data_6a9c_residue ############################ # Computer software used # ############################ 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 6a9c _Structure_validation_residue.Date_analyzed 2019-06-07 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 ' B' B ' -1' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 102.173 -3.269 . . . . 39.280000000000001 102.173 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' SER . . . . . . . . . . . . . 26.7 p -112.63 144.79 41.53 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 124.093 0.871 . . . . 55.369999999999997 110.63 169.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 19.0 tptp -88.55 123.15 32.77 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 106.911 -1.515 . . . . 53.869999999999997 106.911 -177.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 34.0 mt -84.16 155.61 63.67 Favored Pre-proline 0 C--O 1.256 1.446 0 N-CA-C 107.676 -1.231 . . . . 34.590000000000003 107.676 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -65.5 144.08 78.01 Favored 'Trans proline' 0 C--O 1.26 1.595 0 C-N-CA 116.619 -1.788 . . . . 31.129999999999999 111.432 176.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -120.66 152.92 37.59 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 113.383 0.882 . . . . 42.380000000000003 113.383 170.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 25.3 m -131.89 151.94 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 O-C-N 125.19 1.556 . . . . 25.829999999999998 108.375 -176.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -114.83 128.39 56.27 Favored 'General case' 0 N--CA 1.416 -2.136 0 CA-C-N 114.032 -1.44 . . . . 48.369999999999997 110.825 171.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.05 129.3 39.54 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-N 114.499 -1.228 . . . . 30.170000000000002 110.905 -177.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 68.3 mt -90.83 -26.01 19.62 Favored 'General case' 0 C--O 1.202 -1.401 0 O-C-N 124.385 1.053 . . . . 37.210000000000001 110.721 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -140.78 156.81 68.72 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 105.364 -2.087 . . . . 38.689999999999998 105.364 -173.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -75.45 160.42 38.68 Favored 'Trans proline' 0 N--CA 1.44 -1.631 0 C-N-CA 116.435 -1.91 . . . . 40.490000000000002 111.588 172.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -145.32 138.68 26.51 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 115.181 -0.918 . . . . 32.219999999999999 111.243 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 81.6 m -110.41 122.87 48.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.535 -1.211 . . . . 41.109999999999999 111.808 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.59 126.14 24.06 Favored 'General case' 0 C--O 1.193 -1.911 0 O-C-N 124.054 0.846 . . . . 36.25 109.46 -179.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.35 -24.01 59.11 Favored 'General case' 0 C--O 1.202 -1.411 0 O-C-N 123.77 0.669 . . . . 44.259999999999998 112.511 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ASN . . . . . . . . . . . . . 21.5 p30 -153.32 -179.95 8.2 Favored 'General case' 0 C--O 1.263 1.814 0 O-C-N 120.942 -1.099 . . . . 39.979999999999997 109.859 176.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.06 -15.93 63.48 Favored 'General case' 0 C--O 1.192 -1.942 0 N-CA-C 117.267 2.321 . . . . 68.439999999999998 117.267 -178.936 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -81.92 -15.94 52.2 Favored 'General case' 0 CA--C 1.564 1.511 0 CA-C-O 118.213 -0.899 . . . . 67.489999999999995 112.193 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -97.31 163.23 12.98 Favored 'General case' 0 CA--C 1.493 -1.213 0 C-N-CA 124.799 1.239 . . . . 32.32 111.554 -177.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 57.3 tp -120.89 121.88 39.03 Favored 'General case' 0 CA--C 1.486 -1.492 0 CA-C-N 114.756 -1.111 . . . . 28.649999999999999 108.376 -173.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 49.2 m -77.79 154.51 31.84 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-O 121.852 0.834 . . . . 34.060000000000002 112.572 172.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -161.14 165.76 29.01 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 121.364 -0.835 . . . . 29.989999999999998 109.147 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -114.61 164.06 14.55 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.67 -1.15 . . . . 79.329999999999998 113.382 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -52.11 142.22 4.96 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 115.155 -0.93 . . . . 39.109999999999999 110.465 176.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 75.91 -11.17 11.69 Favored Glycine 0 CA--C 1.508 -0.372 0 N-CA-C 119.729 2.652 . . . . 35.130000000000003 119.729 -173.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -62.1 138.9 58.46 Favored 'General case' 0 CA--C 1.555 1.17 0 CA-C-N 119.234 1.517 . . . . 38.299999999999997 109.195 -178.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 39.6 mm -99.15 109.81 25.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 C-N-CA 124.478 1.111 . . . . 36.740000000000002 108.472 176.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 48.8 mt -111.89 134.24 54.96 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.293 0 N-CA-C 107.505 -1.294 . . . . 34.600000000000001 107.505 -171.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 90.7 m -94.1 133.72 37.28 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.621 -1.251 . . . . 30.469999999999999 107.621 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ILE . . . . . . . . . . . . . 31.1 mm -98.29 126.72 51.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 N-CA-C 108.726 -0.842 . . . . 27.109999999999999 108.726 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 58.1 mt -96.79 -26.83 14.99 Favored 'General case' 0 CA--C 1.505 -0.783 0 C-N-CA 124.906 1.282 . . . . 34.520000000000003 111.403 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -165.96 139.91 4.41 Favored 'General case' 0 C--O 1.261 1.704 0 N-CA-C 108.236 -1.024 . . . . 69.659999999999997 108.236 -172.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -111.25 125.68 54.08 Favored 'General case' 0 C--O 1.202 -1.411 0 N-CA-C 115.882 1.808 . . . . 33.979999999999997 115.882 171.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -108.21 -173.78 2.36 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 125.091 1.356 . . . . 32.039999999999999 108.942 164.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -81.33 121.55 26.35 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 103.1 -2.926 . . . . 70.280000000000001 103.1 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.16 -27.47 2.36 Favored Glycine 0 C--O 1.202 -1.901 0 N-CA-C 119.08 2.392 . . . . 28.0 119.08 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -132.75 131.84 41.62 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 125.057 1.343 . . . . 30.699999999999999 109.359 -174.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 47.3 m0 -119.09 148.3 43.2 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 109.18 -0.674 . . . . 32.530000000000001 109.18 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -96.52 121.63 38.55 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 108.279 -1.008 . . . . 51.369999999999997 108.279 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -124.48 168.37 16.62 Favored Glycine 0 C--O 1.263 1.949 0 N-CA-C 110.549 -1.02 . . . . 24.690000000000001 110.549 -172.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -135.99 130.92 34.34 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 126.254 1.796 . . . . 64.379999999999995 108.205 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 47.2 tp -146.01 121.08 10.08 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 105.135 -2.172 . . . . 41.340000000000003 105.135 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 48.8 46.03 21.89 Favored 'General case' 0 N--CA 1.5 2.03 0 CA-C-O 123.339 1.542 . . . . 65.450000000000003 115.072 174.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.87 7.17 87.47 Favored Glycine 0 N--CA 1.407 -3.275 0 CA-C-O 117.354 -1.804 . . . . 39.719999999999999 116.571 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -112.99 135.84 53.32 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 104.907 -2.257 . . . . 57.740000000000002 104.907 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -124.94 141.33 52.2 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 124.757 1.285 . . . . 58.200000000000003 110.252 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 178.52 169.91 39.88 Favored Glycine 0 CA--C 1.499 -0.923 0 CA-C-O 121.474 0.486 . . . . 27.489999999999998 113.841 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -78.55 134.71 37.22 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.551 1.141 . . . . 26.039999999999999 112.124 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 48.8 pt -124.15 147.1 53.5 Favored Pre-proline 0 C--O 1.272 2.253 0 C-N-CA 124.474 1.109 . . . . 26.510000000000002 112.125 178.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.76 121.14 7.83 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 O-C-N 122.678 0.831 . . . . 23.309999999999999 111.665 173.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 49.5 p30 -72.02 -10.88 60.39 Favored 'General case' 0 C--O 1.188 -2.164 0 N-CA-C 114.804 1.409 . . . . 36.340000000000003 114.804 -170.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 35.3 p-10 -87.04 1.18 53.74 Favored 'General case' 0 C--O 1.198 -1.623 0 CA-C-N 119.734 1.152 . . . . 31.09 112.259 174.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -89.19 -2.95 58.72 Favored 'General case' 0 C--N 1.309 -1.19 0 O-C-N 119.898 -1.751 . . . . 32.700000000000003 113.802 174.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 12.7 m -138.42 162.04 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 N-CA-C 107.501 -1.296 . . . . 25.949999999999999 107.501 -168.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -130.53 121.74 26.29 Favored 'General case' 0 C--O 1.259 1.567 0 CA-C-N 115.019 -0.991 . . . . 60.649999999999999 108.824 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -68.59 133.03 47.91 Favored 'General case' 0 CA--C 1.561 1.391 0 CA-C-N 113.926 -1.488 . . . . 41.75 109.601 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 68.3 mt -76.98 129.6 37.18 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.849 0 C-N-CA 124.445 1.098 . . . . 44.310000000000002 108.959 -176.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 53.1 tp -51.55 129.31 25.32 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.157 0.983 . . . . 56.810000000000002 110.67 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLU . . . . . 0.406 ' OE2' ' ND1' ' B' ' 62' ' ' HIS . 1.2 pp20? -129.04 171.48 12.33 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.025 -1.102 . . . . 52.600000000000001 108.025 169.807 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -125.8 23.54 7.27 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 119.544 -0.862 . . . . 39.520000000000003 112.383 -162.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -114.49 -41.51 3.43 Favored 'General case' 0 C--O 1.211 -0.951 0 C-N-CA 123.736 0.814 . . . . 66.730000000000004 110.992 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -112.66 2.67 16.23 Favored 'General case' 0 C--O 1.195 -1.786 0 N-CA-C 114.642 1.349 . . . . 51.869999999999997 114.642 -174.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' HIS . . . . . 0.406 ' ND1' ' OE2' ' B' ' 58' ' ' GLU . 80.5 m80 -135.6 155.03 51.1 Favored 'General case' 0 C--O 1.247 0.945 0 N-CA-C 108.348 -0.982 . . . . 53.039999999999999 108.348 174.441 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . 55.6 t60 -156.76 153.2 27.98 Favored 'General case' 0 N--CA 1.418 -2.056 0 CA-C-N 113.711 -1.586 . . . . 34.960000000000001 111.965 172.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 54.4 p-80 . . . . . 0 CA--C 1.565 1.522 0 CA-C-O 121.542 0.687 . . . . 64.290000000000006 111.483 169.885 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . 0.274 . . . . . . . 0 C--O 1.198 -1.617 0 N-CA-C 116.886 2.18 . . . . 53.799999999999997 116.886 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 66.7 m -78.15 136.1 37.78 Favored 'General case' 0 N--CA 1.504 2.25 0 CA-C-N 122.02 2.191 . . . . 56.899999999999999 109.347 157.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -85.54 134.89 34.0 Favored 'General case' 0 C--O 1.195 -1.786 0 N-CA-C 107.005 -1.48 . . . . 75.290000000000006 107.005 172.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 58.4 mt -99.86 144.77 28.98 Favored Pre-proline 0 C--N 1.309 -1.194 0 O-C-N 121.509 -0.744 . . . . 45.030000000000001 109.163 171.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -60.86 146.01 98.17 Favored 'Trans proline' 0 C--O 1.268 2.007 0 C-N-CA 116.153 -2.098 . . . . 45.060000000000002 112.244 170.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -126.08 150.98 47.79 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.84 -1.073 . . . . 55.229999999999997 108.439 173.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.2 m -142.1 156.81 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.85 0 N-CA-C 105.319 -2.104 . . . . 42.469999999999999 105.319 -169.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -117.07 136.06 53.26 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.571 -0.9 . . . . 75.659999999999997 108.571 177.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -73.15 134.78 44.55 Favored 'General case' 0 C--O 1.197 -1.673 0 C-N-CA 117.76 -1.576 . . . . 42.18 111.157 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 72.5 mt -83.0 -32.57 26.88 Favored 'General case' 0 C--O 1.204 -1.302 0 C-N-CA 125.804 1.642 . . . . 45.909999999999997 111.328 170.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -139.55 157.58 70.01 Favored Pre-proline 0 N--CA 1.472 0.642 0 C-N-CA 124.742 1.217 . . . . 40.149999999999999 110.103 -174.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -71.8 149.6 54.4 Favored 'Trans proline' 0 CA--C 1.55 1.276 0 C-N-CA 116.71 -1.727 . . . . 43.409999999999997 110.252 170.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -131.13 136.32 48.25 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.259 -0.645 . . . . 36.740000000000002 109.259 172.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 85.8 m -106.99 120.19 41.39 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 108.185 -1.043 . . . . 39.329999999999998 108.185 170.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -49.37 128.63 17.42 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 123.645 0.778 . . . . 32.090000000000003 111.008 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.14 -11.15 58.21 Favored 'General case' 0 CA--C 1.479 -1.788 0 N-CA-C 115.038 1.496 . . . . 33.710000000000001 115.038 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -160.35 -179.3 7.58 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 105.758 -1.941 . . . . 31.18 105.758 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -70.06 -18.23 63.27 Favored 'General case' 0 C--O 1.206 -1.214 0 N-CA-C 115.03 1.493 . . . . 39.840000000000003 115.03 -174.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -84.21 -12.03 55.5 Favored 'General case' 0 C--O 1.249 1.045 0 N-CA-C 112.997 0.74 . . . . 45.969999999999999 112.997 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -96.69 160.23 14.49 Favored 'General case' 0 C--O 1.204 -1.309 0 O-C-N 124.413 1.071 . . . . 32.850000000000001 111.477 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 43.4 tp -112.57 126.13 55.01 Favored 'General case' 0 C--O 1.245 0.834 0 O-C-N 124.757 1.286 . . . . 27.710000000000001 110.701 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.8 m -80.72 154.36 27.31 Favored 'General case' 0 CA--C 1.499 -0.981 0 O-C-N 124.361 1.038 . . . . 32.189999999999998 109.218 174.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -162.44 165.62 26.06 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-N 116.151 -0.477 . . . . 37.439999999999998 111.031 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -117.07 164.64 14.44 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.502 -0.772 . . . . 76.269999999999996 109.497 -179.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 77.7 t -60.73 140.17 19.01 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.643 0 N-CA-C 106.132 -1.803 . . . . 49.869999999999997 106.132 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 92.73 -21.54 38.48 Favored Glycine 0 N--CA 1.414 -2.782 0 CA-C-O 117.292 -1.838 . . . . 48.82 116.783 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -63.76 136.8 57.72 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 119.638 1.719 . . . . 50.270000000000003 107.86 -174.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.7 mp -100.18 119.39 48.19 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 N-CA-C 105.474 -2.047 . . . . 54.359999999999999 105.474 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.5 mt -118.47 136.59 55.15 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.491 0 N-CA-C 107.439 -1.319 . . . . 44.75 107.439 -172.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.8 m -92.09 137.35 32.44 Favored 'General case' 0 C--O 1.273 2.29 0 CA-C-N 115.917 -0.583 . . . . 37.090000000000003 110.862 173.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 36.5 mm -103.67 129.24 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.919 0 CA-C-N 115.452 -0.795 . . . . 41.259999999999998 109.977 -174.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.8 mt -108.29 -23.27 11.99 Favored 'General case' 0 C--O 1.192 -1.944 0 O-C-N 124.726 1.266 . . . . 51.920000000000002 113.103 -174.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -164.77 156.25 15.27 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 106.488 -1.671 . . . . 64.659999999999997 106.488 -175.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -132.41 136.5 46.82 Favored 'General case' 0 CA--C 1.484 -1.574 0 N-CA-C 104.225 -2.509 . . . . 55.079999999999998 104.225 -176.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -131.96 85.81 2.28 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.788 1.635 . . . . 44.920000000000002 107.561 170.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 59.45 -127.7 1.21 Allowed 'General case' 0 N--CA 1.506 2.335 0 O-C-N 119.322 -2.111 . . . . 82.129999999999995 112.552 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.39 -13.51 65.32 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 118.787 2.275 . . . . 45.859999999999999 118.787 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -114.42 135.57 53.95 Favored 'General case' 0 N--CA 1.437 -1.077 0 O-C-N 121.837 -0.802 . . . . 40.799999999999997 111.056 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 53.6 m0 -121.43 141.83 50.61 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 107.852 -1.166 . . . . 41.859999999999999 107.852 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.5 tttt -88.64 115.52 26.23 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.923 0.868 . . . . 49.82 110.902 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -112.86 165.64 12.06 Favored Glycine 0 C--O 1.259 1.709 0 C-N-CA 120.805 -0.712 . . . . 32.479999999999997 113.098 -172.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -134.58 126.55 29.49 Favored 'General case' 0 C--O 1.206 -1.205 0 C-N-CA 124.192 0.997 . . . . 57.960000000000001 110.629 179.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.6 tp -146.38 116.2 7.26 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 106.459 -1.682 . . . . 42.740000000000002 106.459 -174.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 51.22 39.69 24.33 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 112.772 0.656 . . . . 68.040000000000006 112.772 -179.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.62 -0.59 86.82 Favored Glycine 0 N--CA 1.41 -3.042 0 N-CA-C 115.917 1.127 . . . . 33.280000000000001 115.917 174.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 mm100 -103.23 135.3 45.13 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 105.29 -2.115 . . . . 53.700000000000003 105.29 -178.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -122.45 138.33 54.58 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 115.598 -0.728 . . . . 66.879999999999995 112.385 -178.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 175.23 177.42 44.29 Favored Glycine 0 CA--C 1.49 -1.53 0 C-N-CA 121.549 -0.358 . . . . 28.539999999999999 113.734 172.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -81.23 143.25 32.45 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 124.404 0.708 . . . . 35.509999999999998 111.492 -171.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.4 pt -134.02 151.11 76.09 Favored Pre-proline 0 C--N 1.307 -1.266 0 CA-C-N 114.589 -1.187 . . . . 31.16 109.01 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -71.49 125.62 11.4 Favored 'Trans proline' 0 C--O 1.278 2.49 0 C-N-CA 121.565 1.51 . . . . 32.82 110.817 173.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 57.0 p30 -69.61 -20.6 63.62 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 119.151 -1.02 . . . . 49.57 113.642 -173.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -75.29 -1.06 21.82 Favored 'General case' 0 C--O 1.211 -0.934 0 N-CA-C 114.832 1.419 . . . . 44.159999999999997 114.832 171.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -95.42 0.05 52.97 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 118.367 -1.333 . . . . 35.079999999999998 110.535 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -133.04 164.77 34.39 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.663 0 C-N-CA 119.379 -0.928 . . . . 39.5 111.801 -175.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.8 tttt -129.24 130.89 46.82 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 124.043 0.839 . . . . 76.450000000000003 111.994 174.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.42 141.48 36.28 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 113.434 0.901 . . . . 89.469999999999999 113.434 179.11 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -101.69 146.36 10.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.857 -1.164 . . . . 79.480000000000004 107.857 177.951 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 116.251 1.945 . . . . 80.680000000000007 116.251 -174.346 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.574 0 CA-C-O 121.843 0.83 . . . . 74.810000000000002 110.272 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 34' ' ' VAL . . . . . . . . . . . . . 98.6 t -96.95 128.47 48.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 CA-C-N 115.455 -0.793 . . . . 52.079999999999998 108.986 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.73 147.47 97.94 Favored Pre-proline 0 N--CA 1.472 0.644 0 O-C-N 120.625 -1.297 . . . . 43.659999999999997 109.411 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 36' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -82.65 175.54 8.68 Favored 'Trans proline' 0 C--O 1.2 -1.42 1 C-N-CA 110.5 -5.867 . . . . 37.57 107.049 -179.104 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 37' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -73.68 151.89 47.16 Favored 'Trans proline' 0 CA--C 1.491 -1.636 0 N-CA-C 109.106 -1.151 . . . . 41.670000000000002 109.106 174.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 pt -70.11 158.61 87.0 Favored Pre-proline 0 N--CA 1.407 -2.608 0 N-CA-C 106.638 -1.616 . . . . 44.270000000000003 106.638 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 39' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -63.21 123.42 12.13 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 120.831 1.021 . . . . 54.32 109.58 177.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 40' ' ' HIS . . . . . 0.466 ' C ' ' CG ' ' E' ' 41' ' ' ARG . 2.0 m-70 -69.48 78.14 0.4 Allowed 'General case' 0 C--O 1.289 3.164 0 O-C-N 124.713 1.258 . . . . 124.33 110.717 -179.294 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 41' ' ' ARG . . . . . 0.473 ' NH1' ' O1 ' ' B' ' 102' ' ' SO4 . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.001 0 CA-C-N 114.463 -1.244 . . . . 104.5 109.528 -166.905 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' SO4 . . . . . 0.473 ' O1 ' ' NH1' ' E' ' 41' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 102.173 -3.269 . . . . 39.28 102.173 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' SER . . . . . . . . . . . . . 26.7 p -112.63 144.79 41.53 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 124.093 0.871 . . . . 55.37 110.63 169.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' LYS . . . . . 0.517 ' HD3' ' OE1' ' A' ' 44' ' ' GLN . 19.0 tptp -88.55 123.15 32.77 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 106.911 -1.515 . . . . 53.87 106.911 -177.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 34.0 mt -84.16 155.61 63.67 Favored Pre-proline 0 C--O 1.256 1.446 0 N-CA-C 107.676 -1.231 . . . . 34.59 107.676 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -65.5 144.08 78.01 Favored 'Trans proline' 0 C--O 1.26 1.595 0 C-N-CA 116.619 -1.788 . . . . 31.13 111.432 176.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -120.66 152.92 37.59 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 113.383 0.882 . . . . 42.38 113.383 170.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 25.3 m -131.89 151.94 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 O-C-N 125.19 1.556 . . . . 25.83 108.375 -176.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -114.83 128.39 56.27 Favored 'General case' 0 N--CA 1.416 -2.136 0 CA-C-N 114.032 -1.44 . . . . 48.37 110.825 171.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.05 129.3 39.54 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-N 114.499 -1.228 . . . . 30.17 110.905 -177.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 68.3 mt -90.83 -26.01 19.62 Favored 'General case' 0 C--O 1.202 -1.401 0 O-C-N 124.385 1.053 . . . . 37.21 110.721 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -140.78 156.81 68.72 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 105.364 -2.087 . . . . 38.69 105.364 -173.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -75.45 160.42 38.68 Favored 'Trans proline' 0 N--CA 1.44 -1.631 0 C-N-CA 116.435 -1.91 . . . . 40.49 111.588 172.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -145.32 138.68 26.51 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 115.181 -0.918 . . . . 32.22 111.243 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 81.6 m -110.41 122.87 48.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.535 -1.211 . . . . 41.11 111.808 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.59 126.14 24.06 Favored 'General case' 0 C--O 1.193 -1.911 0 O-C-N 124.054 0.846 . . . . 36.25 109.46 -179.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.35 -24.01 59.11 Favored 'General case' 0 C--O 1.202 -1.411 0 O-C-N 123.77 0.669 . . . . 44.26 112.511 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ASN . . . . . . . . . . . . . 21.5 p30 -153.32 -179.95 8.2 Favored 'General case' 0 C--O 1.263 1.814 0 O-C-N 120.942 -1.099 . . . . 39.98 109.859 176.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.06 -15.93 63.48 Favored 'General case' 0 C--O 1.192 -1.942 0 N-CA-C 117.267 2.321 . . . . 68.44 117.267 -178.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -81.92 -15.94 52.2 Favored 'General case' 0 CA--C 1.564 1.511 0 CA-C-O 118.213 -0.899 . . . . 67.49 112.193 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -97.31 163.23 12.98 Favored 'General case' 0 CA--C 1.493 -1.213 0 C-N-CA 124.799 1.239 . . . . 32.32 111.554 -177.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 57.3 tp -120.89 121.88 39.03 Favored 'General case' 0 CA--C 1.486 -1.492 0 CA-C-N 114.756 -1.111 . . . . 28.65 108.376 -173.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 49.2 m -77.79 154.51 31.84 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-O 121.852 0.834 . . . . 34.06 112.572 172.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -161.14 165.76 29.01 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 121.364 -0.835 . . . . 29.99 109.147 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -114.61 164.06 14.55 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.67 -1.15 . . . . 79.33 113.382 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -52.11 142.22 4.96 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 115.155 -0.93 . . . . 39.11 110.465 176.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 75.91 -11.17 11.69 Favored Glycine 0 CA--C 1.508 -0.372 0 N-CA-C 119.729 2.652 . . . . 35.13 119.729 -173.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -62.1 138.9 58.46 Favored 'General case' 0 CA--C 1.555 1.17 0 CA-C-N 119.234 1.517 . . . . 38.3 109.195 -178.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 39.6 mm -99.15 109.81 25.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 C-N-CA 124.478 1.111 . . . . 36.74 108.472 176.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 48.8 mt -111.89 134.24 54.96 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.293 0 N-CA-C 107.505 -1.294 . . . . 34.6 107.505 -171.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 90.7 m -94.1 133.72 37.28 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.621 -1.251 . . . . 30.47 107.621 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ILE . . . . . . . . . . . . . 31.1 mm -98.29 126.72 51.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 N-CA-C 108.726 -0.842 . . . . 27.11 108.726 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 58.1 mt -96.79 -26.83 14.99 Favored 'General case' 0 CA--C 1.505 -0.783 0 C-N-CA 124.906 1.282 . . . . 34.52 111.403 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -165.96 139.91 4.41 Favored 'General case' 0 C--O 1.261 1.704 0 N-CA-C 108.236 -1.024 . . . . 69.66 108.236 -172.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -111.25 125.68 54.08 Favored 'General case' 0 C--O 1.202 -1.411 0 N-CA-C 115.882 1.808 . . . . 33.98 115.882 171.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -108.21 -173.78 2.36 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 125.091 1.356 . . . . 32.04 108.942 164.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -81.33 121.55 26.35 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 103.1 -2.926 . . . . 70.28 103.1 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLY . . . . . 0.432 ' O ' ' HG2' ' E' ' 39' ' ' PRO . . . 79.16 -27.47 2.36 Favored Glycine 0 C--O 1.202 -1.901 0 N-CA-C 119.08 2.392 . . . . 28.0 119.08 177.392 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -132.75 131.84 41.62 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 125.057 1.343 . . . . 30.7 109.359 -174.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 47.3 m0 -119.09 148.3 43.2 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 109.18 -0.674 . . . . 32.53 109.18 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -96.52 121.63 38.55 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 108.279 -1.008 . . . . 51.37 108.279 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -124.48 168.37 16.62 Favored Glycine 0 C--O 1.263 1.949 0 N-CA-C 110.549 -1.02 . . . . 24.69 110.549 -172.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -135.99 130.92 34.34 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 126.254 1.796 . . . . 64.38 108.205 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 47.2 tp -146.01 121.08 10.08 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 105.135 -2.172 . . . . 41.34 105.135 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 48.8 46.03 21.89 Favored 'General case' 0 N--CA 1.5 2.03 0 CA-C-O 123.339 1.542 . . . . 65.45 115.072 174.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.87 7.17 87.47 Favored Glycine 0 N--CA 1.407 -3.275 0 CA-C-O 117.354 -1.804 . . . . 39.72 116.571 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -112.99 135.84 53.32 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 104.907 -2.257 . . . . 57.74 104.907 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -124.94 141.33 52.2 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 124.757 1.285 . . . . 58.2 110.252 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 178.52 169.91 39.88 Favored Glycine 0 CA--C 1.499 -0.923 0 CA-C-O 121.474 0.486 . . . . 27.49 113.841 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -78.55 134.71 37.22 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.551 1.141 . . . . 26.04 112.124 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 48.8 pt -124.15 147.1 53.5 Favored Pre-proline 0 C--O 1.272 2.253 0 C-N-CA 124.474 1.109 . . . . 26.51 112.125 178.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.76 121.14 7.83 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 O-C-N 122.678 0.831 . . . . 23.31 111.665 173.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 49.5 p30 -72.02 -10.88 60.39 Favored 'General case' 0 C--O 1.188 -2.164 0 N-CA-C 114.804 1.409 . . . . 36.34 114.804 -170.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 35.3 p-10 -87.04 1.18 53.74 Favored 'General case' 0 C--O 1.198 -1.623 0 CA-C-N 119.734 1.152 . . . . 31.09 112.259 174.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -89.19 -2.95 58.72 Favored 'General case' 0 C--N 1.309 -1.19 0 O-C-N 119.898 -1.751 . . . . 32.7 113.802 174.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 12.7 m -138.42 162.04 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 N-CA-C 107.501 -1.296 . . . . 25.95 107.501 -168.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -130.53 121.74 26.29 Favored 'General case' 0 C--O 1.259 1.567 0 CA-C-N 115.019 -0.991 . . . . 60.65 108.824 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -68.59 133.03 47.91 Favored 'General case' 0 CA--C 1.561 1.391 0 CA-C-N 113.926 -1.488 . . . . 41.75 109.601 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 68.3 mt -76.98 129.6 37.18 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.849 0 C-N-CA 124.445 1.098 . . . . 44.31 108.959 -176.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 53.1 tp -51.55 129.31 25.32 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.157 0.983 . . . . 56.81 110.67 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -129.04 171.48 12.33 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.025 -1.102 . . . . 52.6 108.025 169.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -125.8 23.54 7.27 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 119.544 -0.862 . . . . 39.52 112.383 -162.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -114.49 -41.51 3.43 Favored 'General case' 0 C--O 1.211 -0.951 0 C-N-CA 123.736 0.814 . . . . 66.73 110.992 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -112.66 2.67 16.23 Favored 'General case' 0 C--O 1.195 -1.786 0 N-CA-C 114.642 1.349 . . . . 51.87 114.642 -174.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -135.6 155.03 51.1 Favored 'General case' 0 C--O 1.247 0.945 0 N-CA-C 108.348 -0.982 . . . . 53.04 108.348 174.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . 55.6 t60 -156.76 153.2 27.98 Favored 'General case' 0 N--CA 1.418 -2.056 0 CA-C-N 113.711 -1.586 . . . . 34.96 111.965 172.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 54.4 p-80 . . . . . 0 CA--C 1.565 1.522 0 CA-C-O 121.542 0.687 . . . . 64.29 111.483 169.885 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . 0.274 . . . . . . . 0 C--O 1.198 -1.617 0 N-CA-C 116.886 2.18 . . . . 53.8 116.886 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 66.7 m -78.15 136.1 37.78 Favored 'General case' 0 N--CA 1.504 2.25 0 CA-C-N 122.02 2.191 . . . . 56.9 109.347 157.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -85.54 134.89 34.0 Favored 'General case' 0 C--O 1.195 -1.786 0 N-CA-C 107.005 -1.48 . . . . 75.29 107.005 172.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 58.4 mt -99.86 144.77 28.98 Favored Pre-proline 0 C--N 1.309 -1.194 0 O-C-N 121.509 -0.744 . . . . 45.03 109.163 171.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -60.86 146.01 98.17 Favored 'Trans proline' 0 C--O 1.268 2.007 0 C-N-CA 116.153 -2.098 . . . . 45.06 112.244 170.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -126.08 150.98 47.79 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.84 -1.073 . . . . 55.23 108.439 173.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.2 m -142.1 156.81 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.85 0 N-CA-C 105.319 -2.104 . . . . 42.47 105.319 -169.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -117.07 136.06 53.26 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.571 -0.9 . . . . 75.66 108.571 177.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -73.15 134.78 44.55 Favored 'General case' 0 C--O 1.197 -1.673 0 C-N-CA 117.76 -1.576 . . . . 42.18 111.157 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 72.5 mt -83.0 -32.57 26.88 Favored 'General case' 0 C--O 1.204 -1.302 0 C-N-CA 125.804 1.642 . . . . 45.91 111.328 170.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -139.55 157.58 70.01 Favored Pre-proline 0 N--CA 1.472 0.642 0 C-N-CA 124.742 1.217 . . . . 40.15 110.103 -174.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -71.8 149.6 54.4 Favored 'Trans proline' 0 CA--C 1.55 1.276 0 C-N-CA 116.71 -1.727 . . . . 43.41 110.252 170.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -131.13 136.32 48.25 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.259 -0.645 . . . . 36.74 109.259 172.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 85.8 m -106.99 120.19 41.39 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 108.185 -1.043 . . . . 39.33 108.185 170.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -49.37 128.63 17.42 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 123.645 0.778 . . . . 32.09 111.008 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.14 -11.15 58.21 Favored 'General case' 0 CA--C 1.479 -1.788 0 N-CA-C 115.038 1.496 . . . . 33.71 115.038 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -160.35 -179.3 7.58 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 105.758 -1.941 . . . . 31.18 105.758 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -70.06 -18.23 63.27 Favored 'General case' 0 C--O 1.206 -1.214 0 N-CA-C 115.03 1.493 . . . . 39.84 115.03 -174.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -84.21 -12.03 55.5 Favored 'General case' 0 C--O 1.249 1.045 0 N-CA-C 112.997 0.74 . . . . 45.97 112.997 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -96.69 160.23 14.49 Favored 'General case' 0 C--O 1.204 -1.309 0 O-C-N 124.413 1.071 . . . . 32.85 111.477 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 43.4 tp -112.57 126.13 55.01 Favored 'General case' 0 C--O 1.245 0.834 0 O-C-N 124.757 1.286 . . . . 27.71 110.701 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.8 m -80.72 154.36 27.31 Favored 'General case' 0 CA--C 1.499 -0.981 0 O-C-N 124.361 1.038 . . . . 32.19 109.218 174.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -162.44 165.62 26.06 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-N 116.151 -0.477 . . . . 37.44 111.031 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -117.07 164.64 14.44 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.502 -0.772 . . . . 76.27 109.497 -179.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 77.7 t -60.73 140.17 19.01 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.643 0 N-CA-C 106.132 -1.803 . . . . 49.87 106.132 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 92.73 -21.54 38.48 Favored Glycine 0 N--CA 1.414 -2.782 0 CA-C-O 117.292 -1.838 . . . . 48.82 116.783 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -63.76 136.8 57.72 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 119.638 1.719 . . . . 50.27 107.86 -174.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.7 mp -100.18 119.39 48.19 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 N-CA-C 105.474 -2.047 . . . . 54.36 105.474 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.5 mt -118.47 136.59 55.15 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.491 0 N-CA-C 107.439 -1.319 . . . . 44.75 107.439 -172.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.8 m -92.09 137.35 32.44 Favored 'General case' 0 C--O 1.273 2.29 0 CA-C-N 115.917 -0.583 . . . . 37.09 110.862 173.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 36.5 mm -103.67 129.24 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.919 0 CA-C-N 115.452 -0.795 . . . . 41.26 109.977 -174.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.8 mt -108.29 -23.27 11.99 Favored 'General case' 0 C--O 1.192 -1.944 0 O-C-N 124.726 1.266 . . . . 51.92 113.103 -174.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -164.77 156.25 15.27 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 106.488 -1.671 . . . . 64.66 106.488 -175.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -132.41 136.5 46.82 Favored 'General case' 0 CA--C 1.484 -1.574 0 N-CA-C 104.225 -2.509 . . . . 55.08 104.225 -176.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -131.96 85.81 2.28 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.788 1.635 . . . . 44.92 107.561 170.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 59.45 -127.7 1.21 Allowed 'General case' 0 N--CA 1.506 2.335 0 O-C-N 119.322 -2.111 . . . . 82.13 112.552 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.39 -13.51 65.32 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 118.787 2.275 . . . . 45.86 118.787 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -114.42 135.57 53.95 Favored 'General case' 0 N--CA 1.437 -1.077 0 O-C-N 121.837 -0.802 . . . . 40.8 111.056 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 53.6 m0 -121.43 141.83 50.61 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 107.852 -1.166 . . . . 41.86 107.852 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.5 tttt -88.64 115.52 26.23 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.923 0.868 . . . . 49.82 110.902 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -112.86 165.64 12.06 Favored Glycine 0 C--O 1.259 1.709 0 C-N-CA 120.805 -0.712 . . . . 32.48 113.098 -172.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -134.58 126.55 29.49 Favored 'General case' 0 C--O 1.206 -1.205 0 C-N-CA 124.192 0.997 . . . . 57.96 110.629 179.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.6 tp -146.38 116.2 7.26 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 106.459 -1.682 . . . . 42.74 106.459 -174.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 51.22 39.69 24.33 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 112.772 0.656 . . . . 68.04 112.772 -179.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.62 -0.59 86.82 Favored Glycine 0 N--CA 1.41 -3.042 0 N-CA-C 115.917 1.127 . . . . 33.28 115.917 174.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . 0.517 ' OE1' ' HD3' ' B' ' 1' ' ' LYS . 24.5 mm100 -103.23 135.3 45.13 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 105.29 -2.115 . . . . 53.7 105.29 -178.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -122.45 138.33 54.58 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 115.598 -0.728 . . . . 66.88 112.385 -178.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 175.23 177.42 44.29 Favored Glycine 0 CA--C 1.49 -1.53 0 C-N-CA 121.549 -0.358 . . . . 28.54 113.734 172.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -81.23 143.25 32.45 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 124.404 0.708 . . . . 35.51 111.492 -171.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.4 pt -134.02 151.11 76.09 Favored Pre-proline 0 C--N 1.307 -1.266 0 CA-C-N 114.589 -1.187 . . . . 31.16 109.01 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -71.49 125.62 11.4 Favored 'Trans proline' 0 C--O 1.278 2.49 0 C-N-CA 121.565 1.51 . . . . 32.82 110.817 173.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 57.0 p30 -69.61 -20.6 63.62 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 119.151 -1.02 . . . . 49.57 113.642 -173.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -75.29 -1.06 21.82 Favored 'General case' 0 C--O 1.211 -0.934 0 N-CA-C 114.832 1.419 . . . . 44.16 114.832 171.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -95.42 0.05 52.97 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 118.367 -1.333 . . . . 35.08 110.535 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -133.04 164.77 34.39 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.663 0 C-N-CA 119.379 -0.928 . . . . 39.5 111.801 -175.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.8 tttt -129.24 130.89 46.82 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 124.043 0.839 . . . . 76.45 111.994 174.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.42 141.48 36.28 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 113.434 0.901 . . . . 89.47 113.434 179.11 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -101.69 146.36 10.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.857 -1.164 . . . . 79.48 107.857 177.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 116.251 1.945 . . . . 80.68 116.251 -174.346 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.574 0 CA-C-O 121.843 0.83 . . . . 74.81 110.272 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 34' ' ' VAL . . . . . . . . . . . . . 98.6 t -96.95 128.47 48.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 CA-C-N 115.455 -0.793 . . . . 52.08 108.986 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.73 147.47 97.94 Favored Pre-proline 0 N--CA 1.472 0.644 0 O-C-N 120.625 -1.297 . . . . 43.66 109.411 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 36' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -82.65 175.54 8.68 Favored 'Trans proline' 0 C--O 1.2 -1.42 1 C-N-CA 110.5 -5.867 . . . . 37.57 107.049 -179.104 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 37' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -73.68 151.89 47.16 Favored 'Trans proline' 0 CA--C 1.491 -1.636 0 N-CA-C 109.106 -1.151 . . . . 41.67 109.106 174.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 pt -70.11 158.61 87.0 Favored Pre-proline 0 N--CA 1.407 -2.608 0 N-CA-C 106.638 -1.616 . . . . 44.27 106.638 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 39' ' ' PRO . . . . . 0.493 ' HB3' ' CD ' ' E' ' 41' ' ' ARG . 73.6 Cg_exo -63.21 123.42 12.13 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 120.831 1.021 . . . . 54.32 109.58 177.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 40' ' ' HIS . . . . . 0.782 ' O ' ' HG3' ' E' ' 41' ' ' ARG . 2.0 m-70 -69.48 78.14 0.4 Allowed 'General case' 0 C--O 1.289 3.164 0 O-C-N 124.713 1.258 . . . . 124.33 110.717 -179.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 41' ' ' ARG . . . . . 0.782 ' HG3' ' O ' ' E' ' 40' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.001 0 CA-C-N 114.463 -1.244 . . . . 104.5 109.528 -166.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' SO4 . . . . . 0.473 ' O1 ' ' NH1' ' E' ' 41' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 102.173 -3.269 . . . . 39.28 102.173 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' SER . . . . . . . . . . . . . 26.7 p -112.63 144.79 41.53 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 124.093 0.871 . . . . 55.37 110.63 169.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' LYS . . . . . 0.517 ' HD3' ' OE1' ' A' ' 44' ' ' GLN . 19.0 tptp -88.55 123.15 32.77 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 106.911 -1.515 . . . . 53.87 106.911 -177.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 34.0 mt -84.16 155.61 63.67 Favored Pre-proline 0 C--O 1.256 1.446 0 N-CA-C 107.676 -1.231 . . . . 34.59 107.676 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -65.5 144.08 78.01 Favored 'Trans proline' 0 C--O 1.26 1.595 0 C-N-CA 116.619 -1.788 . . . . 31.13 111.432 176.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -120.66 152.92 37.59 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 113.383 0.882 . . . . 42.38 113.383 170.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 25.3 m -131.89 151.94 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 O-C-N 125.19 1.556 . . . . 25.83 108.375 -176.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -114.83 128.39 56.27 Favored 'General case' 0 N--CA 1.416 -2.136 0 CA-C-N 114.032 -1.44 . . . . 48.37 110.825 171.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.05 129.3 39.54 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-N 114.499 -1.228 . . . . 30.17 110.905 -177.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 68.3 mt -90.83 -26.01 19.62 Favored 'General case' 0 C--O 1.202 -1.401 0 O-C-N 124.385 1.053 . . . . 37.21 110.721 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -140.78 156.81 68.72 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 105.364 -2.087 . . . . 38.69 105.364 -173.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -75.45 160.42 38.68 Favored 'Trans proline' 0 N--CA 1.44 -1.631 0 C-N-CA 116.435 -1.91 . . . . 40.49 111.588 172.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -145.32 138.68 26.51 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 115.181 -0.918 . . . . 32.22 111.243 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 81.6 m -110.41 122.87 48.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.535 -1.211 . . . . 41.11 111.808 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.59 126.14 24.06 Favored 'General case' 0 C--O 1.193 -1.911 0 O-C-N 124.054 0.846 . . . . 36.25 109.46 -179.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.35 -24.01 59.11 Favored 'General case' 0 C--O 1.202 -1.411 0 O-C-N 123.77 0.669 . . . . 44.26 112.511 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ASN . . . . . . . . . . . . . 21.5 p30 -153.32 -179.95 8.2 Favored 'General case' 0 C--O 1.263 1.814 0 O-C-N 120.942 -1.099 . . . . 39.98 109.859 176.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.06 -15.93 63.48 Favored 'General case' 0 C--O 1.192 -1.942 0 N-CA-C 117.267 2.321 . . . . 68.44 117.267 -178.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -81.92 -15.94 52.2 Favored 'General case' 0 CA--C 1.564 1.511 0 CA-C-O 118.213 -0.899 . . . . 67.49 112.193 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -97.31 163.23 12.98 Favored 'General case' 0 CA--C 1.493 -1.213 0 C-N-CA 124.799 1.239 . . . . 32.32 111.554 -177.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 57.3 tp -120.89 121.88 39.03 Favored 'General case' 0 CA--C 1.486 -1.492 0 CA-C-N 114.756 -1.111 . . . . 28.65 108.376 -173.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 49.2 m -77.79 154.51 31.84 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-O 121.852 0.834 . . . . 34.06 112.572 172.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -161.14 165.76 29.01 Favored 'General case' 0 C--N 1.32 -0.686 0 O-C-N 121.364 -0.835 . . . . 29.99 109.147 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -114.61 164.06 14.55 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.67 -1.15 . . . . 79.33 113.382 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -52.11 142.22 4.96 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 115.155 -0.93 . . . . 39.11 110.465 176.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 75.91 -11.17 11.69 Favored Glycine 0 CA--C 1.508 -0.372 0 N-CA-C 119.729 2.652 . . . . 35.13 119.729 -173.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -62.1 138.9 58.46 Favored 'General case' 0 CA--C 1.555 1.17 0 CA-C-N 119.234 1.517 . . . . 38.3 109.195 -178.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 39.6 mm -99.15 109.81 25.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 C-N-CA 124.478 1.111 . . . . 36.74 108.472 176.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 48.8 mt -111.89 134.24 54.96 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.293 0 N-CA-C 107.505 -1.294 . . . . 34.6 107.505 -171.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 90.7 m -94.1 133.72 37.28 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.621 -1.251 . . . . 30.47 107.621 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ILE . . . . . . . . . . . . . 31.1 mm -98.29 126.72 51.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 N-CA-C 108.726 -0.842 . . . . 27.11 108.726 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 58.1 mt -96.79 -26.83 14.99 Favored 'General case' 0 CA--C 1.505 -0.783 0 C-N-CA 124.906 1.282 . . . . 34.52 111.403 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -165.96 139.91 4.41 Favored 'General case' 0 C--O 1.261 1.704 0 N-CA-C 108.236 -1.024 . . . . 69.66 108.236 -172.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -111.25 125.68 54.08 Favored 'General case' 0 C--O 1.202 -1.411 0 N-CA-C 115.882 1.808 . . . . 33.98 115.882 171.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -108.21 -173.78 2.36 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 125.091 1.356 . . . . 32.04 108.942 164.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -81.33 121.55 26.35 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 103.1 -2.926 . . . . 70.28 103.1 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.432 ' O ' ' HG2' ' E' ' 39' ' ' PRO . . . 79.16 -27.47 2.36 Favored Glycine 0 C--O 1.202 -1.901 0 N-CA-C 119.08 2.392 . . . . 28.0 119.08 177.392 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -132.75 131.84 41.62 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 125.057 1.343 . . . . 30.7 109.359 -174.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 47.3 m0 -119.09 148.3 43.2 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 109.18 -0.674 . . . . 32.53 109.18 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -96.52 121.63 38.55 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 108.279 -1.008 . . . . 51.37 108.279 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -124.48 168.37 16.62 Favored Glycine 0 C--O 1.263 1.949 0 N-CA-C 110.549 -1.02 . . . . 24.69 110.549 -172.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -135.99 130.92 34.34 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 126.254 1.796 . . . . 64.38 108.205 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 47.2 tp -146.01 121.08 10.08 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 105.135 -2.172 . . . . 41.34 105.135 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 48.8 46.03 21.89 Favored 'General case' 0 N--CA 1.5 2.03 0 CA-C-O 123.339 1.542 . . . . 65.45 115.072 174.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.87 7.17 87.47 Favored Glycine 0 N--CA 1.407 -3.275 0 CA-C-O 117.354 -1.804 . . . . 39.72 116.571 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -112.99 135.84 53.32 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 104.907 -2.257 . . . . 57.74 104.907 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -124.94 141.33 52.2 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 124.757 1.285 . . . . 58.2 110.252 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 178.52 169.91 39.88 Favored Glycine 0 CA--C 1.499 -0.923 0 CA-C-O 121.474 0.486 . . . . 27.49 113.841 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -78.55 134.71 37.22 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.551 1.141 . . . . 26.04 112.124 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 48.8 pt -124.15 147.1 53.5 Favored Pre-proline 0 C--O 1.272 2.253 0 C-N-CA 124.474 1.109 . . . . 26.51 112.125 178.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.76 121.14 7.83 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 O-C-N 122.678 0.831 . . . . 23.31 111.665 173.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 49.5 p30 -72.02 -10.88 60.39 Favored 'General case' 0 C--O 1.188 -2.164 0 N-CA-C 114.804 1.409 . . . . 36.34 114.804 -170.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 35.3 p-10 -87.04 1.18 53.74 Favored 'General case' 0 C--O 1.198 -1.623 0 CA-C-N 119.734 1.152 . . . . 31.09 112.259 174.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -89.19 -2.95 58.72 Favored 'General case' 0 C--N 1.309 -1.19 0 O-C-N 119.898 -1.751 . . . . 32.7 113.802 174.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 12.7 m -138.42 162.04 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 N-CA-C 107.501 -1.296 . . . . 25.95 107.501 -168.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -130.53 121.74 26.29 Favored 'General case' 0 C--O 1.259 1.567 0 CA-C-N 115.019 -0.991 . . . . 60.65 108.824 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -68.59 133.03 47.91 Favored 'General case' 0 CA--C 1.561 1.391 0 CA-C-N 113.926 -1.488 . . . . 41.75 109.601 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 68.3 mt -76.98 129.6 37.18 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.849 0 C-N-CA 124.445 1.098 . . . . 44.31 108.959 -176.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 53.1 tp -51.55 129.31 25.32 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.157 0.983 . . . . 56.81 110.67 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -129.04 171.48 12.33 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.025 -1.102 . . . . 52.6 108.025 169.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -125.8 23.54 7.27 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 119.544 -0.862 . . . . 39.52 112.383 -162.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -114.49 -41.51 3.43 Favored 'General case' 0 C--O 1.211 -0.951 0 C-N-CA 123.736 0.814 . . . . 66.73 110.992 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -112.66 2.67 16.23 Favored 'General case' 0 C--O 1.195 -1.786 0 N-CA-C 114.642 1.349 . . . . 51.87 114.642 -174.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -135.6 155.03 51.1 Favored 'General case' 0 C--O 1.247 0.945 0 N-CA-C 108.348 -0.982 . . . . 53.04 108.348 174.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . 55.6 t60 -156.76 153.2 27.98 Favored 'General case' 0 N--CA 1.418 -2.056 0 CA-C-N 113.711 -1.586 . . . . 34.96 111.965 172.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 54.4 p-80 . . . . . 0 CA--C 1.565 1.522 0 CA-C-O 121.542 0.687 . . . . 64.29 111.483 169.885 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . 0.274 . . . . . . . 0 C--O 1.198 -1.617 0 N-CA-C 116.886 2.18 . . . . 53.8 116.886 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 66.7 m -78.15 136.1 37.78 Favored 'General case' 0 N--CA 1.504 2.25 0 CA-C-N 122.02 2.191 . . . . 56.9 109.347 157.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -85.54 134.89 34.0 Favored 'General case' 0 C--O 1.195 -1.786 0 N-CA-C 107.005 -1.48 . . . . 75.29 107.005 172.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 58.4 mt -99.86 144.77 28.98 Favored Pre-proline 0 C--N 1.309 -1.194 0 O-C-N 121.509 -0.744 . . . . 45.03 109.163 171.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -60.86 146.01 98.17 Favored 'Trans proline' 0 C--O 1.268 2.007 0 C-N-CA 116.153 -2.098 . . . . 45.06 112.244 170.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -126.08 150.98 47.79 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.84 -1.073 . . . . 55.23 108.439 173.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.2 m -142.1 156.81 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.85 0 N-CA-C 105.319 -2.104 . . . . 42.47 105.319 -169.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -117.07 136.06 53.26 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.571 -0.9 . . . . 75.66 108.571 177.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -73.15 134.78 44.55 Favored 'General case' 0 C--O 1.197 -1.673 0 C-N-CA 117.76 -1.576 . . . . 42.18 111.157 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 72.5 mt -83.0 -32.57 26.88 Favored 'General case' 0 C--O 1.204 -1.302 0 C-N-CA 125.804 1.642 . . . . 45.91 111.328 170.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -139.55 157.58 70.01 Favored Pre-proline 0 N--CA 1.472 0.642 0 C-N-CA 124.742 1.217 . . . . 40.15 110.103 -174.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -71.8 149.6 54.4 Favored 'Trans proline' 0 CA--C 1.55 1.276 0 C-N-CA 116.71 -1.727 . . . . 43.41 110.252 170.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -131.13 136.32 48.25 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.259 -0.645 . . . . 36.74 109.259 172.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 85.8 m -106.99 120.19 41.39 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 108.185 -1.043 . . . . 39.33 108.185 170.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -49.37 128.63 17.42 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 123.645 0.778 . . . . 32.09 111.008 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.14 -11.15 58.21 Favored 'General case' 0 CA--C 1.479 -1.788 0 N-CA-C 115.038 1.496 . . . . 33.71 115.038 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -160.35 -179.3 7.58 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 105.758 -1.941 . . . . 31.18 105.758 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -70.06 -18.23 63.27 Favored 'General case' 0 C--O 1.206 -1.214 0 N-CA-C 115.03 1.493 . . . . 39.84 115.03 -174.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -84.21 -12.03 55.5 Favored 'General case' 0 C--O 1.249 1.045 0 N-CA-C 112.997 0.74 . . . . 45.97 112.997 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -96.69 160.23 14.49 Favored 'General case' 0 C--O 1.204 -1.309 0 O-C-N 124.413 1.071 . . . . 32.85 111.477 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 43.4 tp -112.57 126.13 55.01 Favored 'General case' 0 C--O 1.245 0.834 0 O-C-N 124.757 1.286 . . . . 27.71 110.701 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.8 m -80.72 154.36 27.31 Favored 'General case' 0 CA--C 1.499 -0.981 0 O-C-N 124.361 1.038 . . . . 32.19 109.218 174.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -162.44 165.62 26.06 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-N 116.151 -0.477 . . . . 37.44 111.031 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -117.07 164.64 14.44 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.502 -0.772 . . . . 76.27 109.497 -179.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 77.7 t -60.73 140.17 19.01 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.643 0 N-CA-C 106.132 -1.803 . . . . 49.87 106.132 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 92.73 -21.54 38.48 Favored Glycine 0 N--CA 1.414 -2.782 0 CA-C-O 117.292 -1.838 . . . . 48.82 116.783 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -63.76 136.8 57.72 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 119.638 1.719 . . . . 50.27 107.86 -174.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.7 mp -100.18 119.39 48.19 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 N-CA-C 105.474 -2.047 . . . . 54.36 105.474 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.5 mt -118.47 136.59 55.15 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.491 0 N-CA-C 107.439 -1.319 . . . . 44.75 107.439 -172.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.8 m -92.09 137.35 32.44 Favored 'General case' 0 C--O 1.273 2.29 0 CA-C-N 115.917 -0.583 . . . . 37.09 110.862 173.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 36.5 mm -103.67 129.24 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.919 0 CA-C-N 115.452 -0.795 . . . . 41.26 109.977 -174.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.8 mt -108.29 -23.27 11.99 Favored 'General case' 0 C--O 1.192 -1.944 0 O-C-N 124.726 1.266 . . . . 51.92 113.103 -174.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -164.77 156.25 15.27 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 106.488 -1.671 . . . . 64.66 106.488 -175.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -132.41 136.5 46.82 Favored 'General case' 0 CA--C 1.484 -1.574 0 N-CA-C 104.225 -2.509 . . . . 55.08 104.225 -176.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -131.96 85.81 2.28 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.788 1.635 . . . . 44.92 107.561 170.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 59.45 -127.7 1.21 Allowed 'General case' 0 N--CA 1.506 2.335 0 O-C-N 119.322 -2.111 . . . . 82.13 112.552 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -68.39 -13.51 65.32 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 118.787 2.275 . . . . 45.86 118.787 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -114.42 135.57 53.95 Favored 'General case' 0 N--CA 1.437 -1.077 0 O-C-N 121.837 -0.802 . . . . 40.8 111.056 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 53.6 m0 -121.43 141.83 50.61 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 107.852 -1.166 . . . . 41.86 107.852 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.5 tttt -88.64 115.52 26.23 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.923 0.868 . . . . 49.82 110.902 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -112.86 165.64 12.06 Favored Glycine 0 C--O 1.259 1.709 0 C-N-CA 120.805 -0.712 . . . . 32.48 113.098 -172.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -134.58 126.55 29.49 Favored 'General case' 0 C--O 1.206 -1.205 0 C-N-CA 124.192 0.997 . . . . 57.96 110.629 179.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.6 tp -146.38 116.2 7.26 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 106.459 -1.682 . . . . 42.74 106.459 -174.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 51.22 39.69 24.33 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 112.772 0.656 . . . . 68.04 112.772 -179.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.62 -0.59 86.82 Favored Glycine 0 N--CA 1.41 -3.042 0 N-CA-C 115.917 1.127 . . . . 33.28 115.917 174.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.517 ' OE1' ' HD3' ' B' ' 1' ' ' LYS . 24.5 mm100 -103.23 135.3 45.13 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 105.29 -2.115 . . . . 53.7 105.29 -178.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -122.45 138.33 54.58 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 115.598 -0.728 . . . . 66.88 112.385 -178.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 175.23 177.42 44.29 Favored Glycine 0 CA--C 1.49 -1.53 0 C-N-CA 121.549 -0.358 . . . . 28.54 113.734 172.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -81.23 143.25 32.45 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 124.404 0.708 . . . . 35.51 111.492 -171.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.4 pt -134.02 151.11 76.09 Favored Pre-proline 0 C--N 1.307 -1.266 0 CA-C-N 114.589 -1.187 . . . . 31.16 109.01 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -71.49 125.62 11.4 Favored 'Trans proline' 0 C--O 1.278 2.49 0 C-N-CA 121.565 1.51 . . . . 32.82 110.817 173.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 57.0 p30 -69.61 -20.6 63.62 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 119.151 -1.02 . . . . 49.57 113.642 -173.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -75.29 -1.06 21.82 Favored 'General case' 0 C--O 1.211 -0.934 0 N-CA-C 114.832 1.419 . . . . 44.16 114.832 171.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -95.42 0.05 52.97 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 118.367 -1.333 . . . . 35.08 110.535 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -133.04 164.77 34.39 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.663 0 C-N-CA 119.379 -0.928 . . . . 39.5 111.801 -175.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.8 tttt -129.24 130.89 46.82 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 124.043 0.839 . . . . 76.45 111.994 174.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.42 141.48 36.28 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 113.434 0.901 . . . . 89.47 113.434 179.11 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -101.69 146.36 10.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.857 -1.164 . . . . 79.48 107.857 177.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 116.251 1.945 . . . . 80.68 116.251 -174.346 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.574 0 CA-C-O 121.843 0.83 . . . . 74.81 110.272 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 34' ' ' VAL . . . . . . . . . . . . . 98.6 t -96.95 128.47 48.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 CA-C-N 115.455 -0.793 . . . . 52.08 108.986 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.73 147.47 97.94 Favored Pre-proline 0 N--CA 1.472 0.644 0 O-C-N 120.625 -1.297 . . . . 43.66 109.411 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 36' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -82.65 175.54 8.68 Favored 'Trans proline' 0 C--O 1.2 -1.42 1 C-N-CA 110.5 -5.867 . . . . 37.57 107.049 -179.104 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 37' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -73.68 151.89 47.16 Favored 'Trans proline' 0 CA--C 1.491 -1.636 0 N-CA-C 109.106 -1.151 . . . . 41.67 109.106 174.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 pt -70.11 158.61 87.0 Favored Pre-proline 0 N--CA 1.407 -2.608 0 N-CA-C 106.638 -1.616 . . . . 44.27 106.638 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 39' ' ' PRO . . . . . 0.493 ' HB3' ' CD ' ' E' ' 41' ' ' ARG . 73.6 Cg_exo -63.21 123.42 12.13 Favored 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 120.831 1.021 . . . . 54.32 109.58 177.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 40' ' ' HIS . . . . . 0.782 ' O ' ' HG3' ' E' ' 41' ' ' ARG . 2.0 m-70 -69.48 78.14 0.4 Allowed 'General case' 0 C--O 1.289 3.164 0 O-C-N 124.713 1.258 . . . . 124.33 110.717 -179.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 41' ' ' ARG . . . . . 0.782 ' HG3' ' O ' ' E' ' 40' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.001 0 CA-C-N 114.463 -1.244 . . . . 104.5 109.528 -166.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' SO4 . . . . . 0.473 ' O1 ' ' NH1' ' E' ' 41' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_