data_4gbi_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 4gbi _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 109.704 -1.358 . . . . 63.490000000000002 109.704 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.8 tt -54.59 -39.08 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 CA-C-O 122.179 0.99 . . . . 60.299999999999997 111.75 -175.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 36.0 t -77.42 -50.17 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 C-N-CA 118.706 -1.197 . . . . 63.130000000000003 112.114 -172.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.88 -49.79 62.27 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.792 -1.188 . . . . 98.549999999999997 107.792 172.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -70.78 -35.9 72.8 Favored 'General case' 0 C--O 1.252 1.205 0 N-CA-C 115.979 1.844 . . . . 83.150000000000006 115.979 -171.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.7 m -106.4 -24.9 12.11 Favored 'General case' 0 CA--C 1.468 -2.209 0 N-CA-C 114.251 1.204 . . . . 54.549999999999997 114.251 -172.774 -54.476 -62.674 -78.275 101.372 1.954 109.82 156.088 -71.544 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.7 m -82.83 -6.5 59.46 Favored 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.889 1.811 . . . . 55.060000000000002 115.889 170.012 -65.2 -69.989 -106.218 99.097 2.009 105.191 -130.348 -175.629 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 31.4 p -97.48 -56.16 2.61 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 108.0 -1.111 . . . . 57.159999999999997 108.0 174.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -109.59 163.75 13.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.787 0.835 . . . . 68.150000000000006 108.953 175.974 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 55.5 mt -82.83 123.01 38.12 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.524 0 N-CA-C 101.519 -3.511 . . . . 55.899999999999999 101.519 -171.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.7 m -80.89 133.92 35.65 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 107.2 -1.407 . . . . 44.560000000000002 107.2 166.264 -71.544 156.088 -78.275 109.82 1.954 101.372 -62.674 -54.476 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 56.5 p -84.58 172.06 11.93 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 103.44 -2.8 . . . . 47.109999999999999 103.44 174.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.6 mt -51.76 -36.39 47.13 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-O 122.661 1.22 . . . . 53.75 111.443 175.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -66.7 -48.16 70.14 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.325 -1.361 . . . . 57.630000000000003 107.325 -172.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -63.42 -36.32 83.35 Favored 'General case' 0 CA--C 1.494 -1.196 0 CA-C-O 121.88 0.848 . . . . 55.259999999999998 111.665 -179.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -67.19 -32.49 73.59 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.424 -1.262 . . . . 45.159999999999997 109.287 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -64.99 -23.84 67.34 Favored 'General case' 0 CA--C 1.488 -1.427 0 CA-C-O 121.882 0.849 . . . . 57.490000000000002 112.793 -174.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -53.75 -35.91 61.76 Favored 'General case' 0 CA--C 1.472 -2.045 0 CA-C-N 112.939 -1.937 . . . . 51.799999999999997 114.141 172.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -95.03 27.63 3.11 Favored 'General case' 0 CA--C 1.571 1.769 0 O-C-N 125.31 1.632 . . . . 57.289999999999999 115.389 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.8 m -88.11 169.95 11.49 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.686 1.195 . . . . 56.740000000000002 112.614 174.064 -68.306 -46.835 -92.033 108.554 1.999 107.872 -54.345 -62.182 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.244 0.766 0 CA-C-N 114.053 -1.43 . . . . 74.409999999999997 113.405 178.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' PHE . . . . . 0.468 ' N ' ' CD2' ' B' ' 1' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.863 0 N-CA-C 109.241 -0.651 . . . . 73.569999999999993 109.241 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . 0.62 ' O ' ' N ' ' B' ' 6' ' ' LEU . 34.6 m -63.23 -44.91 99.48 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 N-CA-C 119.975 3.324 . . . . 78.739999999999995 119.975 -164.917 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASN . . . . . 0.513 ' N ' ' CG2' ' B' ' 2' ' ' VAL . 1.1 m-80 -68.05 -11.61 59.29 Favored 'General case' 0 C--O 1.195 -1.816 0 CA-C-N 115.999 -0.546 . . . . 92.859999999999999 111.918 -164.482 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -96.26 -30.42 13.47 Favored 'General case' 0 C--O 1.196 -1.75 0 C-N-CA 119.859 -0.737 . . . . 64.010000000000005 110.856 163.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' HIS . . . . . 0.494 ' N ' ' O ' ' B' ' 2' ' ' VAL . 63.0 t60 -69.56 -36.04 75.96 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 114.857 1.429 . . . . 49.710000000000001 114.857 170.805 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . 0.62 ' N ' ' O ' ' B' ' 2' ' ' VAL . 62.2 mt -76.94 -34.07 57.65 Favored 'General case' 0 C--O 1.21 -1.002 0 O-C-N 120.877 -1.139 . . . . 40.909999999999997 109.108 173.405 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 42.7 t -60.32 -47.08 87.56 Favored 'General case' 0 C--O 1.207 -1.142 0 O-C-N 121.467 -0.771 . . . . 50.950000000000003 109.092 176.198 -175.629 -130.348 -106.218 105.191 2.009 99.097 -69.989 -65.2 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLY . . . . . 0.47 ' O ' ' C ' ' B' ' 9' ' ' SER . . . -62.28 -42.03 99.72 Favored Glycine 0 C--N 1.316 -0.545 0 N-CA-C 108.515 -1.834 . . . . 61.549999999999997 108.515 -169.504 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . 0.47 ' C ' ' O ' ' B' ' 8' ' ' GLY . 1.0 OUTLIER -33.38 -52.75 0.39 Allowed 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 105.444 -2.058 . . . . 62.25 105.444 172.577 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -73.8 -26.15 60.48 Favored 'General case' 0 CA--C 1.455 -2.681 0 C-N-CA 117.432 -1.707 . . . . 47.670000000000002 113.645 -170.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 61.0 mt -77.2 -44.53 29.75 Favored 'General case' 0 CA--C 1.487 -1.446 0 N-CA-C 106.827 -1.545 . . . . 43.670000000000002 106.827 -169.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 2.5 m -61.12 -39.88 83.9 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.478 0 CA-C-N 115.212 -0.904 . . . . 43.049999999999997 109.657 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.48 -40.52 80.92 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 112.475 0.546 . . . . 51.659999999999997 112.475 -178.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ALA . . . . . 0.422 ' O ' ' CG1' ' B' ' 18' ' ' VAL . . . -76.74 -32.91 58.08 Favored 'General case' 0 C--O 1.256 1.403 0 N-CA-C 113.199 0.814 . . . . 45.82 113.199 176.25 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 mt -62.5 -25.21 67.9 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.059 0.457 . . . . 45.68 111.992 169.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -71.94 -43.12 65.78 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 112.676 0.621 . . . . 43.600000000000001 112.676 173.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.19 -46.88 72.58 Favored 'General case' 0 C--O 1.211 -0.96 0 C-N-CA 118.586 -1.246 . . . . 35.840000000000003 111.242 -178.548 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . 0.422 ' CG1' ' O ' ' B' ' 14' ' ' ALA . 2.3 p -70.83 -42.03 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.602 0 C-N-CA 125.238 1.415 . . . . 37.579999999999998 114.295 -177.768 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.8 m -79.88 -7.58 58.81 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 114.368 1.247 . . . . 44.189999999999998 114.368 -177.144 -62.182 -54.345 -92.033 107.872 1.999 108.554 -46.835 -68.306 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 47.94 -113.02 1.24 Allowed Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.075 -0.583 . . . . 53.630000000000003 112.04 174.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -97.29 -22.61 16.56 Favored 'General case' 0 C--O 1.261 1.663 0 N-CA-C 114.935 1.457 . . . . 69.400000000000006 114.935 -175.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 31.5 mtm180 -55.92 -37.1 68.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 120.776 -0.37 . . . . 51.549999999999997 111.111 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.45 171.36 42.6 Favored Glycine 0 N--CA 1.487 2.044 0 C-N-CA 119.654 -1.26 . . . . 43.859999999999999 111.525 -178.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -147.71 167.89 23.49 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-O 121.532 0.682 . . . . 48.789999999999999 109.709 170.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -104.52 138.85 40.27 Favored 'General case' 0 CA--C 1.474 -1.978 0 N-CA-C 104.355 -2.461 . . . . 66.150000000000006 104.355 166.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -120.49 108.9 14.65 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 119.431 -0.907 . . . . 65.040000000000006 108.594 164.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.35 159.83 25.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.809 -0.632 . . . . 93.640000000000001 109.494 174.845 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ASP . . . . . 0.573 ' O ' ' CB ' ' B' ' 29' ' ' LYS . 0.4 OUTLIER -158.1 159.75 36.58 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.354 -0.98 . . . . 91.840000000000003 108.354 168.1 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . 0.573 ' CB ' ' O ' ' B' ' 28' ' ' ASP . 35.5 tttm . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 119.587 -0.845 . . . . 102.26000000000001 109.613 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.8 0 N-CA-C 111.138 -0.785 . . . . 67.939999999999998 111.138 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' ILE . . . . . . . . . . . . . 3.0 tt -64.48 -35.73 75.3 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 N-CA-C 107.371 -1.344 . . . . 58.520000000000003 107.371 177.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 39.7 t -68.55 -45.21 82.16 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 114.693 -1.14 . . . . 52.840000000000003 110.411 -177.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -78.37 -15.03 59.12 Favored 'General case' 0 C--O 1.25 1.093 0 CA-C-N 114.66 -1.155 . . . . 66.989999999999995 111.388 -177.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -100.02 -24.3 14.65 Favored 'General case' 0 CA--C 1.565 1.536 0 C-N-CA 120.016 -0.674 . . . . 72.120000000000005 111.884 175.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' CYS . . . . . . . . . . . . . 11.8 m -122.92 -4.3 8.58 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 115.988 1.847 . . . . 55.920000000000002 115.988 -173.992 -45.515 -50.463 -58.443 103.632 2.02 105.208 164.252 -104.983 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' CYS . . . . . 0.444 ' O ' ' ND1' ' D' ' 5' ' ' HIS . 42.8 t -114.47 -52.18 2.73 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 125.704 1.877 . . . . 53.619999999999997 112.952 173.328 -175.536 47.588 76.847 129.488 2.116 118.505 -25.159 -106.714 2 2 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' THR . . . . . . . . . . . . . 43.6 p -71.48 -36.27 71.11 Favored 'General case' 0 CA--C 1.589 2.453 0 CA-C-N 116.017 -0.538 . . . . 71.609999999999999 110.113 173.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.9 156.57 34.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.864 -1.148 . . . . 64.019999999999996 112.285 166.862 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.11 153.15 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 O-C-N 121.217 -0.927 . . . . 86.519999999999996 109.927 177.225 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.82 142.03 51.71 Favored 'General case' 0 CA--C 1.463 -2.37 0 C-N-CA 124.292 1.037 . . . . 67.349999999999994 109.038 -176.926 -104.983 164.252 -58.443 105.208 2.02 103.632 -50.463 -45.515 2 2 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' SER . . . . . 0.774 ' OG ' ' CG ' ' C' ' 15' ' ' GLN . 54.2 p -83.63 168.92 15.88 Favored 'General case' 0 C--O 1.249 1.061 0 O-C-N 125.338 1.649 . . . . 72.719999999999999 109.792 167.521 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' LEU . . . . . 0.634 ' CD2' ' C ' ' C' ' 13' ' ' LEU . 0.9 OUTLIER -55.31 -67.03 0.31 Allowed 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 114.429 -1.26 . . . . 66.680000000000007 109.615 173.561 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' TYR . . . . . 0.477 ' C ' ' O ' ' C' ' 13' ' ' LEU . 1.4 t80 -35.13 -54.96 0.61 Allowed 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 105.49 -2.041 . . . . 78.519999999999996 105.49 175.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' GLN . . . . . 0.774 ' CG ' ' OG ' ' C' ' 12' ' ' SER . 5.2 mt-30 -58.45 -34.62 71.03 Favored 'General case' 0 C--O 1.173 -2.969 0 CA-C-N 115.333 -0.849 . . . . 72.579999999999998 108.915 -169.113 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LEU . . . . . 0.437 ' N ' ' O ' ' C' ' 13' ' ' LEU . 12.5 mt -65.5 -37.15 85.95 Favored 'General case' 0 C--O 1.175 -2.859 0 N-CA-C 116.136 1.902 . . . . 52.969999999999999 116.136 172.894 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -71.38 -18.8 62.34 Favored 'General case' 0 C--O 1.193 -1.889 0 CA-C-N 119.584 1.084 . . . . 65.560000000000002 110.682 -171.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -48.55 -28.95 3.73 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.121 -0.945 . . . . 75.25 109.622 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -101.19 15.92 27.18 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.421 -0.809 . . . . 50.399999999999999 110.607 -172.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 62.6 m -81.53 166.67 20.07 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 116.755 -1.978 . . . . 44.759999999999998 108.78 172.266 -56.774 -54.082 -87.556 107.288 2.024 102.169 -60.277 -65.289 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' ASN . . . . . 0.502 ' OD1' ' N ' ' D' ' 24' ' ' PHE . 21.4 m120 . . . . . 0 CA--C 1.504 -0.825 0 CA-C-O 116.084 -1.912 . . . . 41.210000000000001 108.293 175.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' PHE . . . . . . . . . . . . . 23.6 t80 . . . . . 0 N--CA 1.512 2.641 0 CA-C-O 119.523 -0.275 . . . . 64.0 110.464 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 17.1 m -60.54 129.18 22.82 Favored 'Isoleucine or valine' 0 C--O 1.245 0.863 0 N-CA-C 115.934 1.827 . . . . 61.090000000000003 115.934 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -91.29 73.45 6.18 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 106.659 -1.608 . . . . 80.010000000000005 106.659 166.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -147.15 153.63 40.12 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.055 -0.52 . . . . 106.16 109.924 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' HIS . . . . . 0.444 ' ND1' ' O ' ' C' ' 7' ' ' CYS . 34.2 m-70 -68.5 121.87 17.26 Favored 'General case' 0 CA--C 1.498 -1.036 0 CA-C-N 116.112 -0.495 . . . . 63.600000000000001 110.332 168.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 88.7 mt -100.16 107.77 19.72 Favored 'General case' 0 C--O 1.267 1.994 0 O-C-N 121.417 -0.802 . . . . 50.57 111.187 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -106.0 8.58 32.47 Favored 'General case' 0 CA--C 1.549 0.936 1 N-CA-C 123.836 4.754 . . . . 46.850000000000001 123.836 -158.744 -106.714 -25.159 76.847 118.505 2.116 129.488 47.588 -175.536 3 3 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' GLY . . . . . . . . . . . . . . . -176.78 -120.02 0.6 Allowed Glycine 0 CA--C 1.505 -0.582 0 CA-C-N 119.984 1.266 . . . . 35.420000000000002 112.605 -172.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.4 -33.9 71.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 105.554 -2.017 . . . . 41.719999999999999 105.554 173.888 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -60.08 -35.78 75.94 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-N 115.521 -0.763 . . . . 42.18 110.52 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -57.93 8.73 Favored 'General case' 0 C--O 1.252 1.191 0 N-CA-C 103.139 -2.912 . . . . 41.770000000000003 103.139 -178.743 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' VAL . . . . . 0.408 ' O ' ' C ' ' D' ' 13' ' ' GLU . 51.3 t -54.29 -62.09 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.93 0 CA-C-N 114.228 -1.351 . . . . 43.200000000000003 109.766 -176.367 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' GLU . . . . . 0.408 ' C ' ' O ' ' D' ' 12' ' ' VAL . 7.2 tp10 -38.92 -57.68 1.21 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.98 0.895 . . . . 63.759999999999998 112.237 175.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' D' ' 15' ' ' LEU . . . -45.99 -65.3 0.57 Allowed 'General case' 0 CA--C 1.5 -0.966 0 O-C-N 121.602 -0.687 . . . . 66.560000000000002 109.161 176.587 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' LEU . . . . . 0.403 ' C ' ' O ' ' D' ' 14' ' ' ALA . 25.4 mt -42.26 -49.15 5.04 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.864 0.84 . . . . 50.149999999999999 111.219 179.373 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -45.34 -50.44 12.13 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 114.567 -1.197 . . . . 65.959999999999994 109.364 -178.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 73.2 mt -85.27 -33.21 22.2 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 113.412 0.893 . . . . 69.430000000000007 113.412 -175.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 2.9 t -61.28 -43.29 96.25 Favored 'Isoleucine or valine' 0 C--O 1.254 1.312 0 N-CA-C 108.042 -1.095 . . . . 50.460000000000001 108.042 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 97.0 m -86.61 -45.73 10.76 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.549 -0.75 . . . . 64.359999999999999 112.813 -171.134 -65.289 -60.277 -87.556 102.169 2.024 107.288 -54.082 -56.774 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.76 -137.49 48.53 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 110.071 -1.211 . . . . 68.950000000000003 110.071 176.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -47.37 -42.53 21.95 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 114.771 -0.714 . . . . 90.390000000000001 111.734 -174.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -42.39 -53.51 4.19 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 122.183 -0.323 . . . . 75.579999999999998 111.325 175.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.86 -171.53 30.23 Favored Glycine 0 C--O 1.252 1.22 0 N-CA-C 110.408 -1.077 . . . . 56.859999999999999 110.408 -175.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' PHE . . . . . 0.502 ' N ' ' OD1' ' C' ' 21' ' ' ASN . 21.8 p90 -160.81 171.33 18.98 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 117.349 2.352 . . . . 54.369999999999997 117.349 -170.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 53.6 p90 -135.5 125.06 25.09 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-N 115.026 -0.988 . . . . 56.57 110.203 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -121.41 114.84 21.86 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 105.485 -2.042 . . . . 53.509999999999998 105.485 -176.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' THR . . . . . . . . . . . . 0.264 77.6 p -92.68 -22.05 19.65 Favored 'General case' 0 CA--C 1.5 -0.975 0 C-N-CA 126.847 2.059 . . . . 61.789999999999999 112.071 179.294 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' ASP . . . . . . . . . . . . . 17.0 t70 66.06 -145.92 0.19 Allowed 'General case' 0 C--O 1.26 1.636 0 N-CA-C 104.888 -2.264 . . . . 57.810000000000002 104.888 -170.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -68.16 157.31 35.65 Favored 'General case' 0 CA--C 1.484 -1.587 0 N-CA-C 105.208 -2.145 . . . . 60.909999999999997 105.208 -171.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' THR . . . . . . . . . . . . . 6.4 p . . . . . 0 C--O 1.258 1.526 0 O-C-N 124.937 1.398 . . . . 79.109999999999999 109.033 -179.465 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' CRS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' CRS . . . . . 0.55 ' C5 ' ' O ' ' B' ' 28' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 109.704 -1.358 . . . . 63.490000000000002 109.704 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . 0.412 HG23 HG23 ' A' ' 3' ' ' VAL . 12.8 tt -54.59 -39.08 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 CA-C-O 122.179 0.99 . . . . 60.299999999999997 111.75 -175.102 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . 0.412 HG23 HG23 ' A' ' 2' ' ' ILE . 36.0 t -77.42 -50.17 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 C-N-CA 118.706 -1.197 . . . . 63.130000000000003 112.114 -172.374 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.88 -49.79 62.27 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.792 -1.188 . . . . 98.549999999999997 107.792 172.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -70.78 -35.9 72.8 Favored 'General case' 0 C--O 1.252 1.205 0 N-CA-C 115.979 1.844 . . . . 83.150000000000006 115.979 -171.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.7 m -106.4 -24.9 12.11 Favored 'General case' 0 CA--C 1.468 -2.209 0 N-CA-C 114.251 1.204 . . . . 54.549999999999997 114.251 -172.774 -54.476 -62.674 -78.275 101.372 1.954 109.82 156.088 -71.544 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.7 m -82.83 -6.5 59.46 Favored 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.889 1.811 . . . . 55.060000000000002 115.889 170.012 -65.2 -69.989 -106.218 99.097 2.009 105.191 -130.348 -175.629 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 31.4 p -97.48 -56.16 2.61 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 108.0 -1.111 . . . . 57.159999999999997 108.0 174.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -109.59 163.75 13.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.787 0.835 . . . . 68.150000000000006 108.953 175.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 55.5 mt -82.83 123.01 38.12 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.524 0 N-CA-C 101.519 -3.511 . . . . 55.899999999999999 101.519 -171.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.7 m -80.89 133.92 35.65 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 107.2 -1.407 . . . . 44.560000000000002 107.2 166.264 -71.544 156.088 -78.275 109.82 1.954 101.372 -62.674 -54.476 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 56.5 p -84.58 172.06 11.93 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 103.44 -2.8 . . . . 47.109999999999999 103.44 174.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.6 mt -51.76 -36.39 47.13 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-O 122.661 1.22 . . . . 53.75 111.443 175.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -66.7 -48.16 70.14 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.325 -1.361 . . . . 57.630000000000003 107.325 -172.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -63.42 -36.32 83.35 Favored 'General case' 0 CA--C 1.494 -1.196 0 CA-C-O 121.88 0.848 . . . . 55.259999999999998 111.665 -179.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -67.19 -32.49 73.59 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.424 -1.262 . . . . 45.159999999999997 109.287 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -64.99 -23.84 67.34 Favored 'General case' 0 CA--C 1.488 -1.427 0 CA-C-O 121.882 0.849 . . . . 57.490000000000002 112.793 -174.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -53.75 -35.91 61.76 Favored 'General case' 0 CA--C 1.472 -2.045 0 CA-C-N 112.939 -1.937 . . . . 51.799999999999997 114.141 172.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -95.03 27.63 3.11 Favored 'General case' 0 CA--C 1.571 1.769 0 O-C-N 125.31 1.632 . . . . 57.289999999999999 115.389 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.8 m -88.11 169.95 11.49 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.686 1.195 . . . . 56.740000000000002 112.614 174.064 -68.306 -46.835 -92.033 108.554 1.999 107.872 -54.345 -62.182 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.244 0.766 0 CA-C-N 114.053 -1.43 . . . . 74.409999999999997 113.405 178.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.863 0 N-CA-C 109.241 -0.651 . . . . 73.569999999999993 109.241 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . 0.74 HG23 ' N ' ' B' ' 3' ' ' ASN . 34.6 m -63.23 -44.91 99.48 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 N-CA-C 119.975 3.324 . . . . 78.739999999999995 119.975 -164.917 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASN . . . . . 0.74 ' N ' HG23 ' B' ' 2' ' ' VAL . 1.7 m120 -68.05 -11.61 59.29 Favored 'General case' 0 C--O 1.195 -1.816 0 CA-C-N 115.999 -0.546 . . . . 92.859999999999999 111.918 -164.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -96.26 -30.42 13.47 Favored 'General case' 0 C--O 1.196 -1.75 0 C-N-CA 119.859 -0.737 . . . . 64.010000000000005 110.856 163.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' HIS . . . . . 0.494 ' N ' ' O ' ' B' ' 2' ' ' VAL . 63.0 t60 -69.56 -36.04 75.96 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 114.857 1.429 . . . . 49.710000000000001 114.857 170.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' B' ' 2' ' ' VAL . 62.2 mt -76.94 -34.07 57.65 Favored 'General case' 0 C--O 1.21 -1.002 0 O-C-N 120.877 -1.139 . . . . 40.909999999999997 109.108 173.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 42.7 t -60.32 -47.08 87.56 Favored 'General case' 0 C--O 1.207 -1.142 0 O-C-N 121.467 -0.771 . . . . 50.950000000000003 109.092 176.198 -175.629 -130.348 -106.218 105.191 2.009 99.097 -69.989 -65.2 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLY . . . . . 0.47 ' O ' ' C ' ' B' ' 9' ' ' SER . . . -62.28 -42.03 99.72 Favored Glycine 0 C--N 1.316 -0.545 0 N-CA-C 108.515 -1.834 . . . . 61.549999999999997 108.515 -169.504 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . 0.47 ' C ' ' O ' ' B' ' 8' ' ' GLY . 1.0 OUTLIER -33.38 -52.75 0.39 Allowed 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 105.444 -2.058 . . . . 62.25 105.444 172.577 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -73.8 -26.15 60.48 Favored 'General case' 0 CA--C 1.455 -2.681 0 C-N-CA 117.432 -1.707 . . . . 47.670000000000002 113.645 -170.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 61.0 mt -77.2 -44.53 29.75 Favored 'General case' 0 CA--C 1.487 -1.446 0 N-CA-C 106.827 -1.545 . . . . 43.670000000000002 106.827 -169.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 2.5 m -61.12 -39.88 83.9 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.478 0 CA-C-N 115.212 -0.904 . . . . 43.049999999999997 109.657 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.48 -40.52 80.92 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 112.475 0.546 . . . . 51.659999999999997 112.475 -178.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ALA . . . . . 0.872 ' O ' HG12 ' B' ' 18' ' ' VAL . . . -76.74 -32.91 58.08 Favored 'General case' 0 C--O 1.256 1.403 0 N-CA-C 113.199 0.814 . . . . 45.82 113.199 176.25 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 mt -62.5 -25.21 67.9 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.059 0.457 . . . . 45.68 111.992 169.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -71.94 -43.12 65.78 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 112.676 0.621 . . . . 43.600000000000001 112.676 173.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.19 -46.88 72.58 Favored 'General case' 0 C--O 1.211 -0.96 0 C-N-CA 118.586 -1.246 . . . . 35.840000000000003 111.242 -178.548 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . 0.872 HG12 ' O ' ' B' ' 14' ' ' ALA . 2.3 p -70.83 -42.03 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.602 0 C-N-CA 125.238 1.415 . . . . 37.579999999999998 114.295 -177.768 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.8 m -79.88 -7.58 58.81 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 114.368 1.247 . . . . 44.189999999999998 114.368 -177.144 -62.182 -54.345 -92.033 107.872 1.999 108.554 -46.835 -68.306 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 47.94 -113.02 1.24 Allowed Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.075 -0.583 . . . . 53.630000000000003 112.04 174.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -97.29 -22.61 16.56 Favored 'General case' 0 C--O 1.261 1.663 0 N-CA-C 114.935 1.457 . . . . 69.400000000000006 114.935 -175.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 31.5 mtm180 -55.92 -37.1 68.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 120.776 -0.37 . . . . 51.549999999999997 111.111 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.45 171.36 42.6 Favored Glycine 0 N--CA 1.487 2.044 0 C-N-CA 119.654 -1.26 . . . . 43.859999999999999 111.525 -178.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -147.71 167.89 23.49 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-O 121.532 0.682 . . . . 48.789999999999999 109.709 170.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -104.52 138.85 40.27 Favored 'General case' 0 CA--C 1.474 -1.978 0 N-CA-C 104.355 -2.461 . . . . 66.150000000000006 104.355 166.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' TYR . . . . . 0.493 ' O ' HG23 ' B' ' 27' ' ' THR . 37.4 t80 -120.49 108.9 14.65 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 119.431 -0.907 . . . . 65.040000000000006 108.594 164.665 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' THR . . . . . 0.493 HG23 ' O ' ' B' ' 26' ' ' TYR . 0.5 OUTLIER -162.35 159.83 25.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.809 -0.632 . . . . 93.640000000000001 109.494 174.845 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ASP . . . . . 0.595 ' HB2' ' C7 ' ' B' ' 103' ' ' CRS . 0.4 OUTLIER -158.1 159.75 36.58 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.354 -0.98 . . . . 91.840000000000003 108.354 168.1 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . 0.573 ' CB ' ' O ' ' B' ' 28' ' ' ASP . 35.5 tttm . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 119.587 -0.845 . . . . 102.26000000000001 109.613 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 1' ' ' GLY . . . . . 0.501 ' HA3' ' OE1' ' C' ' 4' ' ' GLU . . . . . . . . 0 N--CA 1.498 2.8 0 N-CA-C 111.138 -0.785 . . . . 67.939999999999998 111.138 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 2' ' ' ILE . . . . . 0.768 HG12 HD11 ' D' ' 11' ' ' LEU . 3.0 tt -64.48 -35.73 75.3 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 N-CA-C 107.371 -1.344 . . . . 58.520000000000003 107.371 177.364 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 3' ' ' VAL . . . . . 0.504 ' O ' ' HB3' ' C' ' 7' ' ' CYS . 39.7 t -68.55 -45.21 82.16 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 114.693 -1.14 . . . . 52.840000000000003 110.411 -177.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 4' ' ' GLU . . . . . 0.501 ' OE1' ' HA3' ' C' ' 1' ' ' GLY . 20.4 mp0 -78.37 -15.03 59.12 Favored 'General case' 0 C--O 1.25 1.093 0 CA-C-N 114.66 -1.155 . . . . 66.989999999999995 111.388 -177.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -100.02 -24.3 14.65 Favored 'General case' 0 CA--C 1.565 1.536 0 C-N-CA 120.016 -0.674 . . . . 72.120000000000005 111.884 175.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' CYS . . . . . . . . . . . . . 11.8 m -122.92 -4.3 8.58 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 115.988 1.847 . . . . 55.920000000000002 115.988 -173.992 -45.515 -50.463 -58.443 103.632 2.02 105.208 164.252 -104.983 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' CYS . . . . . 0.504 ' HB3' ' O ' ' C' ' 3' ' ' VAL . 42.8 t -114.47 -52.18 2.73 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 125.704 1.877 . . . . 53.619999999999997 112.952 173.328 -175.536 47.588 76.847 129.488 2.116 118.505 -25.159 -106.714 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' THR . . . . . . . . . . . . . 43.6 p -71.48 -36.27 71.11 Favored 'General case' 0 CA--C 1.589 2.453 0 CA-C-N 116.017 -0.538 . . . . 71.609999999999999 110.113 173.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.9 156.57 34.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.864 -1.148 . . . . 64.019999999999996 112.285 166.862 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.11 153.15 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 O-C-N 121.217 -0.927 . . . . 86.519999999999996 109.927 177.225 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.82 142.03 51.71 Favored 'General case' 0 CA--C 1.463 -2.37 0 C-N-CA 124.292 1.037 . . . . 67.349999999999994 109.038 -176.926 -104.983 164.252 -58.443 105.208 2.02 103.632 -50.463 -45.515 2 2 . 1 . 001 ecloud build full ' C' C ' 12' ' ' SER . . . . . 1.183 ' OG ' ' HG3' ' C' ' 15' ' ' GLN . 54.2 p -83.63 168.92 15.88 Favored 'General case' 0 C--O 1.249 1.061 0 O-C-N 125.338 1.649 . . . . 72.719999999999999 109.792 167.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 13' ' ' LEU . . . . . 0.662 HD23 ' C ' ' C' ' 13' ' ' LEU . 0.9 OUTLIER -55.31 -67.03 0.31 Allowed 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 114.429 -1.26 . . . . 66.680000000000007 109.615 173.561 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 14' ' ' TYR . . . . . 0.477 ' C ' ' O ' ' C' ' 13' ' ' LEU . 1.4 t80 -35.13 -54.96 0.61 Allowed 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 105.49 -2.041 . . . . 78.519999999999996 105.49 175.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 15' ' ' GLN . . . . . 1.183 ' HG3' ' OG ' ' C' ' 12' ' ' SER . 5.2 mt-30 -58.45 -34.62 71.03 Favored 'General case' 0 C--O 1.173 -2.969 0 CA-C-N 115.333 -0.849 . . . . 72.579999999999998 108.915 -169.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LEU . . . . . 0.74 HD13 HG21 ' D' ' 18' ' ' VAL . 12.5 mt -65.5 -37.15 85.95 Favored 'General case' 0 C--O 1.175 -2.859 0 N-CA-C 116.136 1.902 . . . . 52.969999999999999 116.136 172.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -71.38 -18.8 62.34 Favored 'General case' 0 C--O 1.193 -1.889 0 CA-C-N 119.584 1.084 . . . . 65.560000000000002 110.682 -171.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -48.55 -28.95 3.73 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.121 -0.945 . . . . 75.25 109.622 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' TYR . . . . . 0.471 ' CZ ' ' HA ' ' C' ' 2' ' ' ILE . 69.5 m-85 -101.19 15.92 27.18 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.421 -0.809 . . . . 50.399999999999999 110.607 -172.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 62.6 m -81.53 166.67 20.07 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 116.755 -1.978 . . . . 44.759999999999998 108.78 172.266 -56.774 -54.082 -87.556 107.288 2.024 102.169 -60.277 -65.289 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' ASN . . . . . 0.502 ' OD1' ' N ' ' D' ' 24' ' ' PHE . 21.4 m120 . . . . . 0 CA--C 1.504 -0.825 0 CA-C-O 116.084 -1.912 . . . . 41.210000000000001 108.293 175.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 1' ' ' PHE . . . . . 0.627 ' HB3' ' O ' ' D' ' 201' ' ' HOH . 23.6 t80 . . . . . 0 N--CA 1.512 2.641 0 CA-C-O 119.523 -0.275 . . . . 64.0 110.464 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 17.1 m -60.54 129.18 22.82 Favored 'Isoleucine or valine' 0 C--O 1.245 0.863 0 N-CA-C 115.934 1.827 . . . . 61.090000000000003 115.934 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -91.29 73.45 6.18 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 106.659 -1.608 . . . . 80.010000000000005 106.659 166.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -147.15 153.63 40.12 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.055 -0.52 . . . . 106.16 109.924 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -68.5 121.87 17.26 Favored 'General case' 0 CA--C 1.498 -1.036 0 CA-C-N 116.112 -0.495 . . . . 63.600000000000001 110.332 168.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 88.7 mt -100.16 107.77 19.72 Favored 'General case' 0 C--O 1.267 1.994 0 O-C-N 121.417 -0.802 . . . . 50.57 111.187 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -106.0 8.58 32.47 Favored 'General case' 0 CA--C 1.549 0.936 1 N-CA-C 123.836 4.754 . . . . 46.850000000000001 123.836 -158.744 -106.714 -25.159 76.847 118.505 2.116 129.488 47.588 -175.536 3 3 . 1 . 001 ecloud build full ' D' D ' 8' ' ' GLY . . . . . . . . . . . . . . . -176.78 -120.02 0.6 Allowed Glycine 0 CA--C 1.505 -0.582 0 CA-C-N 119.984 1.266 . . . . 35.420000000000002 112.605 -172.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.4 -33.9 71.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 105.554 -2.017 . . . . 41.719999999999999 105.554 173.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -60.08 -35.78 75.94 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-N 115.521 -0.763 . . . . 42.18 110.52 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' LEU . . . . . 0.768 HD11 HG12 ' C' ' 2' ' ' ILE . 0.0 OUTLIER -63.38 -57.93 8.73 Favored 'General case' 0 C--O 1.252 1.191 0 N-CA-C 103.139 -2.912 . . . . 41.770000000000003 103.139 -178.743 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 12' ' ' VAL . . . . . 0.408 ' O ' ' C ' ' D' ' 13' ' ' GLU . 51.3 t -54.29 -62.09 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.93 0 CA-C-N 114.228 -1.351 . . . . 43.200000000000003 109.766 -176.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 13' ' ' GLU . . . . . 0.525 ' O ' ' HB3' ' D' ' 16' ' ' TYR . 7.2 tp10 -38.92 -57.68 1.21 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.98 0.895 . . . . 63.759999999999998 112.237 175.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 14' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' D' ' 11' ' ' LEU . . . -45.99 -65.3 0.57 Allowed 'General case' 0 CA--C 1.5 -0.966 0 O-C-N 121.602 -0.687 . . . . 66.560000000000002 109.161 176.587 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 15' ' ' LEU . . . . . 0.629 HD11 ' CD1' ' C' ' 2' ' ' ILE . 25.4 mt -42.26 -49.15 5.04 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.864 0.84 . . . . 50.149999999999999 111.219 179.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 16' ' ' TYR . . . . . 0.525 ' HB3' ' O ' ' D' ' 13' ' ' GLU . 29.6 t80 -45.34 -50.44 12.13 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 114.567 -1.197 . . . . 65.959999999999994 109.364 -178.698 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 73.2 mt -85.27 -33.21 22.2 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 113.412 0.893 . . . . 69.430000000000007 113.412 -175.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' VAL . . . . . 0.74 HG21 HD13 ' C' ' 16' ' ' LEU . 2.9 t -61.28 -43.29 96.25 Favored 'Isoleucine or valine' 0 C--O 1.254 1.312 0 N-CA-C 108.042 -1.095 . . . . 50.460000000000001 108.042 177.778 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 97.0 m -86.61 -45.73 10.76 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.549 -0.75 . . . . 64.359999999999999 112.813 -171.134 -65.289 -60.277 -87.556 102.169 2.024 107.288 -54.082 -56.774 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.76 -137.49 48.53 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 110.071 -1.211 . . . . 68.950000000000003 110.071 176.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' GLU . . . . . 0.72 ' O ' ' H6 ' ' B' ' 103' ' ' CRS . 2.6 pt-20 -47.37 -42.53 21.95 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 114.771 -0.714 . . . . 90.390000000000001 111.734 -174.529 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -42.39 -53.51 4.19 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 122.183 -0.323 . . . . 75.579999999999998 111.325 175.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' GLY . . . . . 0.425 ' HA3' ' CG2' ' B' ' 27' ' ' THR . . . 94.86 -171.53 30.23 Favored Glycine 0 C--O 1.252 1.22 0 N-CA-C 110.408 -1.077 . . . . 56.859999999999999 110.408 -175.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 24' ' ' PHE . . . . . 0.502 ' N ' ' OD1' ' C' ' 21' ' ' ASN . 21.8 p90 -160.81 171.33 18.98 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 117.349 2.352 . . . . 54.369999999999997 117.349 -170.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 53.6 p90 -135.5 125.06 25.09 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-N 115.026 -0.988 . . . . 56.57 110.203 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -121.41 114.84 21.86 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 105.485 -2.042 . . . . 53.509999999999998 105.485 -176.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' THR . . . . . . . . . . . . 0.264 77.6 p -92.68 -22.05 19.65 Favored 'General case' 0 CA--C 1.5 -0.975 0 C-N-CA 126.847 2.059 . . . . 61.789999999999999 112.071 179.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 28' ' ' ASP . . . . . . . . . . . . . 17.0 t70 66.06 -145.92 0.19 Allowed 'General case' 0 C--O 1.26 1.636 0 N-CA-C 104.888 -2.264 . . . . 57.810000000000002 104.888 -170.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -68.16 157.31 35.65 Favored 'General case' 0 CA--C 1.484 -1.587 0 N-CA-C 105.208 -2.145 . . . . 60.909999999999997 105.208 -171.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' THR . . . . . . . . . . . . . 6.4 p . . . . . 0 C--O 1.258 1.526 0 O-C-N 124.937 1.398 . . . . 79.109999999999999 109.033 -179.465 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' CRS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' CRS . . . . . 0.72 ' H6 ' ' O ' ' D' ' 21' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 102' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' HOH . . . . . 0.627 ' O ' ' HB3' ' D' ' 1' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 109.704 -1.358 . . . . 63.490000000000002 109.704 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.412 HG23 HG23 ' A' ' 3' ' ' VAL . 12.8 tt -54.59 -39.08 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 CA-C-O 122.179 0.99 . . . . 60.299999999999997 111.75 -175.102 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.412 HG23 HG23 ' A' ' 2' ' ' ILE . 36.0 t -77.42 -50.17 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 C-N-CA 118.706 -1.197 . . . . 63.130000000000003 112.114 -172.374 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.88 -49.79 62.27 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.792 -1.188 . . . . 98.549999999999997 107.792 172.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -70.78 -35.9 72.8 Favored 'General case' 0 C--O 1.252 1.205 0 N-CA-C 115.979 1.844 . . . . 83.150000000000006 115.979 -171.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.7 m -106.4 -24.9 12.11 Favored 'General case' 0 CA--C 1.468 -2.209 0 N-CA-C 114.251 1.204 . . . . 54.549999999999997 114.251 -172.774 -54.476 -62.674 -78.275 101.372 1.954 109.82 156.088 -71.544 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.7 m -82.83 -6.5 59.46 Favored 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.889 1.811 . . . . 55.060000000000002 115.889 170.012 -65.2 -69.989 -106.218 99.097 2.009 105.191 -130.348 -175.629 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 31.4 p -97.48 -56.16 2.61 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 108.0 -1.111 . . . . 57.159999999999997 108.0 174.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -109.59 163.75 13.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.787 0.835 . . . . 68.150000000000006 108.953 175.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 55.5 mt -82.83 123.01 38.12 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.524 0 N-CA-C 101.519 -3.511 . . . . 55.899999999999999 101.519 -171.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.7 m -80.89 133.92 35.65 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 107.2 -1.407 . . . . 44.560000000000002 107.2 166.264 -71.544 156.088 -78.275 109.82 1.954 101.372 -62.674 -54.476 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 56.5 p -84.58 172.06 11.93 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 103.44 -2.8 . . . . 47.109999999999999 103.44 174.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.6 mt -51.76 -36.39 47.13 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-O 122.661 1.22 . . . . 53.75 111.443 175.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -66.7 -48.16 70.14 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.325 -1.361 . . . . 57.630000000000003 107.325 -172.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -63.42 -36.32 83.35 Favored 'General case' 0 CA--C 1.494 -1.196 0 CA-C-O 121.88 0.848 . . . . 55.259999999999998 111.665 -179.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -67.19 -32.49 73.59 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.424 -1.262 . . . . 45.159999999999997 109.287 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -64.99 -23.84 67.34 Favored 'General case' 0 CA--C 1.488 -1.427 0 CA-C-O 121.882 0.849 . . . . 57.490000000000002 112.793 -174.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -53.75 -35.91 61.76 Favored 'General case' 0 CA--C 1.472 -2.045 0 CA-C-N 112.939 -1.937 . . . . 51.799999999999997 114.141 172.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -95.03 27.63 3.11 Favored 'General case' 0 CA--C 1.571 1.769 0 O-C-N 125.31 1.632 . . . . 57.289999999999999 115.389 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.8 m -88.11 169.95 11.49 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.686 1.195 . . . . 56.740000000000002 112.614 174.064 -68.306 -46.835 -92.033 108.554 1.999 107.872 -54.345 -62.182 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.244 0.766 0 CA-C-N 114.053 -1.43 . . . . 74.409999999999997 113.405 178.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.863 0 N-CA-C 109.241 -0.651 . . . . 73.569999999999993 109.241 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.74 HG23 ' N ' ' B' ' 3' ' ' ASN . 34.6 m -63.23 -44.91 99.48 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 N-CA-C 119.975 3.324 . . . . 78.739999999999995 119.975 -164.917 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASN . . . . . 0.74 ' N ' HG23 ' B' ' 2' ' ' VAL . 1.1 m-80 -68.05 -11.61 59.29 Favored 'General case' 0 C--O 1.195 -1.816 0 CA-C-N 115.999 -0.546 . . . . 92.859999999999999 111.918 -164.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -96.26 -30.42 13.47 Favored 'General case' 0 C--O 1.196 -1.75 0 C-N-CA 119.859 -0.737 . . . . 64.010000000000005 110.856 163.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' HIS . . . . . 0.494 ' N ' ' O ' ' B' ' 2' ' ' VAL . 63.0 t60 -69.56 -36.04 75.96 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 114.857 1.429 . . . . 49.710000000000001 114.857 170.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' B' ' 2' ' ' VAL . 62.2 mt -76.94 -34.07 57.65 Favored 'General case' 0 C--O 1.21 -1.002 0 O-C-N 120.877 -1.139 . . . . 40.909999999999997 109.108 173.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 42.7 t -60.32 -47.08 87.56 Favored 'General case' 0 C--O 1.207 -1.142 0 O-C-N 121.467 -0.771 . . . . 50.950000000000003 109.092 176.198 -175.629 -130.348 -106.218 105.191 2.009 99.097 -69.989 -65.2 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLY . . . . . 0.47 ' O ' ' C ' ' B' ' 9' ' ' SER . . . -62.28 -42.03 99.72 Favored Glycine 0 C--N 1.316 -0.545 0 N-CA-C 108.515 -1.834 . . . . 61.549999999999997 108.515 -169.504 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . 0.47 ' C ' ' O ' ' B' ' 8' ' ' GLY . 1.0 OUTLIER -33.38 -52.75 0.39 Allowed 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 105.444 -2.058 . . . . 62.25 105.444 172.577 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -73.8 -26.15 60.48 Favored 'General case' 0 CA--C 1.455 -2.681 0 C-N-CA 117.432 -1.707 . . . . 47.670000000000002 113.645 -170.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 61.0 mt -77.2 -44.53 29.75 Favored 'General case' 0 CA--C 1.487 -1.446 0 N-CA-C 106.827 -1.545 . . . . 43.670000000000002 106.827 -169.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 2.5 m -61.12 -39.88 83.9 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.478 0 CA-C-N 115.212 -0.904 . . . . 43.049999999999997 109.657 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.48 -40.52 80.92 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 112.475 0.546 . . . . 51.659999999999997 112.475 -178.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ALA . . . . . 0.872 ' O ' HG12 ' B' ' 18' ' ' VAL . . . -76.74 -32.91 58.08 Favored 'General case' 0 C--O 1.256 1.403 0 N-CA-C 113.199 0.814 . . . . 45.82 113.199 176.25 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 mt -62.5 -25.21 67.9 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.059 0.457 . . . . 45.68 111.992 169.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -71.94 -43.12 65.78 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 112.676 0.621 . . . . 43.600000000000001 112.676 173.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.19 -46.88 72.58 Favored 'General case' 0 C--O 1.211 -0.96 0 C-N-CA 118.586 -1.246 . . . . 35.840000000000003 111.242 -178.548 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . 0.872 HG12 ' O ' ' B' ' 14' ' ' ALA . 2.3 p -70.83 -42.03 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.602 0 C-N-CA 125.238 1.415 . . . . 37.579999999999998 114.295 -177.768 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.8 m -79.88 -7.58 58.81 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 114.368 1.247 . . . . 44.189999999999998 114.368 -177.144 -62.182 -54.345 -92.033 107.872 1.999 108.554 -46.835 -68.306 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 47.94 -113.02 1.24 Allowed Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.075 -0.583 . . . . 53.630000000000003 112.04 174.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -97.29 -22.61 16.56 Favored 'General case' 0 C--O 1.261 1.663 0 N-CA-C 114.935 1.457 . . . . 69.400000000000006 114.935 -175.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 31.5 mtm180 -55.92 -37.1 68.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 120.776 -0.37 . . . . 51.549999999999997 111.111 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.45 171.36 42.6 Favored Glycine 0 N--CA 1.487 2.044 0 C-N-CA 119.654 -1.26 . . . . 43.859999999999999 111.525 -178.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -147.71 167.89 23.49 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-O 121.532 0.682 . . . . 48.789999999999999 109.709 170.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -104.52 138.85 40.27 Favored 'General case' 0 CA--C 1.474 -1.978 0 N-CA-C 104.355 -2.461 . . . . 66.150000000000006 104.355 166.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' TYR . . . . . 0.493 ' O ' HG23 ' B' ' 27' ' ' THR . 37.4 t80 -120.49 108.9 14.65 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 119.431 -0.907 . . . . 65.040000000000006 108.594 164.665 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' THR . . . . . 0.493 HG23 ' O ' ' B' ' 26' ' ' TYR . 0.5 OUTLIER -162.35 159.83 25.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.809 -0.632 . . . . 93.640000000000001 109.494 174.845 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ASP . . . . . 0.595 ' HB2' ' C7 ' ' B' ' 103' ' ' CRS . 0.4 OUTLIER -158.1 159.75 36.58 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.354 -0.98 . . . . 91.840000000000003 108.354 168.1 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.573 ' CB ' ' O ' ' B' ' 28' ' ' ASP . 35.5 tttm . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 119.587 -0.845 . . . . 102.26000000000001 109.613 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' GLY . . . . . 0.501 ' HA3' ' OE1' ' C' ' 4' ' ' GLU . . . . . . . . 0 N--CA 1.498 2.8 0 N-CA-C 111.138 -0.785 . . . . 67.939999999999998 111.138 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' ILE . . . . . 0.768 HG12 HD11 ' D' ' 11' ' ' LEU . 3.0 tt -64.48 -35.73 75.3 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 N-CA-C 107.371 -1.344 . . . . 58.520000000000003 107.371 177.364 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' VAL . . . . . 0.504 ' O ' ' HB3' ' C' ' 7' ' ' CYS . 39.7 t -68.55 -45.21 82.16 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 114.693 -1.14 . . . . 52.840000000000003 110.411 -177.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' GLU . . . . . 0.501 ' OE1' ' HA3' ' C' ' 1' ' ' GLY . 20.4 mp0 -78.37 -15.03 59.12 Favored 'General case' 0 C--O 1.25 1.093 0 CA-C-N 114.66 -1.155 . . . . 66.989999999999995 111.388 -177.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -100.02 -24.3 14.65 Favored 'General case' 0 CA--C 1.565 1.536 0 C-N-CA 120.016 -0.674 . . . . 72.120000000000005 111.884 175.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' CYS . . . . . . . . . . . . . 11.8 m -122.92 -4.3 8.58 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 115.988 1.847 . . . . 55.920000000000002 115.988 -173.992 -45.515 -50.463 -58.443 103.632 2.02 105.208 164.252 -104.983 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' CYS . . . . . 0.504 ' HB3' ' O ' ' C' ' 3' ' ' VAL . 42.8 t -114.47 -52.18 2.73 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 125.704 1.877 . . . . 53.619999999999997 112.952 173.328 -175.536 47.588 76.847 129.488 2.116 118.505 -25.159 -106.714 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' THR . . . . . . . . . . . . . 43.6 p -71.48 -36.27 71.11 Favored 'General case' 0 CA--C 1.589 2.453 0 CA-C-N 116.017 -0.538 . . . . 71.609999999999999 110.113 173.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.9 156.57 34.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.864 -1.148 . . . . 64.019999999999996 112.285 166.862 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.11 153.15 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 O-C-N 121.217 -0.927 . . . . 86.519999999999996 109.927 177.225 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.82 142.03 51.71 Favored 'General case' 0 CA--C 1.463 -2.37 0 C-N-CA 124.292 1.037 . . . . 67.349999999999994 109.038 -176.926 -104.983 164.252 -58.443 105.208 2.02 103.632 -50.463 -45.515 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' SER . . . . . 1.183 ' OG ' ' HG3' ' C' ' 15' ' ' GLN . 54.2 p -83.63 168.92 15.88 Favored 'General case' 0 C--O 1.249 1.061 0 O-C-N 125.338 1.649 . . . . 72.719999999999999 109.792 167.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' LEU . . . . . 0.662 HD23 ' C ' ' C' ' 13' ' ' LEU . 0.9 OUTLIER -55.31 -67.03 0.31 Allowed 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 114.429 -1.26 . . . . 66.680000000000007 109.615 173.561 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' TYR . . . . . 0.477 ' C ' ' O ' ' C' ' 13' ' ' LEU . 1.4 t80 -35.13 -54.96 0.61 Allowed 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 105.49 -2.041 . . . . 78.519999999999996 105.49 175.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' GLN . . . . . 1.183 ' HG3' ' OG ' ' C' ' 12' ' ' SER . 5.2 mt-30 -58.45 -34.62 71.03 Favored 'General case' 0 C--O 1.173 -2.969 0 CA-C-N 115.333 -0.849 . . . . 72.579999999999998 108.915 -169.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LEU . . . . . 0.74 HD13 HG21 ' D' ' 18' ' ' VAL . 12.5 mt -65.5 -37.15 85.95 Favored 'General case' 0 C--O 1.175 -2.859 0 N-CA-C 116.136 1.902 . . . . 52.969999999999999 116.136 172.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -71.38 -18.8 62.34 Favored 'General case' 0 C--O 1.193 -1.889 0 CA-C-N 119.584 1.084 . . . . 65.560000000000002 110.682 -171.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -48.55 -28.95 3.73 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.121 -0.945 . . . . 75.25 109.622 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' TYR . . . . . 0.471 ' CZ ' ' HA ' ' C' ' 2' ' ' ILE . 69.5 m-85 -101.19 15.92 27.18 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.421 -0.809 . . . . 50.399999999999999 110.607 -172.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 62.6 m -81.53 166.67 20.07 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 116.755 -1.978 . . . . 44.759999999999998 108.78 172.266 -56.774 -54.082 -87.556 107.288 2.024 102.169 -60.277 -65.289 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' ASN . . . . . 0.502 ' OD1' ' N ' ' D' ' 24' ' ' PHE . 21.4 m120 . . . . . 0 CA--C 1.504 -0.825 0 CA-C-O 116.084 -1.912 . . . . 41.210000000000001 108.293 175.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' PHE . . . . . 0.627 ' HB3' ' O ' ' D' ' 201' ' ' HOH . 23.6 t80 . . . . . 0 N--CA 1.512 2.641 0 CA-C-O 119.523 -0.275 . . . . 64.0 110.464 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 17.1 m -60.54 129.18 22.82 Favored 'Isoleucine or valine' 0 C--O 1.245 0.863 0 N-CA-C 115.934 1.827 . . . . 61.090000000000003 115.934 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -91.29 73.45 6.18 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 106.659 -1.608 . . . . 80.010000000000005 106.659 166.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -147.15 153.63 40.12 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.055 -0.52 . . . . 106.16 109.924 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -68.5 121.87 17.26 Favored 'General case' 0 CA--C 1.498 -1.036 0 CA-C-N 116.112 -0.495 . . . . 63.600000000000001 110.332 168.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 88.7 mt -100.16 107.77 19.72 Favored 'General case' 0 C--O 1.267 1.994 0 O-C-N 121.417 -0.802 . . . . 50.57 111.187 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -106.0 8.58 32.47 Favored 'General case' 0 CA--C 1.549 0.936 1 N-CA-C 123.836 4.754 . . . . 46.850000000000001 123.836 -158.744 -106.714 -25.159 76.847 118.505 2.116 129.488 47.588 -175.536 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' GLY . . . . . . . . . . . . . . . -176.78 -120.02 0.6 Allowed Glycine 0 CA--C 1.505 -0.582 0 CA-C-N 119.984 1.266 . . . . 35.420000000000002 112.605 -172.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.4 -33.9 71.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 105.554 -2.017 . . . . 41.719999999999999 105.554 173.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -60.08 -35.78 75.94 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-N 115.521 -0.763 . . . . 42.18 110.52 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' LEU . . . . . 0.768 HD11 HG12 ' C' ' 2' ' ' ILE . 0.0 OUTLIER -63.38 -57.93 8.73 Favored 'General case' 0 C--O 1.252 1.191 0 N-CA-C 103.139 -2.912 . . . . 41.770000000000003 103.139 -178.743 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' VAL . . . . . 0.408 ' O ' ' C ' ' D' ' 13' ' ' GLU . 51.3 t -54.29 -62.09 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.93 0 CA-C-N 114.228 -1.351 . . . . 43.200000000000003 109.766 -176.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' GLU . . . . . 0.525 ' O ' ' HB3' ' D' ' 16' ' ' TYR . 7.2 tp10 -38.92 -57.68 1.21 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.98 0.895 . . . . 63.759999999999998 112.237 175.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' D' ' 11' ' ' LEU . . . -45.99 -65.3 0.57 Allowed 'General case' 0 CA--C 1.5 -0.966 0 O-C-N 121.602 -0.687 . . . . 66.560000000000002 109.161 176.587 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' LEU . . . . . 0.629 HD11 ' CD1' ' C' ' 2' ' ' ILE . 25.4 mt -42.26 -49.15 5.04 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.864 0.84 . . . . 50.149999999999999 111.219 179.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' TYR . . . . . 0.525 ' HB3' ' O ' ' D' ' 13' ' ' GLU . 29.6 t80 -45.34 -50.44 12.13 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 114.567 -1.197 . . . . 65.959999999999994 109.364 -178.698 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 73.2 mt -85.27 -33.21 22.2 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 113.412 0.893 . . . . 69.430000000000007 113.412 -175.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' VAL . . . . . 0.74 HG21 HD13 ' C' ' 16' ' ' LEU . 2.9 t -61.28 -43.29 96.25 Favored 'Isoleucine or valine' 0 C--O 1.254 1.312 0 N-CA-C 108.042 -1.095 . . . . 50.460000000000001 108.042 177.778 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 97.0 m -86.61 -45.73 10.76 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.549 -0.75 . . . . 64.359999999999999 112.813 -171.134 -65.289 -60.277 -87.556 102.169 2.024 107.288 -54.082 -56.774 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.76 -137.49 48.53 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 110.071 -1.211 . . . . 68.950000000000003 110.071 176.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' GLU . . . . . 0.72 ' O ' ' H6 ' ' B' ' 103' ' ' CRS . 2.6 pt-20 -47.37 -42.53 21.95 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 114.771 -0.714 . . . . 90.390000000000001 111.734 -174.529 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -42.39 -53.51 4.19 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 122.183 -0.323 . . . . 75.579999999999998 111.325 175.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' GLY . . . . . 0.425 ' HA3' ' CG2' ' B' ' 27' ' ' THR . . . 94.86 -171.53 30.23 Favored Glycine 0 C--O 1.252 1.22 0 N-CA-C 110.408 -1.077 . . . . 56.859999999999999 110.408 -175.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' PHE . . . . . 0.502 ' N ' ' OD1' ' C' ' 21' ' ' ASN . 21.8 p90 -160.81 171.33 18.98 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 117.349 2.352 . . . . 54.369999999999997 117.349 -170.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 53.6 p90 -135.5 125.06 25.09 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-N 115.026 -0.988 . . . . 56.57 110.203 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -121.41 114.84 21.86 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 105.485 -2.042 . . . . 53.509999999999998 105.485 -176.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' THR . . . . . . . . . . . . 0.264 77.6 p -92.68 -22.05 19.65 Favored 'General case' 0 CA--C 1.5 -0.975 0 C-N-CA 126.847 2.059 . . . . 61.789999999999999 112.071 179.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' ASP . . . . . . . . . . . . . 17.0 t70 66.06 -145.92 0.19 Allowed 'General case' 0 C--O 1.26 1.636 0 N-CA-C 104.888 -2.264 . . . . 57.810000000000002 104.888 -170.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -68.16 157.31 35.65 Favored 'General case' 0 CA--C 1.484 -1.587 0 N-CA-C 105.208 -2.145 . . . . 60.909999999999997 105.208 -171.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' THR . . . . . . . . . . . . . 6.4 p . . . . . 0 C--O 1.258 1.526 0 O-C-N 124.937 1.398 . . . . 79.109999999999999 109.033 -179.465 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' CRS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' CRS . . . . . 0.72 ' H6 ' ' O ' ' D' ' 21' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' HOH . . . . . 0.627 ' O ' ' HB3' ' D' ' 1' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_