data_6tgp_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 6tgp _Structure_validation_residue.Date_analyzed 2020-02-14 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.515 2.823 0 CA-C-O 119.302 -0.38 . . . . 359.50999999999999 110.762 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -127.33 165.79 19.05 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 124.365 1.066 . . . . 707.09000000000003 112.395 -162.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.06 156.2 22.6 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 112.93 0.715 . . . . 325.55000000000001 112.93 -167.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 58.8 tp -101.63 125.53 48.3 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 118.0 0.364 . . . . 350.05000000000001 111.375 173.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.91 119.35 20.95 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.48 0 O-C-N 124.76 1.288 . . . . 175.66999999999999 109.628 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 80.6 t -113.65 127.19 71.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 O-C-N 124.568 1.167 . . . . 141.81 108.416 172.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -113.98 124.85 53.15 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 113.632 -1.622 . . . . 142.49000000000001 107.342 176.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.6 m -115.75 159.39 15.71 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 CA-C-N 115.588 -0.733 . . . . 163.56999999999999 109.044 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.6 p -162.69 113.66 1.51 Allowed 'General case' 0 C--O 1.248 0.981 0 CA-C-N 114.603 -1.18 . . . . 247.63999999999999 109.526 -170.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -140.18 138.42 35.14 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 112.61 -2.086 . . . . 280.72000000000003 106.711 179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.3 32.64 72.69 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 125.274 1.609 . . . . 171.94 112.585 -167.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 63.83 22.51 66.48 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 115.373 0.909 . . . . 238.44999999999999 115.373 174.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 63.7 t -118.13 116.8 52.66 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 CA-C-N 117.369 0.584 . . . . 216.72999999999999 109.649 172.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.9 tp -73.02 142.2 47.7 Favored 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 125.607 1.817 . . . . 196.33000000000001 110.008 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . 1.577 ' CD ' ' CG ' ' A' ' 19' ' ' ARG . 8.0 mtp180 -133.05 175.14 9.64 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 113.913 -1.494 . . . . 205.66999999999999 109.184 172.399 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.73 139.03 5.2 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 107.732 -1.21 . . . . 277.07999999999998 107.732 -179.924 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -151.76 164.49 36.89 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 112.752 -2.022 . . . . 254.18000000000001 108.075 173.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -116.32 150.55 37.48 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 114.362 -1.29 . . . . 190.16 108.396 -170.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.5 t -129.02 123.66 21.95 Favored Pre-proline 0 N--CA 1.453 -0.323 0 N-CA-C 107.861 -1.163 . . . . 273.01999999999998 107.861 -176.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -77.34 167.85 23.91 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.046 1.164 . . . . 231.30000000000001 110.811 -175.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.9 m -120.43 161.75 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 108.613 -0.884 . . . . 285.88999999999999 108.613 170.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -75.39 -179.26 4.43 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.678 0.751 . . . . 279.47000000000003 109.938 175.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -70.61 -29.92 66.43 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.466 0.65 . . . . 292.73000000000002 109.877 165.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -67.06 -52.63 39.81 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 114.106 -1.407 . . . . 305.62 110.255 -175.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 136.98 -1.68 3.16 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 120.715 -0.755 . . . . 167.88 114.969 174.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -96.92 159.88 14.66 Favored 'General case' 0 C--O 1.21 -0.984 0 C-N-CA 116.97 -1.892 . . . . 408.47000000000003 110.344 178.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 40.4 mt -67.13 145.47 55.26 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 122.275 1.036 . . . . 240.0 109.698 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -98.21 37.06 1.49 Allowed 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 113.861 -1.518 . . . . 338.36000000000001 110.771 -171.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.91 171.91 19.59 Favored 'General case' 0 C--N 1.356 0.856 0 C-N-CA 124.462 1.105 . . . . 393.83999999999997 111.35 161.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.5 pm0 -132.63 179.49 6.12 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.722 -0.844 . . . . 468.17000000000002 108.722 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 57.2 mmm -64.13 -41.4 97.22 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 124.082 0.953 . . . . 276.85000000000002 110.751 -167.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.22 -26.93 65.05 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.469 -0.892 . . . . 350.05000000000001 109.505 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -87.25 -10.52 71.09 Favored Glycine 0 C--N 1.339 0.727 0 N-CA-C 110.778 -0.929 . . . . 179.37 110.778 175.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.4 tp -95.47 -42.73 8.31 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 119.926 -0.71 . . . . 171.69999999999999 110.152 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.6 mtpt -68.04 -31.26 70.8 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 124.341 1.025 . . . . 325.19 110.042 -171.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -86.62 -15.15 40.65 Favored 'General case' 0 N--CA 1.442 -0.864 0 O-C-N 124.512 1.133 . . . . 809.75 108.992 179.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.8 tptt -78.48 -38.5 40.81 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 123.85 0.719 . . . . 303.06999999999999 110.342 176.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 93.6 mt -68.45 -35.07 69.04 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 O-C-N 123.226 0.329 . . . . 217.03999999999999 110.618 177.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.09 -13.7 62.58 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-O 120.831 0.348 . . . . 238.5 110.186 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.82 -34.47 33.89 Favored 'General case' 0 C--O 1.223 -0.318 0 O-C-N 120.915 -1.116 . . . . 294.85000000000002 110.35 176.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 88.0 mt -75.85 -36.73 59.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.27 -0.641 . . . . 319.92000000000002 109.27 -172.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . 0.502 ' O ' ' OD1' ' B' ' 28' ' ' ASN . 77.1 m-85 -107.58 0.61 22.73 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 124.244 0.965 . . . . 337.69999999999999 112.642 -165.773 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 56.3 38.99 30.29 Favored 'General case' 0 C--O 1.233 0.211 0 O-C-N 124.125 0.89 . . . . 641.97000000000003 109.467 -178.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.0 mt -84.95 146.83 27.03 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 113.955 -1.475 . . . . 390.07999999999998 109.983 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 47.6 m -69.9 118.48 12.8 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 113.821 -1.536 . . . . 378.64999999999998 107.432 173.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.68 -13.9 59.77 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 119.391 0.996 . . . . 514.25 110.126 -169.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 44.7 p-10 -77.54 -17.96 57.43 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.669 0.388 . . . . 999.0 110.152 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.45 158.74 34.57 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.976 -1.12 . . . . 518.20000000000005 107.976 179.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -76.05 137.9 40.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.745 -0.661 . . . . 364.29000000000002 111.16 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 31.1 mt -117.87 126.78 53.03 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 124.752 1.283 . . . . 280.44 108.33 178.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.3 t -116.59 98.93 6.81 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 112.811 -1.995 . . . . 204.38 108.332 174.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.1 mt -100.05 127.54 46.25 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-N 114.25 -1.341 . . . . 143.74000000000001 108.666 -171.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 45.4 p -130.53 117.32 19.41 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 118.843 -1.143 . . . . 186.37 110.532 -177.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 30.4 p90 -87.8 -173.72 4.42 Favored 'General case' 0 C--N 1.344 0.357 0 O-C-N 125.755 1.909 . . . . 202.25 109.722 179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.8 m -115.78 139.95 49.68 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.07 0.938 . . . . 168.87 110.843 172.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . 0.707 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 63.0 t0 -79.69 -176.82 5.56 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 114.172 -1.376 . . . . 367.33999999999997 107.535 -173.692 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . 0.707 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 19.5 pt-20 -66.15 -43.39 87.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 123.797 0.685 . . . . 740.20000000000005 110.024 169.368 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 50.1 p-10 -105.35 24.81 11.51 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 123.543 0.737 . . . . 474.04000000000002 110.537 -173.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 86.65 16.25 62.16 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 126.752 2.12 . . . . 259.51999999999998 116.311 154.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -76.89 170.5 16.38 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 118.994 1.397 . . . . 511.44999999999999 109.696 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.3 t -101.78 90.05 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 122.633 1.206 . . . . 250.34999999999999 109.595 168.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 61.2 t -87.05 157.72 3.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 106.295 -1.742 . . . . 229.16999999999999 106.295 -176.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -95.67 148.3 22.69 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 114.716 -1.129 . . . . 249.97 111.307 176.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 37.4 mt -111.33 127.82 55.76 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.095 0.558 . . . . 233.91999999999999 110.514 171.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 22.9 m -135.08 -28.08 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 119.094 -1.043 . . . . 415.38 110.108 -168.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.4 p-10 -153.66 174.77 14.05 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 120.031 -0.668 . . . . 377.86000000000001 109.815 -163.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -85.03 1.65 46.71 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 124.501 1.126 . . . . 415.20999999999998 110.429 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -83.39 -31.79 26.52 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.958 -1.02 . . . . 440.36000000000001 109.809 174.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -86.05 -16.19 38.92 Favored 'General case' 0 C--N 1.343 0.315 0 O-C-N 124.553 1.158 . . . . 365.31999999999999 110.735 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.3 mp -75.21 -24.04 57.71 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 124.77 1.293 . . . . 262.41000000000003 110.313 173.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -68.62 -33.59 74.29 Favored 'General case' 0 N--CA 1.441 -0.883 0 O-C-N 123.972 0.795 . . . . 582.74000000000001 109.81 174.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -76.87 -18.6 58.24 Favored 'General case' 0 C--O 1.214 -0.772 0 CA-C-N 115.412 -0.813 . . . . 267.97000000000003 110.19 -169.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.0 t -68.85 -30.1 45.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 110.158 -0.312 . . . . 307.56999999999999 110.158 -176.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 73.8 p -68.62 -48.04 65.1 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 110.138 -0.319 . . . . 296.72000000000003 110.138 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -74.5 -17.3 60.78 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 124.102 0.876 . . . . 272.80000000000001 112.145 -176.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -68.29 -31.03 70.19 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 115.708 -0.678 . . . . 319.41000000000003 109.318 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 20.6 ttm105 61.98 68.39 0.69 Allowed 'General case' 0 C--O 1.239 0.511 0 O-C-N 124.265 0.978 . . . . 999.0 110.671 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.2 tp -107.55 149.04 28.48 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 114.115 -1.402 . . . . 534.33000000000004 110.243 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.34 -37.8 56.82 Favored 'General case' 0 C--N 1.347 0.493 0 N-CA-C 113.107 0.78 . . . . 999.0 113.107 -172.283 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -158.03 140.2 14.24 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.217 1.407 . . . . 339.19 108.267 164.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.9 tp -85.13 145.37 27.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.845 -0.428 . . . . 230.62 109.845 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -129.68 123.7 31.8 Favored 'General case' 0 C--N 1.347 0.496 0 N-CA-C 112.684 0.624 . . . . 301.50999999999999 112.684 179.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 37.5 mt -121.62 120.45 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 O-C-N 125.227 1.579 . . . . 146.86000000000001 109.973 -167.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -96.75 138.68 33.94 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 114.887 -1.052 . . . . 228.00999999999999 109.342 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 93.5 t -100.55 133.44 43.68 Favored 'Isoleucine or valine' 0 C--N 1.344 0.364 0 CA-C-N 114.508 -1.224 . . . . 226.31999999999999 109.107 175.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -127.3 112.8 15.48 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.032 -0.729 . . . . 233.33000000000001 109.032 164.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.17 159.61 21.54 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.361 1.465 . . . . 279.47000000000003 109.463 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.477 -1.735 . . . . 281.5 113.067 174.053 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . 0.414 . . . . . . . 0 CA--C 1.589 2.461 0 CA-C-O 120.99 0.424 . . . . 248.06 110.001 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -125.61 164.56 20.29 Favored 'General case' 0 C--N 1.377 1.792 0 O-C-N 119.175 -2.203 . . . . 451.43000000000001 115.656 -155.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.75 164.8 14.45 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.217 1.407 . . . . 303.56 111.208 -173.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 57.5 tp -102.49 125.85 49.34 Favored 'General case' 0 C--N 1.347 0.499 0 O-C-N 121.366 -0.834 . . . . 253.77000000000001 111.083 173.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.0 t -76.64 119.59 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 119.142 -0.456 . . . . 153.93000000000001 110.44 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 91.8 t -113.05 125.57 70.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 O-C-N 125.114 1.508 . . . . 118.2 109.965 175.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -114.0 123.31 49.38 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 107.892 -1.151 . . . . 186.16 107.892 177.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 28.3 m -116.07 162.84 13.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 109.198 -0.667 . . . . 205.02000000000001 109.198 174.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.4 p -157.4 118.94 3.68 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.619 1.2 . . . . 245.97999999999999 110.584 -175.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -136.33 138.05 41.27 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 107.906 -1.146 . . . . 244.53999999999999 107.906 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 60.84 34.64 87.94 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.99 1.431 . . . . 159.88999999999999 111.676 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.68 24.79 72.79 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 113.695 -1.252 . . . . 402.64999999999998 114.445 174.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 96.2 t -118.29 112.37 37.98 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.924 0 CA-C-N 117.481 0.64 . . . . 315.49000000000001 109.819 173.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 19.9 tp -75.82 142.46 42.24 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 124.477 1.11 . . . . 508.16000000000003 108.336 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ARG . . . . . . . . . . . . . 10.5 mtp180 -130.25 176.22 8.29 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 114.657 -1.156 . . . . 217.49000000000001 108.03 172.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.41 141.76 13.72 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 120.597 -1.315 . . . . 215.80000000000001 107.588 170.768 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -149.8 166.73 28.58 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 112.81 -1.996 . . . . 193.24000000000001 108.207 173.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 -116.57 150.22 38.36 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 107.364 -1.347 . . . . 272.20999999999998 107.364 -168.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.83 123.13 21.83 Favored Pre-proline 0 C--O 1.222 -0.393 0 N-CA-C 106.625 -1.62 . . . . 261.32999999999998 106.625 -177.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.37 164.09 33.32 Favored 'Trans proline' 0 C--N 1.352 0.746 0 N-CA-C 109.629 -0.951 . . . . 266.38999999999999 109.629 -176.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 2.9 m -118.27 158.68 19.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 107.09 -1.448 . . . . 221.22999999999999 107.09 172.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -77.16 -178.88 5.28 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.226 -0.989 . . . . 186.28 109.421 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.25 -26.74 61.24 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.431 -0.581 . . . . 302.67000000000002 109.431 164.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ASN . . . . . 0.502 ' OD1' ' O ' ' A' ' 46' ' ' PHE . 29.5 t30 -62.23 -53.71 51.37 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.087 1.355 . . . . 282.58999999999997 111.021 178.873 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . 136.34 -12.32 4.07 Favored Glycine 0 C--N 1.345 1.029 0 C-N-CA 119.73 -1.224 . . . . 182.31 115.788 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -95.58 161.46 14.04 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 118.22 -1.392 . . . . 431.68000000000001 110.13 -179.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 84.5 mt -71.65 144.83 49.26 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 114.085 -1.416 . . . . 319.91000000000003 108.929 -178.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -99.25 41.82 1.13 Allowed 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 123.854 0.721 . . . . 301.95999999999998 110.894 -169.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.96 172.57 18.44 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 124.59 1.156 . . . . 295.83999999999997 110.994 160.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 25.5 pm0 -133.02 176.99 8.01 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 108.55 -0.907 . . . . 305.13999999999999 108.55 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' MET . . . . . . . . . . . . . 66.7 mmm -60.57 -42.85 97.49 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 124.816 1.246 . . . . 273.49000000000001 111.34 -170.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.57 -33.35 74.79 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.696 -1.138 . . . . 207.00999999999999 109.703 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . -89.08 -10.18 66.65 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.25 -1.14 . . . . 159.28 110.25 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 13.8 tp -95.54 -41.76 8.78 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 120.211 -0.595 . . . . 195.72999999999999 109.778 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -67.92 -30.28 69.57 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 124.465 1.103 . . . . 395.06999999999999 109.707 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -85.98 -14.92 43.14 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 119.702 -0.799 . . . . 693.63 109.588 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' LYS . . . . . . . . . . . . . 14.3 tptt -79.95 -37.8 33.71 Favored 'General case' 0 C--O 1.224 -0.282 0 O-C-N 123.42 0.45 . . . . 240.63999999999999 110.186 176.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 92.2 mt -68.11 -35.88 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 O-C-N 123.368 0.417 . . . . 258.19999999999999 110.111 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.0 -13.59 62.55 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.962 -0.384 . . . . 175.86000000000001 109.962 179.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.93 -35.3 32.54 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 120.697 -1.252 . . . . 273.45999999999998 110.193 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 75.9 mt -74.49 -37.31 63.19 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.609 -0.515 . . . . 219.31999999999999 109.609 -171.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -109.28 1.41 20.14 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 116.257 -0.429 . . . . 293.92000000000002 112.122 -165.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 56.77 40.43 29.09 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.363 0.665 . . . . 621.90999999999997 110.495 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 35.9 mt -84.29 146.92 27.5 Favored 'General case' 0 N--CA 1.443 -0.777 0 O-C-N 125.454 1.721 . . . . 361.88 109.536 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 35.7 m -66.89 118.85 10.95 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 113.628 -1.624 . . . . 299.72000000000003 108.0 169.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.57 -14.78 59.98 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.259 0.481 . . . . 416.14999999999998 110.54 -167.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 45.6 p-10 -75.66 -17.42 59.99 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.916 0.486 . . . . 999.0 110.651 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.64 156.66 34.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.99 0.9 . . . . 350.44 109.776 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -79.2 139.2 38.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.796 -1.093 . . . . 999.0 109.568 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 22.0 mt -116.52 130.31 56.68 Favored 'General case' 0 N--CA 1.444 -0.769 0 O-C-N 124.539 1.149 . . . . 234.75999999999999 109.932 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 33.7 t -119.17 98.22 6.06 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 113.483 -1.689 . . . . 524.39999999999998 109.554 176.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 86.7 mt -101.74 125.59 48.44 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 113.744 -1.571 . . . . 236.72 109.386 -170.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 74.1 p -134.13 117.59 16.75 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 112.587 0.588 . . . . 164.49000000000001 112.587 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -89.01 -173.85 4.23 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 110.554 -0.165 . . . . 215.36000000000001 110.554 -179.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 39.6 m -115.94 139.96 49.72 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 122.778 1.275 . . . . 197.31 110.784 169.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ASP . . . . . 0.705 ' OD1' ' N ' ' B' ' 61' ' ' GLU . 63.9 t0 -79.3 -177.26 5.62 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 113.687 -1.597 . . . . 522.03999999999996 107.566 -174.199 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLU . . . . . 0.705 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 17.6 pt-20 -65.3 -44.36 88.17 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 124.275 0.984 . . . . 542.23000000000002 109.992 169.386 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 48.2 p-10 -104.35 23.78 12.62 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.794 0.838 . . . . 472.25999999999999 110.724 -172.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . 85.84 16.45 63.43 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 125.991 1.757 . . . . 258.49000000000001 116.262 157.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -78.47 168.23 20.11 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 119.195 1.497 . . . . 644.79999999999995 109.158 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 63.1 t -102.89 91.34 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-O 122.015 0.912 . . . . 337.26999999999998 109.793 170.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 43.1 t -86.88 157.57 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 107.147 -1.427 . . . . 231.46000000000001 107.147 -174.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -97.04 149.69 21.65 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.45 1.1 . . . . 222.16 111.344 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 39.0 mt -112.64 124.13 51.85 Favored 'General case' 0 C--N 1.348 0.542 0 C-N-CA 123.354 0.661 . . . . 167.34 111.015 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 27.2 m -134.85 -28.58 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.076 0 C-N-CA 118.598 -1.241 . . . . 367.12 110.343 -162.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -153.0 173.91 14.82 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.092 -1.077 . . . . 421.67000000000002 108.092 -167.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -84.44 -0.14 51.73 Favored 'General case' 0 C--O 1.223 -0.327 0 O-C-N 124.767 1.292 . . . . 262.83999999999997 109.369 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -85.07 -30.34 24.16 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-O 117.167 -1.397 . . . . 256.13 109.712 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -87.47 -14.98 38.96 Favored 'General case' 0 CA--C 1.519 -0.249 0 O-C-N 124.346 1.029 . . . . 252.75999999999999 110.315 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 6.8 mp -75.11 -24.48 58.09 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 124.28 0.988 . . . . 257.81 110.051 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -69.08 -32.25 71.56 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.179 -0.674 . . . . 436.73000000000002 109.179 174.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -75.9 -20.95 57.62 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 110.027 -0.36 . . . . 244.02000000000001 110.027 -170.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 77.2 t -70.17 -28.48 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 109.205 -0.665 . . . . 274.04000000000002 109.205 -175.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' THR . . . . . . . . . . . . . 71.5 p -68.25 -47.67 67.15 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.532 0.605 . . . . 255.21000000000001 110.081 176.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -74.5 -16.77 60.83 Favored 'General case' 0 C--O 1.239 0.521 0 O-C-N 124.057 0.848 . . . . 220.34 112.236 -177.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -67.68 -32.21 72.72 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 123.566 0.746 . . . . 521.91999999999996 109.592 -179.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 24.1 ttm105 60.34 66.91 0.89 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 122.174 0.988 . . . . 565.34000000000003 111.11 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.1 tp -108.55 149.31 29.04 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 114.286 -1.324 . . . . 498.91000000000003 108.326 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -38.0 57.08 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 113.126 0.788 . . . . 682.25999999999999 113.126 -171.52 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -157.86 139.14 13.51 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.068 -1.086 . . . . 286.23000000000002 108.068 167.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 32.3 tp -85.17 146.48 27.08 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.709 -0.678 . . . . 175.53 110.137 -175.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -133.54 122.14 23.15 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.065 0.459 . . . . 462.58999999999997 111.732 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 63.3 mt -123.05 123.21 67.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 CA-C-N 115.598 -0.728 . . . . 150.66999999999999 110.018 -165.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -94.48 139.1 31.58 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.369 -0.832 . . . . 353.56 110.478 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' VAL . . . . . . . . . . . . . 88.7 t -101.11 130.6 50.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 107.742 -1.207 . . . . 183.06 107.742 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -127.32 113.68 16.59 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.368 -0.833 . . . . 261.95999999999998 109.498 163.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.38 158.27 23.76 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.03 1.332 . . . . 428.17000000000002 109.759 177.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 117.522 -1.71 . . . . 545.57000000000005 112.758 178.824 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.515 2.823 0 CA-C-O 119.302 -0.38 . . . . 359.51 110.762 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -127.33 165.79 19.05 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 124.365 1.066 . . . . 707.09 112.395 -162.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.06 156.2 22.6 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 112.93 0.715 . . . . 325.55 112.93 -167.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 58.8 tp -101.63 125.53 48.3 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 118.0 0.364 . . . . 350.05 111.375 173.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.91 119.35 20.95 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.48 0 O-C-N 124.76 1.288 . . . . 175.67 109.628 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 80.6 t -113.65 127.19 71.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 O-C-N 124.568 1.167 . . . . 141.81 108.416 172.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . 0.515 ' HG3' ' CD2' ' A' ' 84' ' ' PHE . 24.6 mttt -113.98 124.85 53.15 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 113.632 -1.622 . . . . 142.49 107.342 176.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . 0.589 HG12 ' HB ' ' A' ' 87' ' ' ILE . 16.6 m -115.75 159.39 15.71 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 CA-C-N 115.588 -0.733 . . . . 163.57 109.044 176.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.6 p -162.69 113.66 1.51 Allowed 'General case' 0 C--O 1.248 0.981 0 CA-C-N 114.603 -1.18 . . . . 247.64 109.526 -170.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . 0.439 ' CZ ' ' HZ ' ' B' ' 75' ' ' PHE . 49.4 t80 -140.18 138.42 35.14 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 112.61 -2.086 . . . . 280.72 106.711 179.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.3 32.64 72.69 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 125.274 1.609 . . . . 171.94 112.585 -167.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 63.83 22.51 66.48 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 115.373 0.909 . . . . 238.45 115.373 174.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . 0.558 HG21 ' HA2' ' B' ' 29' ' ' GLY . 63.7 t -118.13 116.8 52.66 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 CA-C-N 117.369 0.584 . . . . 216.73 109.649 172.864 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.9 tp -73.02 142.2 47.7 Favored 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 125.607 1.817 . . . . 196.33 110.008 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . 1.577 ' CG ' ' CD ' ' A' ' 19' ' ' ARG . 8.0 mtp180 -133.05 175.14 9.64 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 113.913 -1.494 . . . . 205.67 109.184 172.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.73 139.03 5.2 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 107.732 -1.21 . . . . 277.08 107.732 -179.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -151.76 164.49 36.89 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 112.752 -2.022 . . . . 254.18 108.075 173.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -116.32 150.55 37.48 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 114.362 -1.29 . . . . 190.16 108.396 -170.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.5 t -129.02 123.66 21.95 Favored Pre-proline 0 N--CA 1.453 -0.323 0 N-CA-C 107.861 -1.163 . . . . 273.02 107.861 -176.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -77.34 167.85 23.91 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.046 1.164 . . . . 231.3 110.811 -175.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.9 m -120.43 161.75 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 108.613 -0.884 . . . . 285.89 108.613 170.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -75.39 -179.26 4.43 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.678 0.751 . . . . 279.47 109.938 175.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -70.61 -29.92 66.43 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.466 0.65 . . . . 292.73 109.877 165.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -67.06 -52.63 39.81 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 114.106 -1.407 . . . . 305.62 110.255 -175.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 136.98 -1.68 3.16 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 120.715 -0.755 . . . . 167.88 114.969 174.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -96.92 159.88 14.66 Favored 'General case' 0 C--O 1.21 -0.984 0 C-N-CA 116.97 -1.892 . . . . 408.47 110.344 178.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 40.4 mt -67.13 145.47 55.26 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 122.275 1.036 . . . . 240.0 109.698 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -98.21 37.06 1.49 Allowed 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 113.861 -1.518 . . . . 338.36 110.771 -171.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.91 171.91 19.59 Favored 'General case' 0 C--N 1.356 0.856 0 C-N-CA 124.462 1.105 . . . . 393.84 111.35 161.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.5 pm0 -132.63 179.49 6.12 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.722 -0.844 . . . . 468.17 108.722 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 57.2 mmm -64.13 -41.4 97.22 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 124.082 0.953 . . . . 276.85 110.751 -167.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.22 -26.93 65.05 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.469 -0.892 . . . . 350.05 109.505 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -87.25 -10.52 71.09 Favored Glycine 0 C--N 1.339 0.727 0 N-CA-C 110.778 -0.929 . . . . 179.37 110.778 175.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.4 tp -95.47 -42.73 8.31 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 119.926 -0.71 . . . . 171.7 110.152 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.6 mtpt -68.04 -31.26 70.8 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 124.341 1.025 . . . . 325.19 110.042 -171.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -86.62 -15.15 40.65 Favored 'General case' 0 N--CA 1.442 -0.864 0 O-C-N 124.512 1.133 . . . . 809.75 108.992 179.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.8 tptt -78.48 -38.5 40.81 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 123.85 0.719 . . . . 303.07 110.342 176.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 93.6 mt -68.45 -35.07 69.04 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 O-C-N 123.226 0.329 . . . . 217.04 110.618 177.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.09 -13.7 62.58 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-O 120.831 0.348 . . . . 238.5 110.186 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.82 -34.47 33.89 Favored 'General case' 0 C--O 1.223 -0.318 0 O-C-N 120.915 -1.116 . . . . 294.85 110.35 176.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 88.0 mt -75.85 -36.73 59.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.27 -0.641 . . . . 319.92 109.27 -172.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . 0.502 ' O ' ' OD1' ' B' ' 28' ' ' ASN . 77.1 m-85 -107.58 0.61 22.73 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 124.244 0.965 . . . . 337.7 112.642 -165.773 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 56.3 38.99 30.29 Favored 'General case' 0 C--O 1.233 0.211 0 O-C-N 124.125 0.89 . . . . 641.97 109.467 -178.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.0 mt -84.95 146.83 27.03 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 113.955 -1.475 . . . . 390.08 109.983 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 47.6 m -69.9 118.48 12.8 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 113.821 -1.536 . . . . 378.65 107.432 173.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.68 -13.9 59.77 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 119.391 0.996 . . . . 514.25 110.126 -169.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 44.7 p-10 -77.54 -17.96 57.43 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.669 0.388 . . . . 999.0 110.152 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.45 158.74 34.57 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.976 -1.12 . . . . 518.2 107.976 179.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -76.05 137.9 40.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.745 -0.661 . . . . 364.29 111.16 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 31.1 mt -117.87 126.78 53.03 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 124.752 1.283 . . . . 280.44 108.33 178.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.3 t -116.59 98.93 6.81 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 112.811 -1.995 . . . . 204.38 108.332 174.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.1 mt -100.05 127.54 46.25 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-N 114.25 -1.341 . . . . 143.74 108.666 -171.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 45.4 p -130.53 117.32 19.41 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 118.843 -1.143 . . . . 186.37 110.532 -177.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' TYR . . . . . 0.458 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 30.4 p90 -87.8 -173.72 4.42 Favored 'General case' 0 C--N 1.344 0.357 0 O-C-N 125.755 1.909 . . . . 202.25 109.722 179.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.8 m -115.78 139.95 49.68 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.07 0.938 . . . . 168.87 110.843 172.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . 0.707 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 63.0 t0 -79.69 -176.82 5.56 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 114.172 -1.376 . . . . 367.34 107.535 -173.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . 0.707 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 19.5 pt-20 -66.15 -43.39 87.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 123.797 0.685 . . . . 740.2 110.024 169.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 50.1 p-10 -105.35 24.81 11.51 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 123.543 0.737 . . . . 474.04 110.537 -173.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 86.65 16.25 62.16 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 126.752 2.12 . . . . 259.52 116.311 154.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -76.89 170.5 16.38 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 118.994 1.397 . . . . 511.45 109.696 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.3 t -101.78 90.05 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 122.633 1.206 . . . . 250.35 109.595 168.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 61.2 t -87.05 157.72 3.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 106.295 -1.742 . . . . 229.17 106.295 -176.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -95.67 148.3 22.69 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 114.716 -1.129 . . . . 249.97 111.307 176.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . 0.458 ' HG ' ' HD1' ' A' ' 58' ' ' TYR . 37.4 mt -111.33 127.82 55.76 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.095 0.558 . . . . 233.92 110.514 171.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 22.9 m -135.08 -28.08 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 119.094 -1.043 . . . . 415.38 110.108 -168.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.4 p-10 -153.66 174.77 14.05 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 120.031 -0.668 . . . . 377.86 109.815 -163.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -85.03 1.65 46.71 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 124.501 1.126 . . . . 415.21 110.429 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -83.39 -31.79 26.52 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.958 -1.02 . . . . 440.36 109.809 174.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -86.05 -16.19 38.92 Favored 'General case' 0 C--N 1.343 0.315 0 O-C-N 124.553 1.158 . . . . 365.32 110.735 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.3 mp -75.21 -24.04 57.71 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 124.77 1.293 . . . . 262.41 110.313 173.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -68.62 -33.59 74.29 Favored 'General case' 0 N--CA 1.441 -0.883 0 O-C-N 123.972 0.795 . . . . 582.74 109.81 174.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -76.87 -18.6 58.24 Favored 'General case' 0 C--O 1.214 -0.772 0 CA-C-N 115.412 -0.813 . . . . 267.97 110.19 -169.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.0 t -68.85 -30.1 45.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 110.158 -0.312 . . . . 307.57 110.158 -176.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 73.8 p -68.62 -48.04 65.1 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 110.138 -0.319 . . . . 296.72 110.138 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -74.5 -17.3 60.78 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 124.102 0.876 . . . . 272.8 112.145 -176.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -68.29 -31.03 70.19 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 115.708 -0.678 . . . . 319.41 109.318 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 20.6 ttm105 61.98 68.39 0.69 Allowed 'General case' 0 C--O 1.239 0.511 0 O-C-N 124.265 0.978 . . . . 999.0 110.671 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.2 tp -107.55 149.04 28.48 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 114.115 -1.402 . . . . 534.33 110.243 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.34 -37.8 56.82 Favored 'General case' 0 C--N 1.347 0.493 0 N-CA-C 113.107 0.78 . . . . 999.0 113.107 -172.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PHE . . . . . 0.515 ' CD2' ' HG3' ' A' ' 11' ' ' LYS . 15.2 p90 -158.03 140.2 14.24 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.217 1.407 . . . . 339.19 108.267 164.8 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.9 tp -85.13 145.37 27.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.845 -0.428 . . . . 230.62 109.845 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . 0.409 ' HE3' ' HB3' ' A' ' 86' ' ' LYS . 21.4 mtpp -129.68 123.7 31.8 Favored 'General case' 0 C--N 1.347 0.496 0 N-CA-C 112.684 0.624 . . . . 301.51 112.684 179.611 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ILE . . . . . 0.589 ' HB ' HG12 ' A' ' 12' ' ' VAL . 37.5 mt -121.62 120.45 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 O-C-N 125.227 1.579 . . . . 146.86 109.973 -167.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -96.75 138.68 33.94 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 114.887 -1.052 . . . . 228.01 109.342 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 93.5 t -100.55 133.44 43.68 Favored 'Isoleucine or valine' 0 C--N 1.344 0.364 0 CA-C-N 114.508 -1.224 . . . . 226.32 109.107 175.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -127.3 112.8 15.48 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.032 -0.729 . . . . 233.33 109.032 164.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.17 159.61 21.54 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.361 1.465 . . . . 279.47 109.463 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.477 -1.735 . . . . 281.5 113.067 174.053 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . 0.414 . . . . . . . 0 CA--C 1.589 2.461 0 CA-C-O 120.99 0.424 . . . . 248.06 110.001 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -125.61 164.56 20.29 Favored 'General case' 0 C--N 1.377 1.792 0 O-C-N 119.175 -2.203 . . . . 451.43 115.656 -155.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.75 164.8 14.45 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.217 1.407 . . . . 303.56 111.208 -173.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 57.5 tp -102.49 125.85 49.34 Favored 'General case' 0 C--N 1.347 0.499 0 O-C-N 121.366 -0.834 . . . . 253.77 111.083 173.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.0 t -76.64 119.59 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 119.142 -0.456 . . . . 153.93 110.44 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 91.8 t -113.05 125.57 70.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 O-C-N 125.114 1.508 . . . . 118.2 109.965 175.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LYS . . . . . 0.548 ' HG3' ' HD2' ' B' ' 84' ' ' PHE . 28.8 mttt -114.0 123.31 49.38 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 107.892 -1.151 . . . . 186.16 107.892 177.54 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . 0.545 HG12 ' HB ' ' B' ' 87' ' ' ILE . 28.3 m -116.07 162.84 13.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 109.198 -0.667 . . . . 205.02 109.198 174.258 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.4 p -157.4 118.94 3.68 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.619 1.2 . . . . 245.98 110.584 -175.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -136.33 138.05 41.27 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 107.906 -1.146 . . . . 244.54 107.906 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 60.84 34.64 87.94 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.99 1.431 . . . . 159.89 111.676 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.68 24.79 72.79 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 113.695 -1.252 . . . . 402.65 114.445 174.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 96.2 t -118.29 112.37 37.98 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.924 0 CA-C-N 117.481 0.64 . . . . 315.49 109.819 173.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 19.9 tp -75.82 142.46 42.24 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 124.477 1.11 . . . . 508.16 108.336 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ARG . . . . . . . . . . . . . 10.5 mtp180 -130.25 176.22 8.29 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 114.657 -1.156 . . . . 217.49 108.03 172.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.41 141.76 13.72 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 120.597 -1.315 . . . . 215.8 107.588 170.768 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -149.8 166.73 28.58 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 112.81 -1.996 . . . . 193.24 108.207 173.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 -116.57 150.22 38.36 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 107.364 -1.347 . . . . 272.21 107.364 -168.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.83 123.13 21.83 Favored Pre-proline 0 C--O 1.222 -0.393 0 N-CA-C 106.625 -1.62 . . . . 261.33 106.625 -177.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.37 164.09 33.32 Favored 'Trans proline' 0 C--N 1.352 0.746 0 N-CA-C 109.629 -0.951 . . . . 266.39 109.629 -176.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 2.9 m -118.27 158.68 19.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 107.09 -1.448 . . . . 221.23 107.09 172.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -77.16 -178.88 5.28 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.226 -0.989 . . . . 186.28 109.421 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.25 -26.74 61.24 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.431 -0.581 . . . . 302.67 109.431 164.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ASN . . . . . 0.502 ' OD1' ' O ' ' A' ' 46' ' ' PHE . 29.5 t30 -62.23 -53.71 51.37 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.087 1.355 . . . . 282.59 111.021 178.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLY . . . . . 0.558 ' HA2' HG21 ' A' ' 17' ' ' VAL . . . 136.34 -12.32 4.07 Favored Glycine 0 C--N 1.345 1.029 0 C-N-CA 119.73 -1.224 . . . . 182.31 115.788 179.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -95.58 161.46 14.04 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 118.22 -1.392 . . . . 431.68 110.13 -179.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 84.5 mt -71.65 144.83 49.26 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 114.085 -1.416 . . . . 319.91 108.929 -178.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -99.25 41.82 1.13 Allowed 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 123.854 0.721 . . . . 301.96 110.894 -169.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.96 172.57 18.44 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 124.59 1.156 . . . . 295.84 110.994 160.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 25.5 pm0 -133.02 176.99 8.01 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 108.55 -0.907 . . . . 305.14 108.55 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' MET . . . . . . . . . . . . . 66.7 mmm -60.57 -42.85 97.49 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 124.816 1.246 . . . . 273.49 111.34 -170.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.57 -33.35 74.79 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.696 -1.138 . . . . 207.01 109.703 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . -89.08 -10.18 66.65 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.25 -1.14 . . . . 159.28 110.25 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 13.8 tp -95.54 -41.76 8.78 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 120.211 -0.595 . . . . 195.73 109.778 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -67.92 -30.28 69.57 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 124.465 1.103 . . . . 395.07 109.707 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -85.98 -14.92 43.14 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 119.702 -0.799 . . . . 693.63 109.588 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' LYS . . . . . . . . . . . . . 14.3 tptt -79.95 -37.8 33.71 Favored 'General case' 0 C--O 1.224 -0.282 0 O-C-N 123.42 0.45 . . . . 240.64 110.186 176.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 92.2 mt -68.11 -35.88 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 O-C-N 123.368 0.417 . . . . 258.2 110.111 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.0 -13.59 62.55 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.962 -0.384 . . . . 175.86 109.962 179.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.93 -35.3 32.54 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 120.697 -1.252 . . . . 273.46 110.193 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 75.9 mt -74.49 -37.31 63.19 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.609 -0.515 . . . . 219.32 109.609 -171.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -109.28 1.41 20.14 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 116.257 -0.429 . . . . 293.92 112.122 -165.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 56.77 40.43 29.09 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.363 0.665 . . . . 621.91 110.495 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 35.9 mt -84.29 146.92 27.5 Favored 'General case' 0 N--CA 1.443 -0.777 0 O-C-N 125.454 1.721 . . . . 361.88 109.536 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 35.7 m -66.89 118.85 10.95 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 113.628 -1.624 . . . . 299.72 108.0 169.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.57 -14.78 59.98 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.259 0.481 . . . . 416.15 110.54 -167.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 45.6 p-10 -75.66 -17.42 59.99 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.916 0.486 . . . . 999.0 110.651 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.64 156.66 34.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.99 0.9 . . . . 350.44 109.776 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -79.2 139.2 38.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.796 -1.093 . . . . 999.0 109.568 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 22.0 mt -116.52 130.31 56.68 Favored 'General case' 0 N--CA 1.444 -0.769 0 O-C-N 124.539 1.149 . . . . 234.76 109.932 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 33.7 t -119.17 98.22 6.06 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 113.483 -1.689 . . . . 524.4 109.554 176.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 86.7 mt -101.74 125.59 48.44 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 113.744 -1.571 . . . . 236.72 109.386 -170.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 74.1 p -134.13 117.59 16.75 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 112.587 0.588 . . . . 164.49 112.587 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -89.01 -173.85 4.23 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 110.554 -0.165 . . . . 215.36 110.554 -179.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 39.6 m -115.94 139.96 49.72 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 122.778 1.275 . . . . 197.31 110.784 169.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ASP . . . . . 0.695 ' OD1' ' N ' ' B' ' 61' ' ' GLU . 63.9 t0 -79.3 -177.26 5.62 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 113.687 -1.597 . . . . 522.04 107.566 -174.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLU . . . . . 0.695 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 17.6 pt-20 -65.3 -44.36 88.17 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 124.275 0.984 . . . . 542.23 109.992 169.386 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 48.2 p-10 -104.35 23.78 12.62 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.794 0.838 . . . . 472.26 110.724 -172.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . 85.84 16.45 63.43 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 125.991 1.757 . . . . 258.49 116.262 157.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -78.47 168.23 20.11 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 119.195 1.497 . . . . 644.8 109.158 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 63.1 t -102.89 91.34 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-O 122.015 0.912 . . . . 337.27 109.793 170.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 43.1 t -86.88 157.57 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 107.147 -1.427 . . . . 231.46 107.147 -174.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -97.04 149.69 21.65 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.45 1.1 . . . . 222.16 111.344 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 39.0 mt -112.64 124.13 51.85 Favored 'General case' 0 C--N 1.348 0.542 0 C-N-CA 123.354 0.661 . . . . 167.34 111.015 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 27.2 m -134.85 -28.58 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.076 0 C-N-CA 118.598 -1.241 . . . . 367.12 110.343 -162.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -153.0 173.91 14.82 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.092 -1.077 . . . . 421.67 108.092 -167.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -84.44 -0.14 51.73 Favored 'General case' 0 C--O 1.223 -0.327 0 O-C-N 124.767 1.292 . . . . 262.84 109.369 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -85.07 -30.34 24.16 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-O 117.167 -1.397 . . . . 256.13 109.712 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -87.47 -14.98 38.96 Favored 'General case' 0 CA--C 1.519 -0.249 0 O-C-N 124.346 1.029 . . . . 252.76 110.315 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 6.8 mp -75.11 -24.48 58.09 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 124.28 0.988 . . . . 257.81 110.051 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' PHE . . . . . 0.439 ' HZ ' ' CZ ' ' A' ' 14' ' ' TYR . 59.2 t80 -69.08 -32.25 71.56 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.179 -0.674 . . . . 436.73 109.179 174.314 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -75.9 -20.95 57.62 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 110.027 -0.36 . . . . 244.02 110.027 -170.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 77.2 t -70.17 -28.48 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 109.205 -0.665 . . . . 274.04 109.205 -175.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' THR . . . . . . . . . . . . . 71.5 p -68.25 -47.67 67.15 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.532 0.605 . . . . 255.21 110.081 176.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -74.5 -16.77 60.83 Favored 'General case' 0 C--O 1.239 0.521 0 O-C-N 124.057 0.848 . . . . 220.34 112.236 -177.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 9.9 tp-100 -67.68 -32.21 72.72 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 123.566 0.746 . . . . 521.92 109.592 -179.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 24.1 ttm105 60.34 66.91 0.89 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 122.174 0.988 . . . . 565.34 111.11 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.1 tp -108.55 149.31 29.04 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 114.286 -1.324 . . . . 498.91 108.326 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LYS . . . . . 0.402 ' HG2' ' HD1' ' B' ' 84' ' ' PHE . 0.0 OUTLIER -76.2 -38.0 57.08 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 113.126 0.788 . . . . 682.26 113.126 -171.52 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 84' ' ' PHE . . . . . 0.548 ' HD2' ' HG3' ' B' ' 11' ' ' LYS . 15.3 p90 -157.86 139.14 13.51 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.068 -1.086 . . . . 286.23 108.068 167.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 32.3 tp -85.17 146.48 27.08 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.709 -0.678 . . . . 175.53 110.137 -175.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -133.54 122.14 23.15 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.065 0.459 . . . . 462.59 111.732 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ILE . . . . . 0.545 ' HB ' HG12 ' B' ' 12' ' ' VAL . 63.3 mt -123.05 123.21 67.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 CA-C-N 115.598 -0.728 . . . . 150.67 110.018 -165.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -94.48 139.1 31.58 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.369 -0.832 . . . . 353.56 110.478 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' VAL . . . . . . . . . . . . . 88.7 t -101.11 130.6 50.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 107.742 -1.207 . . . . 183.06 107.742 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -127.32 113.68 16.59 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.368 -0.833 . . . . 261.96 109.498 163.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.38 158.27 23.76 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.03 1.332 . . . . 428.17 109.759 177.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 117.522 -1.71 . . . . 545.57 112.758 178.824 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.515 2.823 0 CA-C-O 119.302 -0.38 . . . . 359.51 110.762 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -127.33 165.79 19.05 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 124.365 1.066 . . . . 707.09 112.395 -162.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.06 156.2 22.6 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 112.93 0.715 . . . . 325.55 112.93 -167.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 58.8 tp -101.63 125.53 48.3 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 118.0 0.364 . . . . 350.05 111.375 173.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.91 119.35 20.95 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.48 0 O-C-N 124.76 1.288 . . . . 175.67 109.628 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 80.6 t -113.65 127.19 71.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 O-C-N 124.568 1.167 . . . . 141.81 108.416 172.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.515 ' HG3' ' CD2' ' A' ' 84' ' ' PHE . 24.6 mttt -113.98 124.85 53.15 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 113.632 -1.622 . . . . 142.49 107.342 176.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.589 HG12 ' HB ' ' A' ' 87' ' ' ILE . 16.6 m -115.75 159.39 15.71 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 CA-C-N 115.588 -0.733 . . . . 163.57 109.044 176.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.6 p -162.69 113.66 1.51 Allowed 'General case' 0 C--O 1.248 0.981 0 CA-C-N 114.603 -1.18 . . . . 247.64 109.526 -170.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.439 ' CZ ' ' HZ ' ' B' ' 75' ' ' PHE . 49.4 t80 -140.18 138.42 35.14 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 112.61 -2.086 . . . . 280.72 106.711 179.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.3 32.64 72.69 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 125.274 1.609 . . . . 171.94 112.585 -167.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 63.83 22.51 66.48 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 115.373 0.909 . . . . 238.45 115.373 174.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.558 HG21 ' HA2' ' B' ' 29' ' ' GLY . 63.7 t -118.13 116.8 52.66 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 CA-C-N 117.369 0.584 . . . . 216.73 109.649 172.864 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.9 tp -73.02 142.2 47.7 Favored 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 125.607 1.817 . . . . 196.33 110.008 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . 1.577 ' CG ' ' CD ' ' A' ' 19' ' ' ARG . 8.0 mtp180 -133.05 175.14 9.64 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 113.913 -1.494 . . . . 205.67 109.184 172.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.73 139.03 5.2 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 107.732 -1.21 . . . . 277.08 107.732 -179.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -151.76 164.49 36.89 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 112.752 -2.022 . . . . 254.18 108.075 173.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -116.32 150.55 37.48 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 114.362 -1.29 . . . . 190.16 108.396 -170.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.5 t -129.02 123.66 21.95 Favored Pre-proline 0 N--CA 1.453 -0.323 0 N-CA-C 107.861 -1.163 . . . . 273.02 107.861 -176.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -77.34 167.85 23.91 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.046 1.164 . . . . 231.3 110.811 -175.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.9 m -120.43 161.75 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 108.613 -0.884 . . . . 285.89 108.613 170.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -75.39 -179.26 4.43 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.678 0.751 . . . . 279.47 109.938 175.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -70.61 -29.92 66.43 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.466 0.65 . . . . 292.73 109.877 165.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -67.06 -52.63 39.81 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 114.106 -1.407 . . . . 305.62 110.255 -175.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 136.98 -1.68 3.16 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 120.715 -0.755 . . . . 167.88 114.969 174.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -96.92 159.88 14.66 Favored 'General case' 0 C--O 1.21 -0.984 0 C-N-CA 116.97 -1.892 . . . . 408.47 110.344 178.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 40.4 mt -67.13 145.47 55.26 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 122.275 1.036 . . . . 240.0 109.698 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -98.21 37.06 1.49 Allowed 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 113.861 -1.518 . . . . 338.36 110.771 -171.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.91 171.91 19.59 Favored 'General case' 0 C--N 1.356 0.856 0 C-N-CA 124.462 1.105 . . . . 393.84 111.35 161.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.5 pm0 -132.63 179.49 6.12 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.722 -0.844 . . . . 468.17 108.722 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 57.2 mmm -64.13 -41.4 97.22 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 124.082 0.953 . . . . 276.85 110.751 -167.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.22 -26.93 65.05 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.469 -0.892 . . . . 350.05 109.505 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -87.25 -10.52 71.09 Favored Glycine 0 C--N 1.339 0.727 0 N-CA-C 110.778 -0.929 . . . . 179.37 110.778 175.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.4 tp -95.47 -42.73 8.31 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 119.926 -0.71 . . . . 171.7 110.152 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.6 mtpt -68.04 -31.26 70.8 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 124.341 1.025 . . . . 325.19 110.042 -171.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -86.62 -15.15 40.65 Favored 'General case' 0 N--CA 1.442 -0.864 0 O-C-N 124.512 1.133 . . . . 809.75 108.992 179.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.8 tptt -78.48 -38.5 40.81 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 123.85 0.719 . . . . 303.07 110.342 176.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 93.6 mt -68.45 -35.07 69.04 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 O-C-N 123.226 0.329 . . . . 217.04 110.618 177.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.09 -13.7 62.58 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-O 120.831 0.348 . . . . 238.5 110.186 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.82 -34.47 33.89 Favored 'General case' 0 C--O 1.223 -0.318 0 O-C-N 120.915 -1.116 . . . . 294.85 110.35 176.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 88.0 mt -75.85 -36.73 59.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.27 -0.641 . . . . 319.92 109.27 -172.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.502 ' O ' ' OD1' ' B' ' 28' ' ' ASN . 77.1 m-85 -107.58 0.61 22.73 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 124.244 0.965 . . . . 337.7 112.642 -165.773 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 56.3 38.99 30.29 Favored 'General case' 0 C--O 1.233 0.211 0 O-C-N 124.125 0.89 . . . . 641.97 109.467 -178.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.0 mt -84.95 146.83 27.03 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 113.955 -1.475 . . . . 390.08 109.983 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 47.6 m -69.9 118.48 12.8 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 113.821 -1.536 . . . . 378.65 107.432 173.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.68 -13.9 59.77 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 119.391 0.996 . . . . 514.25 110.126 -169.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 44.7 p-10 -77.54 -17.96 57.43 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.669 0.388 . . . . 999.0 110.152 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.45 158.74 34.57 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.976 -1.12 . . . . 518.2 107.976 179.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -76.05 137.9 40.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.745 -0.661 . . . . 364.29 111.16 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 31.1 mt -117.87 126.78 53.03 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 124.752 1.283 . . . . 280.44 108.33 178.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.3 t -116.59 98.93 6.81 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 112.811 -1.995 . . . . 204.38 108.332 174.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.1 mt -100.05 127.54 46.25 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-N 114.25 -1.341 . . . . 143.74 108.666 -171.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 45.4 p -130.53 117.32 19.41 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 118.843 -1.143 . . . . 186.37 110.532 -177.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.458 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 30.4 p90 -87.8 -173.72 4.42 Favored 'General case' 0 C--N 1.344 0.357 0 O-C-N 125.755 1.909 . . . . 202.25 109.722 179.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.8 m -115.78 139.95 49.68 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.07 0.938 . . . . 168.87 110.843 172.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.707 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 63.0 t0 -79.69 -176.82 5.56 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 114.172 -1.376 . . . . 367.34 107.535 -173.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.707 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 19.5 pt-20 -66.15 -43.39 87.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 123.797 0.685 . . . . 740.2 110.024 169.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 50.1 p-10 -105.35 24.81 11.51 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 123.543 0.737 . . . . 474.04 110.537 -173.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 86.65 16.25 62.16 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 126.752 2.12 . . . . 259.52 116.311 154.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -76.89 170.5 16.38 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 118.994 1.397 . . . . 511.45 109.696 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.3 t -101.78 90.05 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 122.633 1.206 . . . . 250.35 109.595 168.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 61.2 t -87.05 157.72 3.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 106.295 -1.742 . . . . 229.17 106.295 -176.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -95.67 148.3 22.69 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 114.716 -1.129 . . . . 249.97 111.307 176.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.458 ' HG ' ' HD1' ' A' ' 58' ' ' TYR . 37.4 mt -111.33 127.82 55.76 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.095 0.558 . . . . 233.92 110.514 171.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 22.9 m -135.08 -28.08 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 119.094 -1.043 . . . . 415.38 110.108 -168.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.4 p-10 -153.66 174.77 14.05 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 120.031 -0.668 . . . . 377.86 109.815 -163.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -85.03 1.65 46.71 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 124.501 1.126 . . . . 415.21 110.429 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -83.39 -31.79 26.52 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.958 -1.02 . . . . 440.36 109.809 174.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -86.05 -16.19 38.92 Favored 'General case' 0 C--N 1.343 0.315 0 O-C-N 124.553 1.158 . . . . 365.32 110.735 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.3 mp -75.21 -24.04 57.71 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 124.77 1.293 . . . . 262.41 110.313 173.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -68.62 -33.59 74.29 Favored 'General case' 0 N--CA 1.441 -0.883 0 O-C-N 123.972 0.795 . . . . 582.74 109.81 174.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -76.87 -18.6 58.24 Favored 'General case' 0 C--O 1.214 -0.772 0 CA-C-N 115.412 -0.813 . . . . 267.97 110.19 -169.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.0 t -68.85 -30.1 45.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 110.158 -0.312 . . . . 307.57 110.158 -176.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 73.8 p -68.62 -48.04 65.1 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 110.138 -0.319 . . . . 296.72 110.138 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -74.5 -17.3 60.78 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 124.102 0.876 . . . . 272.8 112.145 -176.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -68.29 -31.03 70.19 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 115.708 -0.678 . . . . 319.41 109.318 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 20.6 ttm105 61.98 68.39 0.69 Allowed 'General case' 0 C--O 1.239 0.511 0 O-C-N 124.265 0.978 . . . . 999.0 110.671 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.2 tp -107.55 149.04 28.48 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 114.115 -1.402 . . . . 534.33 110.243 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.34 -37.8 56.82 Favored 'General case' 0 C--N 1.347 0.493 0 N-CA-C 113.107 0.78 . . . . 999.0 113.107 -172.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.515 ' CD2' ' HG3' ' A' ' 11' ' ' LYS . 15.2 p90 -158.03 140.2 14.24 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.217 1.407 . . . . 339.19 108.267 164.8 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.9 tp -85.13 145.37 27.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.845 -0.428 . . . . 230.62 109.845 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.409 ' HE3' ' HB3' ' A' ' 86' ' ' LYS . 21.4 mtpp -129.68 123.7 31.8 Favored 'General case' 0 C--N 1.347 0.496 0 N-CA-C 112.684 0.624 . . . . 301.51 112.684 179.611 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.589 ' HB ' HG12 ' A' ' 12' ' ' VAL . 37.5 mt -121.62 120.45 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 O-C-N 125.227 1.579 . . . . 146.86 109.973 -167.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -96.75 138.68 33.94 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 114.887 -1.052 . . . . 228.01 109.342 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 93.5 t -100.55 133.44 43.68 Favored 'Isoleucine or valine' 0 C--N 1.344 0.364 0 CA-C-N 114.508 -1.224 . . . . 226.32 109.107 175.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -127.3 112.8 15.48 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.032 -0.729 . . . . 233.33 109.032 164.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.17 159.61 21.54 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.361 1.465 . . . . 279.47 109.463 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.477 -1.735 . . . . 281.5 113.067 174.053 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . 0.414 . . . . . . . 0 CA--C 1.589 2.461 0 CA-C-O 120.99 0.424 . . . . 248.06 110.001 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -125.61 164.56 20.29 Favored 'General case' 0 C--N 1.377 1.792 0 O-C-N 119.175 -2.203 . . . . 451.43 115.656 -155.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.75 164.8 14.45 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.217 1.407 . . . . 303.56 111.208 -173.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 57.5 tp -102.49 125.85 49.34 Favored 'General case' 0 C--N 1.347 0.499 0 O-C-N 121.366 -0.834 . . . . 253.77 111.083 173.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.0 t -76.64 119.59 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 119.142 -0.456 . . . . 153.93 110.44 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 91.8 t -113.05 125.57 70.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 O-C-N 125.114 1.508 . . . . 118.2 109.965 175.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.548 ' HG3' ' HD2' ' B' ' 84' ' ' PHE . 28.8 mttt -114.0 123.31 49.38 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 107.892 -1.151 . . . . 186.16 107.892 177.54 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.545 HG12 ' HB ' ' B' ' 87' ' ' ILE . 28.3 m -116.07 162.84 13.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 109.198 -0.667 . . . . 205.02 109.198 174.258 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.4 p -157.4 118.94 3.68 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.619 1.2 . . . . 245.98 110.584 -175.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -136.33 138.05 41.27 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 107.906 -1.146 . . . . 244.54 107.906 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 60.84 34.64 87.94 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.99 1.431 . . . . 159.89 111.676 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.68 24.79 72.79 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 113.695 -1.252 . . . . 402.65 114.445 174.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 96.2 t -118.29 112.37 37.98 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.924 0 CA-C-N 117.481 0.64 . . . . 315.49 109.819 173.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 19.9 tp -75.82 142.46 42.24 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 124.477 1.11 . . . . 508.16 108.336 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ARG . . . . . . . . . . . . . 10.5 mtp180 -130.25 176.22 8.29 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 114.657 -1.156 . . . . 217.49 108.03 172.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.41 141.76 13.72 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 120.597 -1.315 . . . . 215.8 107.588 170.768 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -149.8 166.73 28.58 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 112.81 -1.996 . . . . 193.24 108.207 173.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 -116.57 150.22 38.36 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 107.364 -1.347 . . . . 272.21 107.364 -168.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.83 123.13 21.83 Favored Pre-proline 0 C--O 1.222 -0.393 0 N-CA-C 106.625 -1.62 . . . . 261.33 106.625 -177.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.37 164.09 33.32 Favored 'Trans proline' 0 C--N 1.352 0.746 0 N-CA-C 109.629 -0.951 . . . . 266.39 109.629 -176.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 2.9 m -118.27 158.68 19.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 107.09 -1.448 . . . . 221.23 107.09 172.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -77.16 -178.88 5.28 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.226 -0.989 . . . . 186.28 109.421 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.25 -26.74 61.24 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.431 -0.581 . . . . 302.67 109.431 164.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ASN . . . . . 0.502 ' OD1' ' O ' ' A' ' 46' ' ' PHE . 29.5 t30 -62.23 -53.71 51.37 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.087 1.355 . . . . 282.59 111.021 178.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLY . . . . . 0.558 ' HA2' HG21 ' A' ' 17' ' ' VAL . . . 136.34 -12.32 4.07 Favored Glycine 0 C--N 1.345 1.029 0 C-N-CA 119.73 -1.224 . . . . 182.31 115.788 179.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -95.58 161.46 14.04 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 118.22 -1.392 . . . . 431.68 110.13 -179.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 84.5 mt -71.65 144.83 49.26 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 114.085 -1.416 . . . . 319.91 108.929 -178.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -99.25 41.82 1.13 Allowed 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 123.854 0.721 . . . . 301.96 110.894 -169.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.96 172.57 18.44 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 124.59 1.156 . . . . 295.84 110.994 160.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 25.5 pm0 -133.02 176.99 8.01 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 108.55 -0.907 . . . . 305.14 108.55 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' MET . . . . . . . . . . . . . 66.7 mmm -60.57 -42.85 97.49 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 124.816 1.246 . . . . 273.49 111.34 -170.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.57 -33.35 74.79 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.696 -1.138 . . . . 207.01 109.703 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . -89.08 -10.18 66.65 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.25 -1.14 . . . . 159.28 110.25 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 13.8 tp -95.54 -41.76 8.78 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 120.211 -0.595 . . . . 195.73 109.778 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -67.92 -30.28 69.57 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 124.465 1.103 . . . . 395.07 109.707 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -85.98 -14.92 43.14 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 119.702 -0.799 . . . . 693.63 109.588 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' LYS . . . . . . . . . . . . . 14.3 tptt -79.95 -37.8 33.71 Favored 'General case' 0 C--O 1.224 -0.282 0 O-C-N 123.42 0.45 . . . . 240.64 110.186 176.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 92.2 mt -68.11 -35.88 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 O-C-N 123.368 0.417 . . . . 258.2 110.111 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.0 -13.59 62.55 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.962 -0.384 . . . . 175.86 109.962 179.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.93 -35.3 32.54 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 120.697 -1.252 . . . . 273.46 110.193 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 75.9 mt -74.49 -37.31 63.19 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.609 -0.515 . . . . 219.32 109.609 -171.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -109.28 1.41 20.14 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 116.257 -0.429 . . . . 293.92 112.122 -165.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 56.77 40.43 29.09 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.363 0.665 . . . . 621.91 110.495 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 35.9 mt -84.29 146.92 27.5 Favored 'General case' 0 N--CA 1.443 -0.777 0 O-C-N 125.454 1.721 . . . . 361.88 109.536 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 35.7 m -66.89 118.85 10.95 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 113.628 -1.624 . . . . 299.72 108.0 169.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.57 -14.78 59.98 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.259 0.481 . . . . 416.15 110.54 -167.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 45.6 p-10 -75.66 -17.42 59.99 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.916 0.486 . . . . 999.0 110.651 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.64 156.66 34.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.99 0.9 . . . . 350.44 109.776 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -79.2 139.2 38.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.796 -1.093 . . . . 999.0 109.568 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 22.0 mt -116.52 130.31 56.68 Favored 'General case' 0 N--CA 1.444 -0.769 0 O-C-N 124.539 1.149 . . . . 234.76 109.932 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 33.7 t -119.17 98.22 6.06 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 113.483 -1.689 . . . . 524.4 109.554 176.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 86.7 mt -101.74 125.59 48.44 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 113.744 -1.571 . . . . 236.72 109.386 -170.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 74.1 p -134.13 117.59 16.75 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 112.587 0.588 . . . . 164.49 112.587 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -89.01 -173.85 4.23 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 110.554 -0.165 . . . . 215.36 110.554 -179.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 39.6 m -115.94 139.96 49.72 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 122.778 1.275 . . . . 197.31 110.784 169.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.695 ' OD1' ' N ' ' B' ' 61' ' ' GLU . 63.9 t0 -79.3 -177.26 5.62 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 113.687 -1.597 . . . . 522.04 107.566 -174.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.695 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 17.6 pt-20 -65.3 -44.36 88.17 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 124.275 0.984 . . . . 542.23 109.992 169.386 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 48.2 p-10 -104.35 23.78 12.62 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.794 0.838 . . . . 472.26 110.724 -172.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . 85.84 16.45 63.43 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 125.991 1.757 . . . . 258.49 116.262 157.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -78.47 168.23 20.11 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 119.195 1.497 . . . . 644.8 109.158 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 63.1 t -102.89 91.34 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-O 122.015 0.912 . . . . 337.27 109.793 170.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 43.1 t -86.88 157.57 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 107.147 -1.427 . . . . 231.46 107.147 -174.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -97.04 149.69 21.65 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.45 1.1 . . . . 222.16 111.344 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 39.0 mt -112.64 124.13 51.85 Favored 'General case' 0 C--N 1.348 0.542 0 C-N-CA 123.354 0.661 . . . . 167.34 111.015 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 27.2 m -134.85 -28.58 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.076 0 C-N-CA 118.598 -1.241 . . . . 367.12 110.343 -162.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -153.0 173.91 14.82 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.092 -1.077 . . . . 421.67 108.092 -167.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -84.44 -0.14 51.73 Favored 'General case' 0 C--O 1.223 -0.327 0 O-C-N 124.767 1.292 . . . . 262.84 109.369 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -85.07 -30.34 24.16 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-O 117.167 -1.397 . . . . 256.13 109.712 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -87.47 -14.98 38.96 Favored 'General case' 0 CA--C 1.519 -0.249 0 O-C-N 124.346 1.029 . . . . 252.76 110.315 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 6.8 mp -75.11 -24.48 58.09 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 124.28 0.988 . . . . 257.81 110.051 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.439 ' HZ ' ' CZ ' ' A' ' 14' ' ' TYR . 59.2 t80 -69.08 -32.25 71.56 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.179 -0.674 . . . . 436.73 109.179 174.314 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -75.9 -20.95 57.62 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 110.027 -0.36 . . . . 244.02 110.027 -170.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 77.2 t -70.17 -28.48 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 109.205 -0.665 . . . . 274.04 109.205 -175.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' THR . . . . . . . . . . . . . 71.5 p -68.25 -47.67 67.15 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.532 0.605 . . . . 255.21 110.081 176.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -74.5 -16.77 60.83 Favored 'General case' 0 C--O 1.239 0.521 0 O-C-N 124.057 0.848 . . . . 220.34 112.236 -177.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -67.68 -32.21 72.72 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 123.566 0.746 . . . . 521.92 109.592 -179.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 24.1 ttm105 60.34 66.91 0.89 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 122.174 0.988 . . . . 565.34 111.11 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.1 tp -108.55 149.31 29.04 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 114.286 -1.324 . . . . 498.91 108.326 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LYS . . . . . 0.402 ' HG2' ' HD1' ' B' ' 84' ' ' PHE . 0.0 OUTLIER -76.2 -38.0 57.08 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 113.126 0.788 . . . . 682.26 113.126 -171.52 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' PHE . . . . . 0.548 ' HD2' ' HG3' ' B' ' 11' ' ' LYS . 15.3 p90 -157.86 139.14 13.51 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.068 -1.086 . . . . 286.23 108.068 167.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 32.3 tp -85.17 146.48 27.08 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.709 -0.678 . . . . 175.53 110.137 -175.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -133.54 122.14 23.15 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.065 0.459 . . . . 462.59 111.732 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ILE . . . . . 0.545 ' HB ' HG12 ' B' ' 12' ' ' VAL . 63.3 mt -123.05 123.21 67.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 CA-C-N 115.598 -0.728 . . . . 150.67 110.018 -165.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -94.48 139.1 31.58 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.369 -0.832 . . . . 353.56 110.478 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' VAL . . . . . . . . . . . . . 88.7 t -101.11 130.6 50.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 107.742 -1.207 . . . . 183.06 107.742 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -127.32 113.68 16.59 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.368 -0.833 . . . . 261.96 109.498 163.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.38 158.27 23.76 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.03 1.332 . . . . 428.17 109.759 177.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 117.522 -1.71 . . . . 545.57 112.758 178.824 . . . . . . . . 0 0 . 1 stop_ save_