05 133.07 33.09 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 105.331 -2.1 . . . . 64.49 105.331 -177.599 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.3 t -83.61 154.13 3.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 124.672 2.177 . . . . 45.08 106.91 173.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . 0.301 2.0 t-20 65.94 67.4 0.48 Allowed 'General case' 0 N--CA 1.422 -1.834 1 CA-C-N 108.315 -4.039 . . . . 83.47 110.119 164.171 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . 1.141 ' OE2' ' CB ' ' A' ' 115' ' ' LYS . 43.1 mp0 . . . . . 0 C--O 1.249 1.042 4 O-C-N 138.286 9.741 . . . . 101.29 103.997 168.966 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.53 0 N-CA-C 115.006 0.762 . . . . 34.24 115.006 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -95.75 -8.71 33.71 Favored 'General case' 0 N--CA 1.436 -1.141 1 O-C-N 115.987 -4.243 . . . . 31.83 116.409 -179.995 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.4 mtt -89.46 123.76 33.88 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 122.667 1.222 . . . . 29.75 107.98 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -128.57 127.97 43.34 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 111.552 -2.567 . . . . 35.08 105.667 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 53.1 tp -59.66 -39.45 84.47 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.554 1.525 . . . . 26.5 114.325 -175.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 54.6 m -60.3 -47.15 87.24 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 124.342 2.02 . . . . 33.1 111.591 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.08 -43.01 86.78 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 113.93 -1.486 . . . . 65.76 113.497 179.285 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.3 mt -68.24 -30.84 69.98 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 122.455 1.121 . . . . 36.68 111.808 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LYS . . . . . 0.449 ' NZ ' ' OD2' ' B' ' 77' ' ' ASP . 35.5 mtmt -70.95 -27.29 63.64 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 118.603 -2.56 . . . . 59.7 110.094 176.15 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -96.91 17.92 15.76 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 115.359 -2.258 . . . . 47.62 111.715 175.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 97.2 m -100.5 129.8 27.04 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 121.8 2.091 . . . . 34.79 110.135 174.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -51.6 146.4 26.71 Favored 'Trans proline' 0 N--CA 1.437 -1.82 0 C-N-CA 122.987 2.458 . . . . 34.17 111.001 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -34.48 64.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 114.099 1.148 . . . . 39.96 114.099 -176.844 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 5.6 p -54.63 -46.25 73.88 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-N 118.29 0.495 . . . . 42.95 110.942 173.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -67.73 -33.23 74.45 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 116.637 -2.025 . . . . 42.91 111.428 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 41.7 mt -67.45 -40.75 85.42 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 116.887 -1.925 . . . . 27.7 112.822 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 94.8 mt -61.38 -41.77 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 CA-C-N 114.936 -1.029 . . . . 34.58 109.002 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 89.6 m -58.33 -50.97 71.75 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 117.8 -1.56 . . . . 41.31 109.272 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 42.9 tp -59.41 -47.53 85.11 Favored 'General case' 0 C--O 1.244 0.77 0 O-C-N 120.583 -1.323 . . . . 36.16 111.188 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.8 -47.93 85.1 Favored Glycine 0 C--O 1.219 -0.802 0 CA-C-O 124.359 2.088 . . . . 31.07 111.342 -176.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -66.69 -27.89 68.01 Favored 'General case' 0 C--O 1.255 1.342 0 O-C-N 118.967 -2.49 . . . . 62.52 111.831 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -66.16 -29.26 69.52 Favored 'General case' 0 C--O 1.247 0.924 0 N-CA-C 114.968 1.47 . . . . 58.5 114.968 170.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' MET . . . . . 0.713 ' SD ' ' O ' ' A' ' 143' ' ' HOH . 54.5 mtm -82.4 -2.46 53.14 Favored 'General case' 0 C--O 1.236 0.346 0 O-C-N 121.01 -1.056 . . . . 46.27 112.842 174.634 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.55 16.27 34.79 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-O 118.094 -1.392 . . . . 40.74 112.286 176.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 93.6 mt -88.74 168.23 12.66 Favored 'General case' 0 C--O 1.209 -1.038 1 CA-C-O 129.116 4.293 . . . . 56.51 118.947 -175.676 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -82.43 90.07 6.68 Favored 'General case' 0 N--CA 1.411 -2.391 3 C-N-CA 145.034 9.334 . . . . 100.67 122.271 -163.169 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 26.06 68.08 0.05 Allowed 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 125.858 2.742 . . . . 89.76 112.658 176.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 11.3 mt -68.06 -29.87 68.94 Favored 'General case' 0 C--O 1.217 -0.658 1 CA-C-N 105.332 -5.395 . . . . 63.74 103.269 167.749 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -44.72 -53.13 7.65 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 126.292 1.837 . . . . 68.65 113.17 176.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -91.17 -4.24 56.31 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 115.481 1.66 . . . . 83.75 115.481 177.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 7.0 mtm -87.66 161.18 17.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 123.197 1.475 . . . . 47.19 112.222 -175.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.09 160.48 32.81 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.537 -0.912 . . . . 74.18 108.537 176.015 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -59.08 -48.02 83.11 Favored 'General case' 0 C--N 1.321 -0.642 0 O-C-N 120.73 -1.231 . . . . 34.44 111.087 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -56.32 -41.13 75.51 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 115.021 1.489 . . . . 58.19 115.021 175.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -70.44 -29.55 66.16 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 117.889 -3.007 . . . . 41.31 111.67 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 59.1 mt -66.47 -43.88 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 123.206 1.479 . . . . 30.72 107.833 178.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 37.6 mt -63.24 -41.08 91.48 Favored 'Isoleucine or valine' 0 C--O 1.251 1.17 0 CA-C-O 124.385 2.04 . . . . 27.76 109.386 -176.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -63.62 -41.29 98.3 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 117.67 -1.612 . . . . 55.76 113.65 176.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.23 -45.97 92.36 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.724 0.773 . . . . 26.4 110.03 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 87.4 mt -59.2 -51.1 76.63 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 CA-C-O 118.336 -0.84 . . . . 28.86 110.254 175.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 85.3 mt -68.01 -39.04 83.26 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 122.34 2.336 . . . . 34.52 113.67 -176.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -60.5 -45.97 91.84 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 121.151 -0.968 . . . . 39.68 108.655 -179.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 -66.37 -43.16 86.74 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 117.886 -1.525 . . . . 46.26 110.879 -175.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 42.1 t60 -64.57 -35.73 81.93 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.592 -0.731 . . . . 26.91 112.346 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.77 -23.12 67.15 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.644 0.735 . . . . 27.17 112.85 179.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -64.93 -22.42 66.99 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 119.143 -2.223 . . . . 47.06 114.908 178.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 89.7 p -74.3 -9.15 58.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 119.375 0.989 . . . . 24.26 111.824 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.82 7.86 85.16 Favored Glycine 0 CA--C 1.532 1.118 0 CA-C-O 115.167 -3.018 . . . . 25.73 109.973 -173.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -67.72 156.98 35.7 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 120.805 2.302 . . . . 24.47 112.324 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -83.53 141.65 31.46 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 116.282 -2.167 . . . . 35.09 110.056 175.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ILE . . . . . . . . . . . . . 56.1 mt -125.28 143.8 37.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 107.683 -1.229 . . . . 38.75 107.683 172.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' PHE . . . . . 0.401 ' CE1' ' OE1' ' B' ' 118' ' ' GLU . 97.0 m-85 -114.12 159.45 20.03 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 124.978 2.323 . . . . 34.93 114.634 -175.881 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -158.1 166.95 34.26 Favored Glycine 0 CA--C 1.54 1.647 0 N-CA-C 106.223 -2.751 . . . . 26.27 106.223 177.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.6 172.82 17.23 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.425 -1.324 . . . . 43.44 107.425 -177.695 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 161.54 -177.62 37.76 Favored Glycine 0 N--CA 1.473 1.151 0 N-CA-C 108.263 -1.935 . . . . 21.15 108.263 176.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 80.2 t -97.64 127.67 49.74 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-O 123.771 1.748 . . . . 26.11 110.027 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 63.5 tp -70.65 134.82 47.88 Favored 'General case' 0 C--O 1.246 0.891 0 O-C-N 119.249 -2.157 . . . . 17.71 113.358 -177.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -129.65 123.68 31.8 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 105.641 -1.985 . . . . 28.59 105.641 169.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 89.2 mt -92.47 130.93 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 126.13 2.144 . . . . 24.16 107.97 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 56.3 mt -93.48 -179.58 5.08 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 117.917 -1.513 . . . . 39.86 111.979 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -68.82 -25.91 64.9 Favored 'General case' 0 C--O 1.247 0.964 0 O-C-N 120.133 -1.604 . . . . 60.75 114.436 -174.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ASP . . . . . 1.028 ' OD1' ' O ' ' B' ' 159' ' ' HOH . 0.8 OUTLIER -77.0 -8.02 56.65 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 117.981 -1.488 . . . . 71.52 112.61 173.843 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.44 -10.43 57.86 Favored Glycine 0 C--O 1.244 0.773 0 CA-C-O 115.993 -2.559 . . . . 34.69 112.508 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -91.38 173.8 7.72 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 121.388 2.594 . . . . 36.47 104.963 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.12 -179.79 17.8 Favored Glycine 0 N--CA 1.5 2.959 1 C-N-CA 112.187 -4.816 . . . . 19.34 108.342 176.795 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -131.57 141.28 49.66 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 127.106 2.298 . . . . 22.08 107.275 171.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 44.6 mt -80.25 115.28 19.71 Favored 'General case' 0 C--O 1.259 1.561 0 N-CA-C 104.939 -2.245 . . . . 20.92 104.939 165.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -89.43 154.04 20.36 Favored 'General case' 0 C--O 1.257 1.454 0 C-N-CA 125.654 1.581 . . . . 22.03 112.931 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.8 -171.58 1.98 Allowed 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.3 -1.36 . . . . 40.87 110.975 171.913 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ALA . . . . . . . . . . . . . . . -118.91 177.35 4.89 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 120.939 1.699 . . . . 67.01 115.427 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 . . . . . 0 N--CA 1.441 -0.91 0 C-N-CA 131.244 3.818 . . . . 97.04 120.585 177.001 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 116.896 -1.526 . . . . 61.99 109.092 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' GLY . . . . . 0.415 ' N ' ' CD ' ' B' ' 76' ' ' PRO . . . 179.96 -44.06 0.08 OUTLIER Glycine 0 CA--C 1.501 -0.818 0 N-CA-C 117.477 1.751 . . . . 56.83 117.477 178.18 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' PRO . . . . . 0.415 ' CD ' ' N ' ' B' ' 75' ' ' GLY . 6.9 Cg_exo -67.86 -19.63 46.41 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 121.952 1.768 . . . . 47.09 113.189 -173.711 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ASP . . . . . 0.449 ' OD2' ' NZ ' ' B' ' 7' ' ' LYS . 10.3 p-10 -111.24 5.77 20.16 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-O 114.344 -2.741 . . . . 45.85 109.788 -176.853 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -52.3 152.3 3.48 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 120.906 1.685 . . . . 34.71 107.141 169.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 59.2 mt -110.75 122.84 65.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 121.047 1.749 . . . . 20.62 108.865 -175.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -64.6 136.06 56.6 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 124.281 1.033 . . . . 30.78 112.962 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 86.5 t -128.95 123.47 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 N-CA-C 105.782 -1.933 . . . . 21.06 105.782 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . 0.273 1.8 t -71.84 158.0 88.56 Favored Pre-proline 0 N--CA 1.482 1.175 0 CA-C-O 118.207 -0.902 . . . . 38.59 111.889 -173.217 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -65.99 -26.33 51.19 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.251 1.967 . . . . 26.33 111.761 173.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 27.4 p -74.08 -29.27 61.78 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 121.457 1.935 . . . . 32.24 109.818 -178.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -72.71 -43.33 63.16 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 125.337 1.648 . . . . 39.29 108.541 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ILE . . . . . . . . . . . . . 50.6 mt -53.91 -52.47 35.52 Favored 'Isoleucine or valine' 0 C--O 1.245 0.853 0 CA-C-O 123.443 1.592 . . . . 25.91 109.958 178.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -62.61 -46.02 90.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 118.161 -1.416 . . . . 80.32 114.356 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 30.1 ttt180 -59.72 -50.48 73.68 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 120.367 -1.458 . . . . 70.92 114.597 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -91.01 -4.27 56.55 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 120.829 -0.348 . . . . 47.13 110.739 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 58.82 57.45 3.64 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 124.623 2.154 . . . . 36.08 107.889 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 71.2 mt -86.78 149.62 24.73 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 113.966 -1.47 . . . . 26.24 109.282 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -136.02 164.57 27.7 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 119.715 -1.865 . . . . 44.97 110.837 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' THR . . . . . . . . . . . . . 4.3 m -63.84 130.42 44.06 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 126.184 2.177 . . . . 24.5 110.64 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 95.62 -6.58 67.8 Favored Glycine 0 N--CA 1.44 -1.072 0 CA-C-O 116.221 -2.433 . . . . 17.83 112.977 -176.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -64.22 140.18 58.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 121.335 2.568 . . . . 26.19 110.03 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 29.8 m -92.95 121.39 34.25 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 123.399 1.571 . . . . 30.43 106.902 169.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 11.9 mt -123.71 140.18 48.0 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.103 0 CA-C-O 116.747 -1.597 . . . . 34.05 112.42 -173.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' SER . . . . . 1.095 ' OG ' ' O ' ' B' ' 118' ' ' GLU . 90.8 p -129.97 154.06 47.76 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 105.133 -2.173 . . . . 45.73 105.133 172.936 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 178.87 -178.75 48.86 Favored Glycine 0 C--O 1.219 -0.79 0 C-N-CA 117.485 -2.293 . . . . 24.47 108.493 179.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 87.2 mttt -79.09 148.86 32.26 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 104.744 -2.317 . . . . 48.15 104.744 177.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 39.9 pt -127.26 164.98 26.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 O-C-N 127.393 2.933 . . . . 26.13 109.603 178.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ARG . . . . . 0.493 ' NH2' ' OE2' ' B' ' 108' ' ' GLU . 1.0 OUTLIER -130.67 164.09 44.08 Favored Pre-proline 0 C--N 1.34 0.18 0 C-N-CA 117.89 -1.524 . . . . 58.68 108.954 170.937 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -74.78 157.73 43.5 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 122.307 2.005 . . . . 32.59 109.3 176.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -60.14 145.3 98.78 Favored 'Trans proline' 0 N--CA 1.431 -2.191 0 N-CA-C 108.237 -1.486 . . . . 28.69 108.237 176.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.69 -178.44 3.65 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 114.525 -2.87 . . . . 72.84 107.584 168.952 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -48.55 125.47 9.9 Favored 'General case' 0 C--O 1.249 1.064 0 O-C-N 121.919 -0.488 . . . . 57.91 112.063 -174.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.6 -16.01 60.28 Favored Glycine 0 CA--C 1.517 0.209 0 CA-C-O 116.854 -2.081 . . . . 31.54 110.911 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' GLU . . . . . 0.493 ' OE2' ' NH2' ' B' ' 102' ' ' ARG . 61.1 mt-10 -103.67 155.04 18.88 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 117.918 -1.513 . . . . 33.38 111.12 -176.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -113.11 -9.6 13.51 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 116.834 -1.946 . . . . 29.08 111.65 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -128.94 152.74 48.24 Favored 'General case' 0 C--O 1.255 1.357 0 CA-C-N 122.76 2.527 . . . . 36.57 110.649 -169.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -57.36 146.4 29.2 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.435 -0.95 . . . . 45.55 108.435 162.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -128.4 138.64 52.43 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 108.961 -0.755 . . . . 21.39 108.961 -174.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 39.6 tp -67.15 134.29 51.48 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 108.134 -1.062 . . . . 25.99 108.134 173.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.77 -58.42 1.96 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.48 -1.236 . . . . 43.78 111.838 176.963 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -137.82 130.42 29.64 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.294 -1.743 . . . . 73.88 106.294 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' B' ' 117' ' ' ASN . 7.6 m -80.7 174.3 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 106.905 -1.517 . . . . 61.34 106.905 175.575 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ASN . . . . . 0.626 ' OD1' ' O ' ' B' ' 117' ' ' ASN . 60.5 t-20 94.92 23.51 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 112.071 -2.331 . . . . 89.87 114.654 166.588 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLU . . . . . 1.095 ' O ' ' OG ' ' B' ' 98' ' ' SER . 79.2 mt-10 . . . . . 0 C--O 1.273 2.324 0 C-N-CA 115.337 -2.545 . . . . 103.27 106.7 -175.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . 0.713 ' O ' ' SD ' ' B' ' 21' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . 0.753 ' O ' ' CD ' ' A' ' 56' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' HOH . . . . . 1.028 ' O ' ' OD1' ' B' ' 60' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.921 2 CA-C-O 108.49 -6.728 . . . . 26.88 125.532 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 0' ' ' HIS . . . . . . . . . . . . . 6.0 p-80 -85.22 -8.58 58.49 Favored 'General case' 0 N--CA 1.441 -0.91 1 CA-C-N 131.708 7.754 . . . . 32.66 113.26 177.642 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.7 mtt -92.19 122.78 35.0 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 115.208 -2.597 . . . . 29.74 110.166 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -126.57 123.27 37.31 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 105.78 -1.934 . . . . 29.76 105.78 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 39.6 tp -52.78 -40.67 63.4 Favored 'General case' 0 C--O 1.263 1.79 0 CA-C-O 123.562 1.648 . . . . 27.74 114.471 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.2 m -64.03 -43.14 96.49 Favored 'General case' 0 CA--C 1.519 -0.215 0 O-C-N 117.871 -3.018 . . . . 28.24 111.841 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 162' ' ' HOH . 42.1 mm-40 -65.4 -34.63 78.77 Favored 'General case' 0 C--O 1.239 0.543 0 O-C-N 121.813 -0.554 . . . . 76.83 112.206 176.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 71.0 mt -67.38 -36.82 82.11 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 126.402 3.001 . . . . 27.54 110.656 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . 0.837 ' NZ ' ' OD2' ' A' ' 77' ' ' ASP . 18.7 mtmt -64.51 -28.34 69.59 Favored 'General case' 0 C--N 1.342 0.256 0 O-C-N 118.193 -2.817 . . . . 59.74 110.476 179.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -92.91 3.63 55.37 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 118.683 0.674 . . . . 45.16 111.393 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 99.8 m -87.57 132.19 41.5 Favored Pre-proline 0 N--CA 1.472 0.631 0 O-C-N 119.214 -2.178 . . . . 31.44 111.129 177.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.5 143.91 43.29 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.812 2.341 . . . . 32.65 109.5 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . 0.532 HG22 ' HD2' ' A' ' 31' ' ' LYS . 5.2 t -64.67 -32.04 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 O-C-N 119.858 -1.776 . . . . 41.27 112.818 -174.184 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.7 p -62.72 -38.01 88.8 Favored 'General case' 0 C--N 1.354 0.795 0 CA-C-O 116.617 -1.658 . . . . 30.2 111.309 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -69.77 -28.88 66.13 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 115.859 1.799 . . . . 58.21 115.859 174.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.6 mt -71.37 -40.88 70.35 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 126.302 2.954 . . . . 29.33 111.043 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 84.6 mt -64.52 -41.73 93.13 Favored 'Isoleucine or valine' 0 C--O 1.246 0.876 0 C-N-CA 117.319 -1.752 . . . . 33.3 109.984 176.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -59.63 -46.11 89.97 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 118.794 -1.162 . . . . 40.27 112.243 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.8 tp -60.57 -48.65 80.84 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 124.78 2.229 . . . . 33.65 110.533 -179.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . 0.43 ' O ' ' HB2' ' A' ' 23' ' ' LEU . . . -60.95 -49.11 82.26 Favored Glycine 0 C--O 1.238 0.361 0 O-C-N 120.156 -1.59 . . . . 33.2 110.769 -177.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.51 -37.68 88.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 118.539 -1.264 . . . . 47.11 110.269 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -61.49 -33.79 74.38 Favored 'General case' 0 C--O 1.252 1.192 0 N-CA-C 113.813 1.042 . . . . 66.38 113.813 174.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 98.0 mtp -74.67 -2.89 28.26 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 120.751 -1.218 . . . . 32.78 112.825 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.0 12.22 50.37 Favored Glycine 0 N--CA 1.461 0.318 0 CA-C-O 123.227 1.459 . . . . 38.91 109.754 174.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 9.0 mt -82.83 123.61 29.52 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 105.698 -1.964 . . . . 55.67 105.698 -176.86 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . 0.603 ' OE1' ' N ' ' A' ' 24' ' ' GLU . 20.2 mp0 -95.0 132.8 39.46 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 123.874 1.797 . . . . 85.89 114.484 -171.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 31.59 86.65 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 126.957 3.265 . . . . 85.57 114.339 -175.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 68.0 mt -84.83 -16.21 42.16 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 111.097 -2.774 . . . . 47.28 107.362 167.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.2 -23.73 62.52 Favored 'General case' 0 C--O 1.248 0.998 0 N-CA-C 115.967 1.84 . . . . 44.86 115.967 -176.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . 0.718 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -86.92 -6.79 58.66 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 121.543 1.974 . . . . 90.3 113.893 170.45 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 11.7 mtp -91.82 156.1 17.75 Favored 'General case' 0 CA--C 1.501 -0.942 0 O-C-N 120.175 -1.578 . . . . 49.24 114.372 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.1 mtt180 -63.85 146.02 54.74 Favored 'General case' 0 N--CA 1.434 -1.227 0 O-C-N 120.008 -1.682 . . . . 80.38 109.043 163.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . 0.532 ' HD2' HG22 ' A' ' 11' ' ' VAL . 80.2 tttt -48.53 -49.58 35.61 Favored 'General case' 0 C--O 1.253 1.243 0 C-N-CA 126.191 1.796 . . . . 34.34 112.892 179.465 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLN . . . . . 0.688 ' OE1' ' HB2' ' A' ' 76' ' ' PRO . 4.9 tt0 -55.98 -38.74 70.83 Favored 'General case' 0 N--CA 1.507 2.392 0 CA-C-O 124.447 2.07 . . . . 54.81 113.997 176.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -73.03 -38.19 66.63 Favored 'General case' 0 C--O 1.244 0.807 0 O-C-N 117.882 -3.011 . . . . 38.59 111.44 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 76.7 mt -56.83 -47.7 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 O-C-N 119.723 -1.861 . . . . 25.21 110.148 174.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.7 mt -53.84 -50.66 50.93 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.874 0 O-C-N 119.459 -2.026 . . . . 24.93 111.984 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -58.2 -46.95 84.9 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 125.085 2.374 . . . . 44.08 113.532 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.54 -48.61 66.0 Favored 'General case' 0 C--O 1.212 -0.889 0 O-C-N 120.082 -1.636 . . . . 24.82 111.16 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.6 mt -62.33 -48.92 86.09 Favored 'Isoleucine or valine' 0 C--N 1.348 0.526 0 CA-C-O 118.661 -0.685 . . . . 28.1 111.512 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 77.5 mt -61.71 -42.44 98.95 Favored 'General case' 0 C--O 1.253 1.253 0 C-N-CA 117.935 -1.506 . . . . 20.77 112.366 -176.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -60.12 -43.55 95.57 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 123.285 1.517 . . . . 39.32 111.956 -178.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 62.0 tp60 -68.0 -46.32 71.62 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.19 1.472 . . . . 52.45 108.717 -178.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -61.6 -36.73 81.53 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.517 -1.365 . . . . 30.14 111.978 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.64 -26.22 68.52 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 120.202 -1.561 . . . . 25.67 114.357 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -63.42 -19.54 64.78 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 116.402 2.001 . . . . 51.42 116.402 175.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 64.9 p -79.75 -5.91 56.21 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 119.716 -1.865 . . . . 24.89 113.714 172.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.74 -3.7 81.42 Favored Glycine 0 C--N 1.346 1.13 0 CA-C-N 120.107 1.321 . . . . 25.37 113.848 -176.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -69.86 150.81 46.41 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 119.053 1.427 . . . . 28.5 113.554 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -76.66 140.2 40.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 123.856 1.789 . . . . 33.18 112.028 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.45 144.7 37.16 Favored 'Isoleucine or valine' 0 C--N 1.342 0.25 0 CA-C-O 116.145 -1.883 . . . . 40.14 106.095 174.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PHE . . . . . 0.421 ' HE1' ' HB3' ' A' ' 118' ' ' GLU . 95.7 m-85 -117.59 165.93 12.99 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-O 124.105 1.907 . . . . 31.49 115.215 -173.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -158.6 167.3 34.6 Favored Glycine 0 CA--C 1.543 1.793 0 N-CA-C 104.938 -3.265 . . . . 20.48 104.938 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -161.39 160.43 29.48 Favored 'General case' 0 C--O 1.245 0.832 0 C-N-CA 118.317 -1.353 . . . . 35.52 107.976 -178.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.12 -176.43 46.54 Favored Glycine 0 N--CA 1.48 1.582 0 N-CA-C 107.624 -2.19 . . . . 21.14 107.624 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.64 122.84 63.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 C-N-CA 126.162 1.785 . . . . 26.12 106.775 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . 0.514 HD21 HD11 ' A' ' 57' ' ' ILE . 35.2 tp -72.51 135.69 45.72 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 118.676 -1.21 . . . . 22.15 114.045 -176.535 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . 0.753 ' CD ' ' O ' ' A' ' 147' ' ' HOH . 39.0 mt-10 -129.79 129.47 44.11 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 113.322 -1.763 . . . . 53.48 110.759 163.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . 0.514 HD11 HD21 ' A' ' 55' ' ' LEU . 40.5 mm -98.03 130.33 46.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 O-C-N 125.486 1.741 . . . . 38.67 106.609 -176.016 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . 0.567 HD12 ' CE1' ' A' ' 62' ' ' PHE . 93.8 mt -96.69 172.68 7.75 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.082 -0.963 . . . . 45.95 110.288 -176.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.3 mp0 -61.45 -32.0 71.97 Favored 'General case' 0 C--O 1.253 1.258 0 N-CA-C 114.464 1.283 . . . . 34.73 114.464 -175.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -74.83 -2.0 24.76 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.176 1.176 . . . . 49.77 114.176 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.06 -10.46 69.95 Favored Glycine 0 CA--C 1.536 1.38 0 CA-C-O 114.916 -3.158 . . . . 30.99 113.801 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PHE . . . . . 0.567 ' CE1' HD12 ' A' ' 58' ' ' LEU . 43.2 p90 -91.01 174.21 7.54 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 116.917 -1.913 . . . . 34.78 107.544 175.059 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.43 172.57 23.2 Favored Glycine 0 C--O 1.216 -0.994 0 C-N-CA 117.459 -2.305 . . . . 19.36 113.485 173.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -122.5 147.84 45.88 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 115.295 -0.452 . . . . 24.03 110.35 167.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . 0.417 ' HB2' ' HB ' ' A' ' 79' ' ' ILE . 0.0 OUTLIER -90.96 110.43 21.68 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 126.866 2.604 . . . . 27.88 108.26 167.988 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -89.12 155.78 19.22 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 117.41 -1.281 . . . . 28.77 111.339 -175.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.5 m -69.21 127.39 32.9 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.001 -1.481 . . . . 54.12 107.001 171.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 118.82 0.736 . . . . 59.6 111.082 -179.86 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 122.931 1.348 . . . . 74.45 108.181 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -45.44 -51.86 9.27 Favored Glycine 0 N--CA 1.424 -2.109 1 N-CA-C 125.38 4.912 . . . . 61.92 125.38 -177.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . 0.688 ' HB2' ' OE1' ' A' ' 32' ' ' GLN . 39.2 Cg_exo -55.33 -22.3 32.85 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.893 1.729 . . . . 43.84 115.755 -168.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . 0.837 ' OD2' ' NZ ' ' A' ' 7' ' ' LYS . 4.7 p-10 -110.7 13.62 22.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 119.38 -2.075 . . . . 64.55 111.712 177.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -62.46 145.6 53.71 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 124.786 1.304 . . . . 35.03 107.653 167.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ILE . . . . . 0.417 ' HB ' ' HB2' ' A' ' 65' ' ' LEU . 55.2 mt -100.74 125.09 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-O 118.254 -0.879 . . . . 23.32 109.046 -177.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -70.59 139.06 51.35 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-O 124.573 2.13 . . . . 34.39 112.888 176.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 46.3 t -129.23 121.11 52.98 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 O-C-N 118.135 -2.853 . . . . 22.0 105.966 -176.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 83.0 p -75.72 161.39 76.26 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 117.572 -1.651 . . . . 26.62 111.617 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.09 -38.28 87.22 Favored 'Trans proline' 0 N--CA 1.446 -1.265 0 C-N-CA 123.325 2.683 . . . . 27.26 114.378 167.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -34.48 64.94 Favored 'General case' 0 CA--C 1.492 -1.281 0 CA-C-N 120.93 1.695 . . . . 44.71 111.022 -174.38 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -65.17 -45.32 85.39 Favored 'General case' 0 C--N 1.374 1.633 0 CA-C-O 116.663 -1.637 . . . . 37.35 108.678 175.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . 0.684 HD13 HD12 ' A' ' 91' ' ' LEU . 24.9 mm -58.07 -44.87 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 118.074 -1.45 . . . . 37.68 109.483 -177.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.67 -36.42 57.31 Favored 'General case' 0 C--N 1.369 1.444 0 C-N-CA 116.416 -2.113 . . . . 38.21 114.425 -175.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.62 -32.1 70.6 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 116.111 1.893 . . . . 77.88 116.111 178.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -106.25 8.14 31.77 Favored 'General case' 0 C--N 1.347 0.5 0 O-C-N 120.4 -1.437 . . . . 41.8 112.976 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 54.37 53.29 11.07 Favored 'General case' 0 CA--C 1.551 0.989 0 O-C-N 125.015 1.447 . . . . 26.63 112.232 176.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . 0.684 HD12 HD13 ' A' ' 86' ' ' ILE . 11.8 mt -91.23 146.37 23.88 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 118.005 -0.997 . . . . 23.47 109.776 178.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 -134.79 153.7 51.91 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 117.67 -1.157 . . . . 36.67 108.808 -168.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.3 m -51.42 123.8 10.56 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 126.267 2.229 . . . . 27.29 114.411 173.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 96.28 -0.75 62.08 Favored Glycine 0 C--N 1.341 0.847 0 CA-C-O 115.763 -2.687 . . . . 20.42 113.011 176.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -67.23 146.51 54.1 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 106.591 -1.633 . . . . 19.51 106.591 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 40.5 m -94.14 117.5 30.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 107.09 -1.448 . . . . 32.3 107.09 169.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 8.4 mt -116.06 137.77 48.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 126.828 2.58 . . . . 30.99 112.406 -172.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.3 m -122.79 150.04 43.33 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 125.478 1.736 . . . . 43.88 108.695 168.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . 0.568 ' HA2' ' OE1' ' A' ' 118' ' ' GLU . . . -175.26 175.77 47.19 Favored Glycine 0 N--CA 1.477 1.369 0 C-N-CA 116.367 -2.825 . . . . 21.87 107.351 174.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . 0.481 ' NZ ' ' NZ ' ' A' ' 115' ' ' LYS . 52.5 mttt -75.73 129.62 37.37 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 105.494 -2.039 . . . . 49.27 105.494 175.634 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 15.6 pt -116.34 167.12 9.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 O-C-N 125.547 1.78 . . . . 21.79 108.81 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 47.8 ptt85 -136.05 146.24 55.77 Favored Pre-proline 0 C--N 1.303 -1.426 0 CA-C-O 122.423 1.106 . . . . 33.09 109.696 172.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.19 156.07 42.13 Favored 'Trans proline' 0 N--CA 1.444 -1.422 0 C-N-CA 122.733 2.289 . . . . 34.89 111.037 172.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -63.27 137.7 62.33 Favored 'Trans proline' 0 C--N 1.331 -0.343 0 C-N-CA 120.89 1.06 . . . . 26.46 109.964 179.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.0 pttt -88.33 -166.64 1.64 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 112.817 -3.553 . . . . 59.28 105.962 168.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -65.11 129.31 39.23 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 120.412 -1.43 . . . . 74.29 113.889 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.58 -24.83 27.59 Favored Glycine 0 N--CA 1.47 0.91 0 CA-C-O 116.847 -2.085 . . . . 39.28 108.055 -179.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -98.28 158.93 15.27 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 124.388 2.042 . . . . 35.36 108.978 -175.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.3 mtp85 -120.12 -14.94 8.79 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.583 -1.189 . . . . 26.71 109.466 -174.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -128.02 147.12 50.5 Favored 'General case' 0 C--O 1.254 1.312 0 CA-C-N 120.331 1.423 . . . . 28.06 111.002 -170.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -54.42 152.73 6.21 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 105.988 -1.856 . . . . 35.5 105.988 167.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -135.35 140.32 44.95 Favored 'General case' 0 N--CA 1.441 -0.891 0 O-C-N 119.591 -1.943 . . . . 21.48 109.744 -176.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . 0.802 HD21 HG23 ' A' ' 116' ' ' VAL . 20.0 tp -65.13 130.81 44.72 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 114.032 -1.44 . . . . 27.26 108.458 177.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 9.6 tp -101.35 -51.58 3.45 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 125.224 1.577 . . . . 33.42 111.485 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . 1.225 ' HB2' ' OE2' ' A' ' 118' ' ' GLU . 23.2 mttt -138.05 133.07 33.09 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 105.331 -2.1 . . . . 64.49 105.331 -177.599 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' VAL . . . . . 0.802 HG23 HD21 ' A' ' 113' ' ' LEU . 2.3 t -83.61 154.13 3.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 124.672 2.177 . . . . 45.08 106.91 173.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . 0.301 54.2 t30 65.94 67.4 0.48 Allowed 'General case' 0 N--CA 1.422 -1.834 1 CA-C-N 108.315 -4.039 . . . . 83.47 110.119 164.171 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . 1.225 ' OE2' ' HB2' ' A' ' 115' ' ' LYS . 43.1 mp0 . . . . . 0 C--O 1.249 1.042 4 O-C-N 138.286 9.741 . . . . 101.29 103.997 168.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.53 0 N-CA-C 115.006 0.762 . . . . 34.24 115.006 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -95.75 -8.71 33.71 Favored 'General case' 0 N--CA 1.436 -1.141 1 O-C-N 115.987 -4.243 . . . . 31.83 116.409 -179.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.4 mtt -89.46 123.76 33.88 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 122.667 1.222 . . . . 29.75 107.98 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -128.57 127.97 43.34 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 111.552 -2.567 . . . . 35.08 105.667 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 53.1 tp -59.66 -39.45 84.47 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.554 1.525 . . . . 26.5 114.325 -175.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 54.6 m -60.3 -47.15 87.24 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 124.342 2.02 . . . . 33.1 111.591 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.08 -43.01 86.78 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 113.93 -1.486 . . . . 65.76 113.497 179.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.3 mt -68.24 -30.84 69.98 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 122.455 1.121 . . . . 36.68 111.808 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LYS . . . . . 0.461 ' HD3' ' OD2' ' B' ' 77' ' ' ASP . 35.5 mtmt -70.95 -27.29 63.64 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 118.603 -2.56 . . . . 59.7 110.094 176.15 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -96.91 17.92 15.76 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 115.359 -2.258 . . . . 47.62 111.715 175.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 97.2 m -100.5 129.8 27.04 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 121.8 2.091 . . . . 34.79 110.135 174.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -51.6 146.4 26.71 Favored 'Trans proline' 0 N--CA 1.437 -1.82 0 C-N-CA 122.987 2.458 . . . . 34.17 111.001 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -34.48 64.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 114.099 1.148 . . . . 39.96 114.099 -176.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 5.6 p -54.63 -46.25 73.88 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-N 118.29 0.495 . . . . 42.95 110.942 173.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -67.73 -33.23 74.45 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 116.637 -2.025 . . . . 42.91 111.428 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 41.7 mt -67.45 -40.75 85.42 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 116.887 -1.925 . . . . 27.7 112.822 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 94.8 mt -61.38 -41.77 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 CA-C-N 114.936 -1.029 . . . . 34.58 109.002 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 89.6 m -58.33 -50.97 71.75 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 117.8 -1.56 . . . . 41.31 109.272 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . 0.51 ' O ' ' HE2' ' B' ' 21' ' ' MET . 42.9 tp -59.41 -47.53 85.11 Favored 'General case' 0 C--O 1.244 0.77 0 O-C-N 120.583 -1.323 . . . . 36.16 111.188 178.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLY . . . . . 0.461 ' HA3' ' CD1' ' B' ' 26' ' ' LEU . . . -62.8 -47.93 85.1 Favored Glycine 0 C--O 1.219 -0.802 0 CA-C-O 124.359 2.088 . . . . 31.07 111.342 -176.006 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -66.69 -27.89 68.01 Favored 'General case' 0 C--O 1.255 1.342 0 O-C-N 118.967 -2.49 . . . . 62.52 111.831 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -66.16 -29.26 69.52 Favored 'General case' 0 C--O 1.247 0.924 0 N-CA-C 114.968 1.47 . . . . 58.5 114.968 170.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' MET . . . . . 0.713 ' SD ' ' O ' ' A' ' 143' ' ' HOH . 54.5 mtm -82.4 -2.46 53.14 Favored 'General case' 0 C--O 1.236 0.346 0 O-C-N 121.01 -1.056 . . . . 46.27 112.842 174.634 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.55 16.27 34.79 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-O 118.094 -1.392 . . . . 40.74 112.286 176.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 93.6 mt -88.74 168.23 12.66 Favored 'General case' 0 C--O 1.209 -1.038 1 CA-C-O 129.116 4.293 . . . . 56.51 118.947 -175.676 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLU . . . . . 0.554 ' O ' ' HG3' ' B' ' 24' ' ' GLU . 20.0 tp10 -82.43 90.07 6.68 Favored 'General case' 0 N--CA 1.411 -2.391 3 C-N-CA 145.034 9.334 . . . . 100.67 122.271 -163.169 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ASN . . . . . 0.747 ' O ' ' HG3' ' B' ' 29' ' ' MET . 86.7 m-20 26.06 68.08 0.05 Allowed 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 125.858 2.742 . . . . 89.76 112.658 176.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . 0.468 ' HB3' HG12 ' B' ' 34' ' ' ILE . 11.3 mt -68.06 -29.87 68.94 Favored 'General case' 0 C--O 1.217 -0.658 1 CA-C-N 105.332 -5.395 . . . . 63.74 103.269 167.749 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -44.72 -53.13 7.65 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 126.292 1.837 . . . . 68.65 113.17 176.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -91.17 -4.24 56.31 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 115.481 1.66 . . . . 83.75 115.481 177.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' MET . . . . . 0.747 ' HG3' ' O ' ' B' ' 25' ' ' ASN . 7.0 mtm -87.66 161.18 17.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 123.197 1.475 . . . . 47.19 112.222 -175.121 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.09 160.48 32.81 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.537 -0.912 . . . . 74.18 108.537 176.015 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -59.08 -48.02 83.11 Favored 'General case' 0 C--N 1.321 -0.642 0 O-C-N 120.73 -1.231 . . . . 34.44 111.087 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLN . . . . . 0.679 HE22 ' HG2' ' B' ' 76' ' ' PRO . 8.4 tt0 -56.32 -41.13 75.51 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 115.021 1.489 . . . . 58.19 115.021 175.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -70.44 -29.55 66.16 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 117.889 -3.007 . . . . 41.31 111.67 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ILE . . . . . 0.468 HG12 ' HB3' ' B' ' 26' ' ' LEU . 59.1 mt -66.47 -43.88 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 123.206 1.479 . . . . 30.72 107.833 178.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 37.6 mt -63.24 -41.08 91.48 Favored 'Isoleucine or valine' 0 C--O 1.251 1.17 0 CA-C-O 124.385 2.04 . . . . 27.76 109.386 -176.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -63.62 -41.29 98.3 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 117.67 -1.612 . . . . 55.76 113.65 176.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.23 -45.97 92.36 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.724 0.773 . . . . 26.4 110.03 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ILE . . . . . 0.561 HG23 ' HE1' ' B' ' 21' ' ' MET . 87.4 mt -59.2 -51.1 76.63 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 CA-C-O 118.336 -0.84 . . . . 28.86 110.254 175.685 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LEU . . . . . 0.585 HD22 HG21 ' B' ' 49' ' ' ILE . 85.3 mt -68.01 -39.04 83.26 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 122.34 2.336 . . . . 34.52 113.67 -176.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -60.5 -45.97 91.84 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 121.151 -0.968 . . . . 39.68 108.655 -179.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 -66.37 -43.16 86.74 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 117.886 -1.525 . . . . 46.26 110.879 -175.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 42.1 t60 -64.57 -35.73 81.93 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.592 -0.731 . . . . 26.91 112.346 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.77 -23.12 67.15 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.644 0.735 . . . . 27.17 112.85 179.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -64.93 -22.42 66.99 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 119.143 -2.223 . . . . 47.06 114.908 178.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 89.7 p -74.3 -9.15 58.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 119.375 0.989 . . . . 24.26 111.824 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.82 7.86 85.16 Favored Glycine 0 CA--C 1.532 1.118 0 CA-C-O 115.167 -3.018 . . . . 25.73 109.973 -173.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -67.72 156.98 35.7 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 120.805 2.302 . . . . 24.47 112.324 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -83.53 141.65 31.46 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 116.282 -2.167 . . . . 35.09 110.056 175.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ILE . . . . . 0.585 HG21 HD22 ' B' ' 39' ' ' LEU . 56.1 mt -125.28 143.8 37.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 107.683 -1.229 . . . . 38.75 107.683 172.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' PHE . . . . . 0.413 ' HE1' ' OE1' ' B' ' 118' ' ' GLU . 97.0 m-85 -114.12 159.45 20.03 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 124.978 2.323 . . . . 34.93 114.634 -175.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -158.1 166.95 34.26 Favored Glycine 0 CA--C 1.54 1.647 0 N-CA-C 106.223 -2.751 . . . . 26.27 106.223 177.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.6 172.82 17.23 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.425 -1.324 . . . . 43.44 107.425 -177.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 161.54 -177.62 37.76 Favored Glycine 0 N--CA 1.473 1.151 0 N-CA-C 108.263 -1.935 . . . . 21.15 108.263 176.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 80.2 t -97.64 127.67 49.74 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-O 123.771 1.748 . . . . 26.11 110.027 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' LEU . . . . . 0.54 ' HB2' HD12 ' B' ' 97' ' ' ILE . 63.5 tp -70.65 134.82 47.88 Favored 'General case' 0 C--O 1.246 0.891 0 O-C-N 119.249 -2.157 . . . . 17.71 113.358 -177.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -129.65 123.68 31.8 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 105.641 -1.985 . . . . 28.59 105.641 169.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 89.2 mt -92.47 130.93 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 126.13 2.144 . . . . 24.16 107.97 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 56.3 mt -93.48 -179.58 5.08 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 117.917 -1.513 . . . . 39.86 111.979 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLN . . . . . 0.553 ' HG3' ' O ' ' B' ' 126' ' ' HOH . 41.6 mt-30 -68.82 -25.91 64.9 Favored 'General case' 0 C--O 1.247 0.964 0 O-C-N 120.133 -1.604 . . . . 60.75 114.436 -174.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ASP . . . . . 1.028 ' OD1' ' O ' ' B' ' 159' ' ' HOH . 0.8 OUTLIER -77.0 -8.02 56.65 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 117.981 -1.488 . . . . 71.52 112.61 173.843 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.44 -10.43 57.86 Favored Glycine 0 C--O 1.244 0.773 0 CA-C-O 115.993 -2.559 . . . . 34.69 112.508 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -91.38 173.8 7.72 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 121.388 2.594 . . . . 36.47 104.963 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.12 -179.79 17.8 Favored Glycine 0 N--CA 1.5 2.959 1 C-N-CA 112.187 -4.816 . . . . 19.34 108.342 176.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -131.57 141.28 49.66 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 127.106 2.298 . . . . 22.08 107.275 171.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 44.6 mt -80.25 115.28 19.71 Favored 'General case' 0 C--O 1.259 1.561 0 N-CA-C 104.939 -2.245 . . . . 20.92 104.939 165.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -89.43 154.04 20.36 Favored 'General case' 0 C--O 1.257 1.454 0 C-N-CA 125.654 1.581 . . . . 22.03 112.931 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.8 -171.58 1.98 Allowed 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.3 -1.36 . . . . 40.87 110.975 171.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ALA . . . . . . . . . . . . . . . -118.91 177.35 4.89 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 120.939 1.699 . . . . 67.01 115.427 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 . . . . . 0 N--CA 1.441 -0.91 0 C-N-CA 131.244 3.818 . . . . 97.04 120.585 177.001 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 116.896 -1.526 . . . . 61.99 109.092 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 75' ' ' GLY . . . . . 0.415 ' N ' ' CD ' ' B' ' 76' ' ' PRO . . . 179.96 -44.06 0.08 OUTLIER Glycine 0 CA--C 1.501 -0.818 0 N-CA-C 117.477 1.751 . . . . 56.83 117.477 178.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' PRO . . . . . 0.679 ' HG2' HE22 ' B' ' 32' ' ' GLN . 6.9 Cg_exo -67.86 -19.63 46.41 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 121.952 1.768 . . . . 47.09 113.189 -173.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ASP . . . . . 0.461 ' OD2' ' HD3' ' B' ' 7' ' ' LYS . 10.3 p-10 -111.24 5.77 20.16 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-O 114.344 -2.741 . . . . 45.85 109.788 -176.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -52.3 152.3 3.48 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 120.906 1.685 . . . . 34.71 107.141 169.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 59.2 mt -110.75 122.84 65.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 121.047 1.749 . . . . 20.62 108.865 -175.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -64.6 136.06 56.6 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 124.281 1.033 . . . . 30.78 112.962 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 86.5 t -128.95 123.47 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 N-CA-C 105.782 -1.933 . . . . 21.06 105.782 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . 0.273 1.8 t -71.84 158.0 88.56 Favored Pre-proline 0 N--CA 1.482 1.175 0 CA-C-O 118.207 -0.902 . . . . 38.59 111.889 -173.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -65.99 -26.33 51.19 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.251 1.967 . . . . 26.33 111.761 173.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 27.4 p -74.08 -29.27 61.78 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 121.457 1.935 . . . . 32.24 109.818 -178.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -72.71 -43.33 63.16 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 125.337 1.648 . . . . 39.29 108.541 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ILE . . . . . . . . . . . . . 50.6 mt -53.91 -52.47 35.52 Favored 'Isoleucine or valine' 0 C--O 1.245 0.853 0 CA-C-O 123.443 1.592 . . . . 25.91 109.958 178.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -62.61 -46.02 90.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 118.161 -1.416 . . . . 80.32 114.356 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 30.1 ttt180 -59.72 -50.48 73.68 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 120.367 -1.458 . . . . 70.92 114.597 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -91.01 -4.27 56.55 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 120.829 -0.348 . . . . 47.13 110.739 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 58.82 57.45 3.64 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 124.623 2.154 . . . . 36.08 107.889 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 71.2 mt -86.78 149.62 24.73 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 113.966 -1.47 . . . . 26.24 109.282 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -136.02 164.57 27.7 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 119.715 -1.865 . . . . 44.97 110.837 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' THR . . . . . . . . . . . . . 4.3 m -63.84 130.42 44.06 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 126.184 2.177 . . . . 24.5 110.64 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 95.62 -6.58 67.8 Favored Glycine 0 N--CA 1.44 -1.072 0 CA-C-O 116.221 -2.433 . . . . 17.83 112.977 -176.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -64.22 140.18 58.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 121.335 2.568 . . . . 26.19 110.03 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 29.8 m -92.95 121.39 34.25 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 123.399 1.571 . . . . 30.43 106.902 169.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ILE . . . . . 0.54 HD12 ' HB2' ' B' ' 55' ' ' LEU . 11.9 mt -123.71 140.18 48.0 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.103 0 CA-C-O 116.747 -1.597 . . . . 34.05 112.42 -173.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' SER . . . . . 1.095 ' OG ' ' O ' ' B' ' 118' ' ' GLU . 90.8 p -129.97 154.06 47.76 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 105.133 -2.173 . . . . 45.73 105.133 172.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 178.87 -178.75 48.86 Favored Glycine 0 C--O 1.219 -0.79 0 C-N-CA 117.485 -2.293 . . . . 24.47 108.493 179.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 87.2 mttt -79.09 148.86 32.26 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 104.744 -2.317 . . . . 48.15 104.744 177.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 39.9 pt -127.26 164.98 26.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 O-C-N 127.393 2.933 . . . . 26.13 109.603 178.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ARG . . . . . 0.493 ' NH2' ' OE2' ' B' ' 108' ' ' GLU . 1.0 OUTLIER -130.67 164.09 44.08 Favored Pre-proline 0 C--N 1.34 0.18 0 C-N-CA 117.89 -1.524 . . . . 58.68 108.954 170.937 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 103' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -74.78 157.73 43.5 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 122.307 2.005 . . . . 32.59 109.3 176.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -60.14 145.3 98.78 Favored 'Trans proline' 0 N--CA 1.431 -2.191 0 N-CA-C 108.237 -1.486 . . . . 28.69 108.237 176.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.69 -178.44 3.65 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 114.525 -2.87 . . . . 72.84 107.584 168.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -48.55 125.47 9.9 Favored 'General case' 0 C--O 1.249 1.064 0 O-C-N 121.919 -0.488 . . . . 57.91 112.063 -174.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.6 -16.01 60.28 Favored Glycine 0 CA--C 1.517 0.209 0 CA-C-O 116.854 -2.081 . . . . 31.54 110.911 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' GLU . . . . . 0.493 ' OE2' ' NH2' ' B' ' 102' ' ' ARG . 61.1 mt-10 -103.67 155.04 18.88 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 117.918 -1.513 . . . . 33.38 111.12 -176.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -113.11 -9.6 13.51 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 116.834 -1.946 . . . . 29.08 111.65 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -128.94 152.74 48.24 Favored 'General case' 0 C--O 1.255 1.357 0 CA-C-N 122.76 2.527 . . . . 36.57 110.649 -169.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -57.36 146.4 29.2 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.435 -0.95 . . . . 45.55 108.435 162.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -128.4 138.64 52.43 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 108.961 -0.755 . . . . 21.39 108.961 -174.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' LEU . . . . . 0.454 HD21 HG12 ' B' ' 116' ' ' VAL . 39.6 tp -67.15 134.29 51.48 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 108.134 -1.062 . . . . 25.99 108.134 173.551 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.77 -58.42 1.96 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.48 -1.236 . . . . 43.78 111.838 176.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -137.82 130.42 29.64 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.294 -1.743 . . . . 73.88 106.294 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' B' ' 117' ' ' ASN . 7.6 m -80.7 174.3 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 106.905 -1.517 . . . . 61.34 106.905 175.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ASN . . . . . 0.626 ' OD1' ' O ' ' B' ' 117' ' ' ASN . 60.5 t-20 94.92 23.51 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 112.071 -2.331 . . . . 89.87 114.654 166.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLU . . . . . 1.095 ' O ' ' OG ' ' B' ' 98' ' ' SER . 79.2 mt-10 . . . . . 0 C--O 1.273 2.324 0 C-N-CA 115.337 -2.545 . . . . 103.27 106.7 -175.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 119' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . 0.713 ' O ' ' SD ' ' B' ' 21' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . 0.753 ' O ' ' CD ' ' A' ' 56' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . 0.656 ' O ' ' HG3' ' A' ' 5' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 126' ' ' HOH . . . . . 0.553 ' O ' ' HG3' ' B' ' 59' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 159' ' ' HOH . . . . . 1.028 ' O ' ' OD1' ' B' ' 60' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.921 2 CA-C-O 108.49 -6.728 . . . . 26.88 125.532 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' HIS . . . . . . . . . . . . . 6.0 p-80 -85.22 -8.58 58.49 Favored 'General case' 0 N--CA 1.441 -0.91 1 CA-C-N 131.708 7.754 . . . . 32.66 113.26 177.642 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.7 mtt -92.19 122.78 35.0 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 115.208 -2.597 . . . . 29.74 110.166 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -126.57 123.27 37.31 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 105.78 -1.934 . . . . 29.76 105.78 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 39.6 tp -52.78 -40.67 63.4 Favored 'General case' 0 C--O 1.263 1.79 0 CA-C-O 123.562 1.648 . . . . 27.74 114.471 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.2 m -64.03 -43.14 96.49 Favored 'General case' 0 CA--C 1.519 -0.215 0 O-C-N 117.871 -3.018 . . . . 28.24 111.841 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 162' ' ' HOH . 42.1 mm-40 -65.4 -34.63 78.77 Favored 'General case' 0 C--O 1.239 0.543 0 O-C-N 121.813 -0.554 . . . . 76.83 112.206 176.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 71.0 mt -67.38 -36.82 82.11 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 126.402 3.001 . . . . 27.54 110.656 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.837 ' NZ ' ' OD2' ' A' ' 77' ' ' ASP . 18.7 mtmt -64.51 -28.34 69.59 Favored 'General case' 0 C--N 1.342 0.256 0 O-C-N 118.193 -2.817 . . . . 59.74 110.476 179.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -92.91 3.63 55.37 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 118.683 0.674 . . . . 45.16 111.393 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 99.8 m -87.57 132.19 41.5 Favored Pre-proline 0 N--CA 1.472 0.631 0 O-C-N 119.214 -2.178 . . . . 31.44 111.129 177.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -52.5 143.91 43.29 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.812 2.341 . . . . 32.65 109.5 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.532 HG22 ' HD2' ' A' ' 31' ' ' LYS . 5.2 t -64.67 -32.04 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 O-C-N 119.858 -1.776 . . . . 41.27 112.818 -174.184 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.7 p -62.72 -38.01 88.8 Favored 'General case' 0 C--N 1.354 0.795 0 CA-C-O 116.617 -1.658 . . . . 30.2 111.309 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -69.77 -28.88 66.13 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 115.859 1.799 . . . . 58.21 115.859 174.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.6 mt -71.37 -40.88 70.35 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 126.302 2.954 . . . . 29.33 111.043 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 84.6 mt -64.52 -41.73 93.13 Favored 'Isoleucine or valine' 0 C--O 1.246 0.876 0 C-N-CA 117.319 -1.752 . . . . 33.3 109.984 176.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -59.63 -46.11 89.97 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 118.794 -1.162 . . . . 40.27 112.243 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.8 tp -60.57 -48.65 80.84 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 124.78 2.229 . . . . 33.65 110.533 -179.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.43 ' O ' ' HB2' ' A' ' 23' ' ' LEU . . . -60.95 -49.11 82.26 Favored Glycine 0 C--O 1.238 0.361 0 O-C-N 120.156 -1.59 . . . . 33.2 110.769 -177.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.51 -37.68 88.25 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 118.539 -1.264 . . . . 47.11 110.269 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -61.49 -33.79 74.38 Favored 'General case' 0 C--O 1.252 1.192 0 N-CA-C 113.813 1.042 . . . . 66.38 113.813 174.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 98.0 mtp -74.67 -2.89 28.26 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 120.751 -1.218 . . . . 32.78 112.825 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.0 12.22 50.37 Favored Glycine 0 N--CA 1.461 0.318 0 CA-C-O 123.227 1.459 . . . . 38.91 109.754 174.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 9.0 mt -82.83 123.61 29.52 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 105.698 -1.964 . . . . 55.67 105.698 -176.86 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.603 ' OE1' ' N ' ' A' ' 24' ' ' GLU . 20.2 mp0 -95.0 132.8 39.46 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 123.874 1.797 . . . . 85.89 114.484 -171.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 31.59 86.65 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 126.957 3.265 . . . . 85.57 114.339 -175.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 68.0 mt -84.83 -16.21 42.16 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 111.097 -2.774 . . . . 47.28 107.362 167.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.2 -23.73 62.52 Favored 'General case' 0 C--O 1.248 0.998 0 N-CA-C 115.967 1.84 . . . . 44.86 115.967 -176.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.718 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -86.92 -6.79 58.66 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 121.543 1.974 . . . . 90.3 113.893 170.45 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 11.7 mtp -91.82 156.1 17.75 Favored 'General case' 0 CA--C 1.501 -0.942 0 O-C-N 120.175 -1.578 . . . . 49.24 114.372 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.1 mtt180 -63.85 146.02 54.74 Favored 'General case' 0 N--CA 1.434 -1.227 0 O-C-N 120.008 -1.682 . . . . 80.38 109.043 163.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.532 ' HD2' HG22 ' A' ' 11' ' ' VAL . 80.2 tttt -48.53 -49.58 35.61 Favored 'General case' 0 C--O 1.253 1.243 0 C-N-CA 126.191 1.796 . . . . 34.34 112.892 179.465 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLN . . . . . 1.063 HE22 ' HB2' ' A' ' 76' ' ' PRO . 38.4 tt0 -55.98 -38.74 70.83 Favored 'General case' 0 N--CA 1.507 2.392 0 CA-C-O 124.447 2.07 . . . . 54.81 113.997 176.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -73.03 -38.19 66.63 Favored 'General case' 0 C--O 1.244 0.807 0 O-C-N 117.882 -3.011 . . . . 38.59 111.44 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 76.7 mt -56.83 -47.7 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 O-C-N 119.723 -1.861 . . . . 25.21 110.148 174.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.7 mt -53.84 -50.66 50.93 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.874 0 O-C-N 119.459 -2.026 . . . . 24.93 111.984 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -58.2 -46.95 84.9 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 125.085 2.374 . . . . 44.08 113.532 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.54 -48.61 66.0 Favored 'General case' 0 C--O 1.212 -0.889 0 O-C-N 120.082 -1.636 . . . . 24.82 111.16 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.6 mt -62.33 -48.92 86.09 Favored 'Isoleucine or valine' 0 C--N 1.348 0.526 0 CA-C-O 118.661 -0.685 . . . . 28.1 111.512 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 77.5 mt -61.71 -42.44 98.95 Favored 'General case' 0 C--O 1.253 1.253 0 C-N-CA 117.935 -1.506 . . . . 20.77 112.366 -176.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -60.12 -43.55 95.57 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 123.285 1.517 . . . . 39.32 111.956 -178.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 62.0 tp60 -68.0 -46.32 71.62 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.19 1.472 . . . . 52.45 108.717 -178.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -61.6 -36.73 81.53 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.517 -1.365 . . . . 30.14 111.978 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.64 -26.22 68.52 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 120.202 -1.561 . . . . 25.67 114.357 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -63.42 -19.54 64.78 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 116.402 2.001 . . . . 51.42 116.402 175.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 64.9 p -79.75 -5.91 56.21 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 119.716 -1.865 . . . . 24.89 113.714 172.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.74 -3.7 81.42 Favored Glycine 0 C--N 1.346 1.13 0 CA-C-N 120.107 1.321 . . . . 25.37 113.848 -176.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -69.86 150.81 46.41 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 119.053 1.427 . . . . 28.5 113.554 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -76.66 140.2 40.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 123.856 1.789 . . . . 33.18 112.028 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.45 144.7 37.16 Favored 'Isoleucine or valine' 0 C--N 1.342 0.25 0 CA-C-O 116.145 -1.883 . . . . 40.14 106.095 174.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.421 ' HE1' ' HB3' ' A' ' 118' ' ' GLU . 95.7 m-85 -117.59 165.93 12.99 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-O 124.105 1.907 . . . . 31.49 115.215 -173.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -158.6 167.3 34.6 Favored Glycine 0 CA--C 1.543 1.793 0 N-CA-C 104.938 -3.265 . . . . 20.48 104.938 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -161.39 160.43 29.48 Favored 'General case' 0 C--O 1.245 0.832 0 C-N-CA 118.317 -1.353 . . . . 35.52 107.976 -178.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.12 -176.43 46.54 Favored Glycine 0 N--CA 1.48 1.582 0 N-CA-C 107.624 -2.19 . . . . 21.14 107.624 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.64 122.84 63.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 C-N-CA 126.162 1.785 . . . . 26.12 106.775 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.514 HD21 HD11 ' A' ' 57' ' ' ILE . 35.2 tp -72.51 135.69 45.72 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 118.676 -1.21 . . . . 22.15 114.045 -176.535 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.753 ' CD ' ' O ' ' A' ' 147' ' ' HOH . 39.0 mt-10 -129.79 129.47 44.11 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 113.322 -1.763 . . . . 53.48 110.759 163.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.514 HD11 HD21 ' A' ' 55' ' ' LEU . 40.5 mm -98.03 130.33 46.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 O-C-N 125.486 1.741 . . . . 38.67 106.609 -176.016 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.567 HD12 ' CE1' ' A' ' 62' ' ' PHE . 93.8 mt -96.69 172.68 7.75 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.082 -0.963 . . . . 45.95 110.288 -176.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.3 mp0 -61.45 -32.0 71.97 Favored 'General case' 0 C--O 1.253 1.258 0 N-CA-C 114.464 1.283 . . . . 34.73 114.464 -175.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -74.83 -2.0 24.76 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.176 1.176 . . . . 49.77 114.176 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.06 -10.46 69.95 Favored Glycine 0 CA--C 1.536 1.38 0 CA-C-O 114.916 -3.158 . . . . 30.99 113.801 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.567 ' CE1' HD12 ' A' ' 58' ' ' LEU . 43.2 p90 -91.01 174.21 7.54 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 116.917 -1.913 . . . . 34.78 107.544 175.059 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.43 172.57 23.2 Favored Glycine 0 C--O 1.216 -0.994 0 C-N-CA 117.459 -2.305 . . . . 19.36 113.485 173.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -122.5 147.84 45.88 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 115.295 -0.452 . . . . 24.03 110.35 167.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.417 ' HB2' ' HB ' ' A' ' 79' ' ' ILE . 0.0 OUTLIER -90.96 110.43 21.68 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 126.866 2.604 . . . . 27.88 108.26 167.988 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -89.12 155.78 19.22 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 117.41 -1.281 . . . . 28.77 111.339 -175.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.5 m -69.21 127.39 32.9 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.001 -1.481 . . . . 54.12 107.001 171.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 118.82 0.736 . . . . 59.6 111.082 -179.86 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 122.931 1.348 . . . . 74.45 108.181 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -45.44 -51.86 9.27 Favored Glycine 0 N--CA 1.424 -2.109 1 N-CA-C 125.38 4.912 . . . . 61.92 125.38 -177.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . 1.063 ' HB2' HE22 ' A' ' 32' ' ' GLN . 39.2 Cg_exo -55.33 -22.3 32.85 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.893 1.729 . . . . 43.84 115.755 -168.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.837 ' OD2' ' NZ ' ' A' ' 7' ' ' LYS . 4.7 p-10 -110.7 13.62 22.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 119.38 -2.075 . . . . 64.55 111.712 177.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -62.46 145.6 53.71 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 124.786 1.304 . . . . 35.03 107.653 167.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.417 ' HB ' ' HB2' ' A' ' 65' ' ' LEU . 55.2 mt -100.74 125.09 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-O 118.254 -0.879 . . . . 23.32 109.046 -177.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -70.59 139.06 51.35 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-O 124.573 2.13 . . . . 34.39 112.888 176.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 46.3 t -129.23 121.11 52.98 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 O-C-N 118.135 -2.853 . . . . 22.0 105.966 -176.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 83.0 p -75.72 161.39 76.26 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 117.572 -1.651 . . . . 26.62 111.617 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.09 -38.28 87.22 Favored 'Trans proline' 0 N--CA 1.446 -1.265 0 C-N-CA 123.325 2.683 . . . . 27.26 114.378 167.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -34.48 64.94 Favored 'General case' 0 CA--C 1.492 -1.281 0 CA-C-N 120.93 1.695 . . . . 44.71 111.022 -174.38 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -65.17 -45.32 85.39 Favored 'General case' 0 C--N 1.374 1.633 0 CA-C-O 116.663 -1.637 . . . . 37.35 108.678 175.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.684 HD13 HD12 ' A' ' 91' ' ' LEU . 24.9 mm -58.07 -44.87 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 118.074 -1.45 . . . . 37.68 109.483 -177.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.67 -36.42 57.31 Favored 'General case' 0 C--N 1.369 1.444 0 C-N-CA 116.416 -2.113 . . . . 38.21 114.425 -175.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.62 -32.1 70.6 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 116.111 1.893 . . . . 77.88 116.111 178.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -106.25 8.14 31.77 Favored 'General case' 0 C--N 1.347 0.5 0 O-C-N 120.4 -1.437 . . . . 41.8 112.976 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 54.37 53.29 11.07 Favored 'General case' 0 CA--C 1.551 0.989 0 O-C-N 125.015 1.447 . . . . 26.63 112.232 176.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.684 HD12 HD13 ' A' ' 86' ' ' ILE . 11.8 mt -91.23 146.37 23.88 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 118.005 -0.997 . . . . 23.47 109.776 178.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 -134.79 153.7 51.91 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 117.67 -1.157 . . . . 36.67 108.808 -168.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.3 m -51.42 123.8 10.56 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 126.267 2.229 . . . . 27.29 114.411 173.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 96.28 -0.75 62.08 Favored Glycine 0 C--N 1.341 0.847 0 CA-C-O 115.763 -2.687 . . . . 20.42 113.011 176.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -67.23 146.51 54.1 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 106.591 -1.633 . . . . 19.51 106.591 176.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 40.5 m -94.14 117.5 30.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 107.09 -1.448 . . . . 32.3 107.09 169.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 8.4 mt -116.06 137.77 48.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 126.828 2.58 . . . . 30.99 112.406 -172.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.3 m -122.79 150.04 43.33 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 125.478 1.736 . . . . 43.88 108.695 168.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.568 ' HA2' ' OE1' ' A' ' 118' ' ' GLU . . . -175.26 175.77 47.19 Favored Glycine 0 N--CA 1.477 1.369 0 C-N-CA 116.367 -2.825 . . . . 21.87 107.351 174.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.481 ' NZ ' ' NZ ' ' A' ' 115' ' ' LYS . 52.5 mttt -75.73 129.62 37.37 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 105.494 -2.039 . . . . 49.27 105.494 175.634 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 15.6 pt -116.34 167.12 9.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 O-C-N 125.547 1.78 . . . . 21.79 108.81 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 47.8 ptt85 -136.05 146.24 55.77 Favored Pre-proline 0 C--N 1.303 -1.426 0 CA-C-O 122.423 1.106 . . . . 33.09 109.696 172.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.19 156.07 42.13 Favored 'Trans proline' 0 N--CA 1.444 -1.422 0 C-N-CA 122.733 2.289 . . . . 34.89 111.037 172.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -63.27 137.7 62.33 Favored 'Trans proline' 0 C--N 1.331 -0.343 0 C-N-CA 120.89 1.06 . . . . 26.46 109.964 179.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.0 pttt -88.33 -166.64 1.64 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 112.817 -3.553 . . . . 59.28 105.962 168.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -65.11 129.31 39.23 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 120.412 -1.43 . . . . 74.29 113.889 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.58 -24.83 27.59 Favored Glycine 0 N--CA 1.47 0.91 0 CA-C-O 116.847 -2.085 . . . . 39.28 108.055 -179.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -98.28 158.93 15.27 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 124.388 2.042 . . . . 35.36 108.978 -175.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.3 mtp85 -120.12 -14.94 8.79 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.583 -1.189 . . . . 26.71 109.466 -174.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -128.02 147.12 50.5 Favored 'General case' 0 C--O 1.254 1.312 0 CA-C-N 120.331 1.423 . . . . 28.06 111.002 -170.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -54.42 152.73 6.21 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 105.988 -1.856 . . . . 35.5 105.988 167.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -135.35 140.32 44.95 Favored 'General case' 0 N--CA 1.441 -0.891 0 O-C-N 119.591 -1.943 . . . . 21.48 109.744 -176.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.802 HD21 HG23 ' A' ' 116' ' ' VAL . 20.0 tp -65.13 130.81 44.72 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 114.032 -1.44 . . . . 27.26 108.458 177.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 9.6 tp -101.35 -51.58 3.45 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 125.224 1.577 . . . . 33.42 111.485 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . 1.225 ' HB2' ' OE2' ' A' ' 118' ' ' GLU . 23.2 mttt -138.05 133.07 33.09 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 105.331 -2.1 . . . . 64.49 105.331 -177.599 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.802 HG23 HD21 ' A' ' 113' ' ' LEU . 2.3 t -83.61 154.13 3.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 124.672 2.177 . . . . 45.08 106.91 173.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . 0.301 2.0 t-20 65.94 67.4 0.48 Allowed 'General case' 0 N--CA 1.422 -1.834 1 CA-C-N 108.315 -4.039 . . . . 83.47 110.119 164.171 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . 1.225 ' OE2' ' HB2' ' A' ' 115' ' ' LYS . 43.1 mp0 . . . . . 0 C--O 1.249 1.042 4 O-C-N 138.286 9.741 . . . . 101.29 103.997 168.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.53 0 N-CA-C 115.006 0.762 . . . . 34.24 115.006 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -95.75 -8.71 33.71 Favored 'General case' 0 N--CA 1.436 -1.141 1 O-C-N 115.987 -4.243 . . . . 31.83 116.409 -179.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 11.4 mtt -89.46 123.76 33.88 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 122.667 1.222 . . . . 29.75 107.98 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -128.57 127.97 43.34 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 111.552 -2.567 . . . . 35.08 105.667 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 53.1 tp -59.66 -39.45 84.47 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.554 1.525 . . . . 26.5 114.325 -175.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 54.6 m -60.3 -47.15 87.24 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 124.342 2.02 . . . . 33.1 111.591 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.08 -43.01 86.78 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 113.93 -1.486 . . . . 65.76 113.497 179.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.3 mt -68.24 -30.84 69.98 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 122.455 1.121 . . . . 36.68 111.808 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LYS . . . . . 0.461 ' HD3' ' OD2' ' B' ' 77' ' ' ASP . 35.5 mtmt -70.95 -27.29 63.64 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 118.603 -2.56 . . . . 59.7 110.094 176.15 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -96.91 17.92 15.76 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 115.359 -2.258 . . . . 47.62 111.715 175.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 97.2 m -100.5 129.8 27.04 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 121.8 2.091 . . . . 34.79 110.135 174.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -51.6 146.4 26.71 Favored 'Trans proline' 0 N--CA 1.437 -1.82 0 C-N-CA 122.987 2.458 . . . . 34.17 111.001 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -34.48 64.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 114.099 1.148 . . . . 39.96 114.099 -176.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 5.6 p -54.63 -46.25 73.88 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-N 118.29 0.495 . . . . 42.95 110.942 173.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -67.73 -33.23 74.45 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 116.637 -2.025 . . . . 42.91 111.428 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 41.7 mt -67.45 -40.75 85.42 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 116.887 -1.925 . . . . 27.7 112.822 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 94.8 mt -61.38 -41.77 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 CA-C-N 114.936 -1.029 . . . . 34.58 109.002 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 89.6 m -58.33 -50.97 71.75 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 117.8 -1.56 . . . . 41.31 109.272 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.51 ' O ' ' HE2' ' B' ' 21' ' ' MET . 42.9 tp -59.41 -47.53 85.11 Favored 'General case' 0 C--O 1.244 0.77 0 O-C-N 120.583 -1.323 . . . . 36.16 111.188 178.996 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLY . . . . . 0.461 ' HA3' ' CD1' ' B' ' 26' ' ' LEU . . . -62.8 -47.93 85.1 Favored Glycine 0 C--O 1.219 -0.802 0 CA-C-O 124.359 2.088 . . . . 31.07 111.342 -176.006 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -66.69 -27.89 68.01 Favored 'General case' 0 C--O 1.255 1.342 0 O-C-N 118.967 -2.49 . . . . 62.52 111.831 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -66.16 -29.26 69.52 Favored 'General case' 0 C--O 1.247 0.924 0 N-CA-C 114.968 1.47 . . . . 58.5 114.968 170.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' MET . . . . . 0.713 ' SD ' ' O ' ' A' ' 143' ' ' HOH . 54.5 mtm -82.4 -2.46 53.14 Favored 'General case' 0 C--O 1.236 0.346 0 O-C-N 121.01 -1.056 . . . . 46.27 112.842 174.634 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.55 16.27 34.79 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-O 118.094 -1.392 . . . . 40.74 112.286 176.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 93.6 mt -88.74 168.23 12.66 Favored 'General case' 0 C--O 1.209 -1.038 1 CA-C-O 129.116 4.293 . . . . 56.51 118.947 -175.676 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLU . . . . . 0.554 ' O ' ' HG3' ' B' ' 24' ' ' GLU . 20.0 tp10 -82.43 90.07 6.68 Favored 'General case' 0 N--CA 1.411 -2.391 3 C-N-CA 145.034 9.334 . . . . 100.67 122.271 -163.169 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ASN . . . . . 0.747 ' O ' ' HG3' ' B' ' 29' ' ' MET . 86.7 m-20 26.06 68.08 0.05 Allowed 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 125.858 2.742 . . . . 89.76 112.658 176.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.468 ' HB3' HG12 ' B' ' 34' ' ' ILE . 11.3 mt -68.06 -29.87 68.94 Favored 'General case' 0 C--O 1.217 -0.658 1 CA-C-N 105.332 -5.395 . . . . 63.74 103.269 167.749 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -44.72 -53.13 7.65 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 126.292 1.837 . . . . 68.65 113.17 176.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -91.17 -4.24 56.31 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 115.481 1.66 . . . . 83.75 115.481 177.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' MET . . . . . 0.747 ' HG3' ' O ' ' B' ' 25' ' ' ASN . 7.0 mtm -87.66 161.18 17.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 123.197 1.475 . . . . 47.19 112.222 -175.121 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.09 160.48 32.81 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.537 -0.912 . . . . 74.18 108.537 176.015 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -59.08 -48.02 83.11 Favored 'General case' 0 C--N 1.321 -0.642 0 O-C-N 120.73 -1.231 . . . . 34.44 111.087 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLN . . . . . 0.679 HE22 ' HG2' ' B' ' 76' ' ' PRO . 8.4 tt0 -56.32 -41.13 75.51 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 115.021 1.489 . . . . 58.19 115.021 175.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -70.44 -29.55 66.16 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 117.889 -3.007 . . . . 41.31 111.67 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.468 HG12 ' HB3' ' B' ' 26' ' ' LEU . 59.1 mt -66.47 -43.88 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 123.206 1.479 . . . . 30.72 107.833 178.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ILE . . . . . . . . . . . . . 37.6 mt -63.24 -41.08 91.48 Favored 'Isoleucine or valine' 0 C--O 1.251 1.17 0 CA-C-O 124.385 2.04 . . . . 27.76 109.386 -176.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -63.62 -41.29 98.3 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 117.67 -1.612 . . . . 55.76 113.65 176.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.23 -45.97 92.36 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.724 0.773 . . . . 26.4 110.03 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.561 HG23 ' HE1' ' B' ' 21' ' ' MET . 87.4 mt -59.2 -51.1 76.63 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 CA-C-O 118.336 -0.84 . . . . 28.86 110.254 175.685 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LEU . . . . . 0.585 HD22 HG21 ' B' ' 49' ' ' ILE . 85.3 mt -68.01 -39.04 83.26 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 122.34 2.336 . . . . 34.52 113.67 -176.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -60.5 -45.97 91.84 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 121.151 -0.968 . . . . 39.68 108.655 -179.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 -66.37 -43.16 86.74 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 117.886 -1.525 . . . . 46.26 110.879 -175.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 42.1 t60 -64.57 -35.73 81.93 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.592 -0.731 . . . . 26.91 112.346 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.77 -23.12 67.15 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.644 0.735 . . . . 27.17 112.85 179.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -64.93 -22.42 66.99 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 119.143 -2.223 . . . . 47.06 114.908 178.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 89.7 p -74.3 -9.15 58.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 119.375 0.989 . . . . 24.26 111.824 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.82 7.86 85.16 Favored Glycine 0 CA--C 1.532 1.118 0 CA-C-O 115.167 -3.018 . . . . 25.73 109.973 -173.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -67.72 156.98 35.7 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-N 120.805 2.302 . . . . 24.47 112.324 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -83.53 141.65 31.46 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 116.282 -2.167 . . . . 35.09 110.056 175.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ILE . . . . . 0.585 HG21 HD22 ' B' ' 39' ' ' LEU . 56.1 mt -125.28 143.8 37.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 107.683 -1.229 . . . . 38.75 107.683 172.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' PHE . . . . . 0.413 ' HE1' ' OE1' ' B' ' 118' ' ' GLU . 97.0 m-85 -114.12 159.45 20.03 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 124.978 2.323 . . . . 34.93 114.634 -175.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -158.1 166.95 34.26 Favored Glycine 0 CA--C 1.54 1.647 0 N-CA-C 106.223 -2.751 . . . . 26.27 106.223 177.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.6 172.82 17.23 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.425 -1.324 . . . . 43.44 107.425 -177.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 161.54 -177.62 37.76 Favored Glycine 0 N--CA 1.473 1.151 0 N-CA-C 108.263 -1.935 . . . . 21.15 108.263 176.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 80.2 t -97.64 127.67 49.74 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-O 123.771 1.748 . . . . 26.11 110.027 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.54 ' HB2' HD12 ' B' ' 97' ' ' ILE . 63.5 tp -70.65 134.82 47.88 Favored 'General case' 0 C--O 1.246 0.891 0 O-C-N 119.249 -2.157 . . . . 17.71 113.358 -177.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -129.65 123.68 31.8 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 105.641 -1.985 . . . . 28.59 105.641 169.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 89.2 mt -92.47 130.93 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 126.13 2.144 . . . . 24.16 107.97 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 56.3 mt -93.48 -179.58 5.08 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 117.917 -1.513 . . . . 39.86 111.979 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLN . . . . . 0.553 ' HG3' ' O ' ' B' ' 126' ' ' HOH . 41.6 mt-30 -68.82 -25.91 64.9 Favored 'General case' 0 C--O 1.247 0.964 0 O-C-N 120.133 -1.604 . . . . 60.75 114.436 -174.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ASP . . . . . 1.028 ' OD1' ' O ' ' B' ' 159' ' ' HOH . 0.8 OUTLIER -77.0 -8.02 56.65 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 117.981 -1.488 . . . . 71.52 112.61 173.843 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.44 -10.43 57.86 Favored Glycine 0 C--O 1.244 0.773 0 CA-C-O 115.993 -2.559 . . . . 34.69 112.508 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -91.38 173.8 7.72 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 121.388 2.594 . . . . 36.47 104.963 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.12 -179.79 17.8 Favored Glycine 0 N--CA 1.5 2.959 1 C-N-CA 112.187 -4.816 . . . . 19.34 108.342 176.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -131.57 141.28 49.66 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 127.106 2.298 . . . . 22.08 107.275 171.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 44.6 mt -80.25 115.28 19.71 Favored 'General case' 0 C--O 1.259 1.561 0 N-CA-C 104.939 -2.245 . . . . 20.92 104.939 165.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -89.43 154.04 20.36 Favored 'General case' 0 C--O 1.257 1.454 0 C-N-CA 125.654 1.581 . . . . 22.03 112.931 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.8 -171.58 1.98 Allowed 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.3 -1.36 . . . . 40.87 110.975 171.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ALA . . . . . . . . . . . . . . . -118.91 177.35 4.89 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 120.939 1.699 . . . . 67.01 115.427 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 . . . . . 0 N--CA 1.441 -0.91 0 C-N-CA 131.244 3.818 . . . . 97.04 120.585 177.001 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 116.896 -1.526 . . . . 61.99 109.092 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' GLY . . . . . 0.415 ' N ' ' CD ' ' B' ' 76' ' ' PRO . . . 179.96 -44.06 0.08 OUTLIER Glycine 0 CA--C 1.501 -0.818 0 N-CA-C 117.477 1.751 . . . . 56.83 117.477 178.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.679 ' HG2' HE22 ' B' ' 32' ' ' GLN . 6.9 Cg_exo -67.86 -19.63 46.41 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 121.952 1.768 . . . . 47.09 113.189 -173.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ASP . . . . . 0.461 ' OD2' ' HD3' ' B' ' 7' ' ' LYS . 10.3 p-10 -111.24 5.77 20.16 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-O 114.344 -2.741 . . . . 45.85 109.788 -176.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -52.3 152.3 3.48 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 120.906 1.685 . . . . 34.71 107.141 169.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 59.2 mt -110.75 122.84 65.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 121.047 1.749 . . . . 20.62 108.865 -175.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -64.6 136.06 56.6 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 124.281 1.033 . . . . 30.78 112.962 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 86.5 t -128.95 123.47 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 N-CA-C 105.782 -1.933 . . . . 21.06 105.782 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . 0.273 1.8 t -71.84 158.0 88.56 Favored Pre-proline 0 N--CA 1.482 1.175 0 CA-C-O 118.207 -0.902 . . . . 38.59 111.889 -173.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -65.99 -26.33 51.19 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.251 1.967 . . . . 26.33 111.761 173.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 27.4 p -74.08 -29.27 61.78 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 121.457 1.935 . . . . 32.24 109.818 -178.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -72.71 -43.33 63.16 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 125.337 1.648 . . . . 39.29 108.541 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ILE . . . . . . . . . . . . . 50.6 mt -53.91 -52.47 35.52 Favored 'Isoleucine or valine' 0 C--O 1.245 0.853 0 CA-C-O 123.443 1.592 . . . . 25.91 109.958 178.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -62.61 -46.02 90.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 118.161 -1.416 . . . . 80.32 114.356 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 30.1 ttt180 -59.72 -50.48 73.68 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 120.367 -1.458 . . . . 70.92 114.597 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -91.01 -4.27 56.55 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 120.829 -0.348 . . . . 47.13 110.739 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 58.82 57.45 3.64 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 124.623 2.154 . . . . 36.08 107.889 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 71.2 mt -86.78 149.62 24.73 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 113.966 -1.47 . . . . 26.24 109.282 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -136.02 164.57 27.7 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 119.715 -1.865 . . . . 44.97 110.837 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' THR . . . . . . . . . . . . . 4.3 m -63.84 130.42 44.06 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 126.184 2.177 . . . . 24.5 110.64 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 95.62 -6.58 67.8 Favored Glycine 0 N--CA 1.44 -1.072 0 CA-C-O 116.221 -2.433 . . . . 17.83 112.977 -176.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -64.22 140.18 58.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 121.335 2.568 . . . . 26.19 110.03 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 29.8 m -92.95 121.39 34.25 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 123.399 1.571 . . . . 30.43 106.902 169.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ILE . . . . . 0.54 HD12 ' HB2' ' B' ' 55' ' ' LEU . 11.9 mt -123.71 140.18 48.0 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.103 0 CA-C-O 116.747 -1.597 . . . . 34.05 112.42 -173.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' SER . . . . . 1.095 ' OG ' ' O ' ' B' ' 118' ' ' GLU . 90.8 p -129.97 154.06 47.76 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 105.133 -2.173 . . . . 45.73 105.133 172.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 178.87 -178.75 48.86 Favored Glycine 0 C--O 1.219 -0.79 0 C-N-CA 117.485 -2.293 . . . . 24.47 108.493 179.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 87.2 mttt -79.09 148.86 32.26 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 104.744 -2.317 . . . . 48.15 104.744 177.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 39.9 pt -127.26 164.98 26.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 O-C-N 127.393 2.933 . . . . 26.13 109.603 178.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ARG . . . . . 0.493 ' NH2' ' OE2' ' B' ' 108' ' ' GLU . 1.0 OUTLIER -130.67 164.09 44.08 Favored Pre-proline 0 C--N 1.34 0.18 0 C-N-CA 117.89 -1.524 . . . . 58.68 108.954 170.937 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -74.78 157.73 43.5 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 122.307 2.005 . . . . 32.59 109.3 176.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -60.14 145.3 98.78 Favored 'Trans proline' 0 N--CA 1.431 -2.191 0 N-CA-C 108.237 -1.486 . . . . 28.69 108.237 176.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.69 -178.44 3.65 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 114.525 -2.87 . . . . 72.84 107.584 168.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -48.55 125.47 9.9 Favored 'General case' 0 C--O 1.249 1.064 0 O-C-N 121.919 -0.488 . . . . 57.91 112.063 -174.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.6 -16.01 60.28 Favored Glycine 0 CA--C 1.517 0.209 0 CA-C-O 116.854 -2.081 . . . . 31.54 110.911 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' GLU . . . . . 0.493 ' OE2' ' NH2' ' B' ' 102' ' ' ARG . 61.1 mt-10 -103.67 155.04 18.88 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 117.918 -1.513 . . . . 33.38 111.12 -176.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -113.11 -9.6 13.51 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 116.834 -1.946 . . . . 29.08 111.65 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -128.94 152.74 48.24 Favored 'General case' 0 C--O 1.255 1.357 0 CA-C-N 122.76 2.527 . . . . 36.57 110.649 -169.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -57.36 146.4 29.2 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.435 -0.95 . . . . 45.55 108.435 162.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -128.4 138.64 52.43 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 108.961 -0.755 . . . . 21.39 108.961 -174.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.454 HD21 HG12 ' B' ' 116' ' ' VAL . 39.6 tp -67.15 134.29 51.48 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 108.134 -1.062 . . . . 25.99 108.134 173.551 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.77 -58.42 1.96 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.48 -1.236 . . . . 43.78 111.838 176.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -137.82 130.42 29.64 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.294 -1.743 . . . . 73.88 106.294 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' B' ' 117' ' ' ASN . 7.6 m -80.7 174.3 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 106.905 -1.517 . . . . 61.34 106.905 175.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ASN . . . . . 0.626 ' OD1' ' O ' ' B' ' 117' ' ' ASN . 60.5 t-20 94.92 23.51 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 112.071 -2.331 . . . . 89.87 114.654 166.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLU . . . . . 1.095 ' O ' ' OG ' ' B' ' 98' ' ' SER . 79.2 mt-10 . . . . . 0 C--O 1.273 2.324 0 C-N-CA 115.337 -2.545 . . . . 103.27 106.7 -175.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . 0.713 ' O ' ' SD ' ' B' ' 21' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . 0.753 ' O ' ' CD ' ' A' ' 56' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . 0.656 ' O ' ' HG3' ' A' ' 5' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' HOH . . . . . 0.553 ' O ' ' HG3' ' B' ' 59' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' HOH . . . . . 1.028 ' O ' ' OD1' ' B' ' 60' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_