data_4cix_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 4cix _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 ' 3' ' ' LEU . . . . . . . . . . . . . 4.5 tt . . . . . 0 N--CA 1.505 2.299 0 N-CA-C 108.782 -0.821 . . . . 48.189999999999998 108.782 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.6 mt -102.23 142.79 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 114.3 1.222 . . . . 39.450000000000003 114.3 -162.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.8 t -130.35 134.26 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 115.01 -0.995 . . . . 35.210000000000001 108.661 176.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -97.99 131.53 44.34 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 120.744 -0.382 . . . . 26.699999999999999 110.357 175.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 65.3 t -117.34 114.05 44.48 Favored 'Isoleucine or valine' 0 C--O 1.251 1.162 0 N-CA-C 106.396 -1.705 . . . . 21.27 106.396 174.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 85.3 mt -116.88 121.08 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 107.782 -1.192 . . . . 20.350000000000001 107.782 -171.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -110.99 141.93 43.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.147 0.499 . . . . 20.539999999999999 110.92 173.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.37 -159.18 29.03 Favored Glycine 0 CA--C 1.521 0.452 0 CA-C-N 115.831 -0.622 . . . . 22.199999999999999 114.581 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -49.85 133.65 33.93 Favored 'Trans proline' 0 CA--C 1.508 -0.809 0 C-N-CA 125.03 3.82 . . . . 24.66 114.579 -173.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 80.61 -4.85 1.78 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 116.705 2.113 . . . . 25.370000000000001 116.705 176.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.0 mt -82.89 -11.0 58.55 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 112.165 0.432 . . . . 32.549999999999997 112.165 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.17 -24.95 63.89 Favored Glycine 0 CA--C 1.521 0.458 0 N-CA-C 111.195 -0.762 . . . . 31.260000000000002 111.195 166.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -90.97 -2.13 57.74 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 112.86 0.689 . . . . 37.390000000000001 112.86 -168.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.0 tp -37.22 130.24 0.9 Allowed 'General case' 0 CA--C 1.537 0.477 0 O-C-N 123.715 0.634 . . . . 45.409999999999997 111.504 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.89 65.14 2.01 Favored Glycine 0 N--CA 1.48 1.586 0 N-CA-C 109.296 -1.522 . . . . 56.149999999999999 109.296 -172.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 116.475 2.028 . . . . 76.120000000000005 116.475 -150.588 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.922 0 N-CA-C 113.721 0.249 . . . . 50.030000000000001 113.721 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 84.2 m -83.18 132.43 35.07 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.373 1.619 . . . . 44.850000000000001 115.373 -166.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.0 p -85.59 161.68 19.19 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.346 0.658 . . . . 41.880000000000003 111.505 175.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -63.79 -35.24 79.97 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 112.983 0.734 . . . . 34.18 112.983 -178.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -64.31 -39.35 93.74 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.46 -0.791 . . . . 31.280000000000001 110.475 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -63.78 -42.16 97.8 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 124.357 1.036 . . . . 55.020000000000003 111.574 173.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.2 tp -58.57 -40.57 83.47 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 123.836 0.71 . . . . 28.870000000000001 111.0 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 96.4 t -62.5 -47.53 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 107.275 -1.38 . . . . 26.25 107.275 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.57 -45.78 90.85 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.367 0.877 . . . . 28.760000000000002 113.367 179.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.3 mt -56.13 -48.62 75.88 Favored 'General case' 0 CA--C 1.504 -0.809 0 C-N-CA 122.414 0.286 . . . . 34.43 111.122 176.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 63.2 mt -66.3 -50.35 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 CA-C-N 115.45 -0.795 . . . . 30.829999999999998 110.352 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -53.62 -43.41 68.67 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.343 0.868 . . . . 36.030000000000001 113.343 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -64.21 -49.75 70.77 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.045 0.757 . . . . 48.490000000000002 113.045 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.65 -37.91 85.79 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 110.108 -0.33 . . . . 47.5 110.108 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.8 -43.54 88.42 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.26 -0.427 . . . . 41.090000000000003 111.478 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.69 -58.79 5.02 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.352 -0.385 . . . . 38.259999999999998 110.302 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -48.3 -37.01 15.34 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.815 1.413 . . . . 68.310000000000002 114.815 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.0 mt -85.82 -3.18 58.84 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 112.069 0.396 . . . . 33.759999999999998 112.069 -178.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.59 44.03 58.87 Favored Glycine 0 C--O 1.221 -0.66 0 C-N-CA 121.51 -0.376 . . . . 34.509999999999998 112.229 -176.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.1 mt -125.81 167.01 15.79 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 108.142 -1.059 . . . . 38.049999999999997 108.142 172.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.8 tttt -112.44 129.27 56.38 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.959 -1.019 . . . . 36.890000000000001 108.281 163.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -100.79 124.6 46.66 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.527 0.68 . . . . 25.59 109.65 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.7 t -101.75 107.69 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.375 -1.343 . . . . 23.940000000000001 107.375 166.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 38.0 t -103.65 142.65 16.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 CA-C-O 120.92 0.391 . . . . 24.649999999999999 110.335 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 10.7 mmt85 -148.84 145.21 27.4 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 119.086 -0.483 . . . . 43.450000000000003 110.753 -169.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.2 tm0? -139.94 137.64 34.93 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 119.839 -0.744 . . . . 22.629999999999999 111.676 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 11.1 t -153.46 140.68 19.5 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.626 0.602 . . . . 19.460000000000001 112.626 175.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -83.53 -4.29 58.41 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.461 -0.79 . . . . 23.620000000000001 110.326 172.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.1 t -96.67 117.51 31.15 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 123.036 0.534 . . . . 18.059999999999999 111.696 -177.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . 0.512 ' OE2' ' OG ' ' A' ' 83' ' ' SER . 33.5 tt0 -56.01 -44.27 78.5 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.001 0.741 . . . . 22.82 113.001 175.319 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.98 -39.58 90.14 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.263 -0.426 . . . . 20.050000000000001 111.086 -178.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -66.08 -44.15 85.25 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.434 -0.803 . . . . 23.73 110.459 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 36.2 mt -57.35 -48.53 78.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 119.936 -0.706 . . . . 23.16 110.81 174.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.8 mt -57.76 -36.53 72.24 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.836 0.68 . . . . 24.280000000000001 112.836 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -65.72 -44.11 87.04 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.32 -0.993 . . . . 26.379999999999999 108.32 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 32.4 m0 -62.04 -35.87 79.88 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.788 0.662 . . . . 25.23 112.788 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.8 mm -70.1 -41.35 79.08 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.184 0 N-CA-C 109.129 -0.693 . . . . 25.5 109.129 178.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 10.4 m-70 -57.47 -49.06 77.5 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.836 0.827 . . . . 28.98 109.958 -179.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -59.27 -44.81 92.43 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.002 -1.454 . . . . 30.68 111.217 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.53 -37.44 86.11 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.017 0.377 . . . . 22.609999999999999 112.017 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.49 -60.39 3.6 Favored 'General case' 0 C--O 1.211 -0.971 0 N-CA-C 109.082 -0.71 . . . . 23.420000000000002 109.082 171.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -51.83 -46.68 64.44 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.23 0.612 . . . . 26.170000000000002 112.56 178.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.05 -15.58 62.03 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 113.599 0.963 . . . . 29.390000000000001 113.599 -178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 61.02 34.32 19.32 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.43 1.092 . . . . 27.280000000000001 111.061 -170.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -94.89 143.39 26.07 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 123.4 0.68 . . . . 38.939999999999998 111.34 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -77.79 162.18 29.9 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 117.249 -1.367 . . . . 27.109999999999999 112.462 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 73.0 t -135.65 133.18 51.67 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 O-C-N 124.528 1.143 . . . . 25.059999999999999 110.454 -173.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.3 mt -105.2 118.47 52.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 105.128 -2.175 . . . . 20.890000000000001 105.128 165.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 59.4 tp -123.02 129.18 51.18 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.499 0.666 . . . . 21.579999999999998 112.39 -170.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -126.59 98.09 5.27 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.375 -1.713 . . . . 19.530000000000001 106.375 171.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.8 11.01 21.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.745 -0.661 . . . . 23.550000000000001 112.393 -167.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 48.61 -137.5 16.18 Favored Glycine 0 C--O 1.253 1.288 0 CA-C-O 121.68 0.6 . . . . 21.039999999999999 113.631 -171.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.68 -33.01 54.72 Favored Glycine 0 N--CA 1.469 0.851 0 N-CA-C 116.019 1.167 . . . . 20.809999999999999 116.019 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.6 mt -61.9 -18.88 61.79 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 113.714 1.005 . . . . 20.68 113.714 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 86.2 m -52.67 -42.26 64.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.766 -0.652 . . . . 20.550000000000001 112.67 174.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -92.86 -4.18 53.33 Favored 'General case' 0 C--O 1.247 0.938 0 CA-C-N 115.448 -0.796 . . . . 22.920000000000002 112.54 -171.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 17.3 p -131.25 -31.5 1.64 Allowed 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 116.064 1.876 . . . . 21.48 116.064 -165.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . 0.512 ' OG ' ' OE2' ' A' ' 55' ' ' GLU . 32.1 t -93.69 111.43 23.12 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 114.726 1.38 . . . . 22.059999999999999 114.726 -172.828 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 38.6 t -78.39 -33.74 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.415 -1.328 . . . . 21.41 107.415 172.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.34 -48.8 79.66 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 122.011 0.91 . . . . 20.75 112.745 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 10.9 tp -57.57 -45.39 85.25 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.634 -0.712 . . . . 22.399999999999999 110.255 174.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . 0.426 ' NH1' ' O3 ' ' A' 1145 ' ' SO4 . 6.7 ttt85 -53.62 -41.33 66.59 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 121.076 0.465 . . . . 22.530000000000001 111.702 178.146 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -71.76 -32.1 67.34 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.454 0.909 . . . . 24.719999999999999 113.454 -176.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.46 -41.96 72.1 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 119.922 -0.711 . . . . 23.52 110.38 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 55.0 m -66.57 -33.7 76.26 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 110.078 -0.342 . . . . 23.91 110.078 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.91 -23.56 63.6 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.3 0.852 . . . . 26.66 113.3 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -78.25 -26.85 47.4 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.761 1.224 . . . . 44.840000000000003 113.253 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 41.7 mt -56.14 132.2 49.75 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 123.311 0.644 . . . . 32.600000000000001 110.573 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 69.8 p -94.94 -33.12 12.89 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 120.721 0.296 . . . . 32.799999999999997 111.015 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.66 170.06 14.76 Favored Pre-proline 0 CA--C 1.552 1.055 0 CA-C-N 115.97 -0.559 . . . . 28.550000000000001 112.41 172.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -62.19 149.36 90.83 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 N-CA-C 114.191 0.804 . . . . 26.390000000000001 114.191 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.2 tp -127.17 120.09 27.99 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 106.342 -1.725 . . . . 24.18 106.342 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 14.2 mm -109.66 121.75 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 106.497 -1.668 . . . . 23.399999999999999 106.497 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -87.64 132.21 34.17 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.247 -1.02 . . . . 33.090000000000003 108.247 176.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 74.7 t -129.0 137.13 58.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 124.092 0.87 . . . . 25.379999999999999 111.56 -174.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -136.86 128.69 29.08 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.883 -1.053 . . . . 32.07 108.47 172.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 62.3 mt -67.1 -41.66 87.35 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 C-N-CA 124.162 0.985 . . . . 25.989999999999998 110.265 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 83.7 p -90.59 162.51 14.95 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.382 -0.826 . . . . 24.66 111.51 179.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -84.4 107.33 16.6 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.867 -1.16 . . . . 24.140000000000001 107.867 167.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 28.6 m -70.3 -17.99 21.16 Favored 'Isoleucine or valine' 0 C--O 1.251 1.155 0 CA-C-O 121.487 0.66 . . . . 24.870000000000001 112.608 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 85.1 m-70 -86.64 -2.21 58.33 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 116.082 -0.508 . . . . 22.16 110.749 -176.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -104.44 1.38 29.98 Favored 'General case' 0 C--O 1.211 -0.95 0 N-CA-C 113.854 1.057 . . . . 26.170000000000002 113.854 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -116.72 -135.98 0.35 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 107.33 -1.359 . . . . 65.189999999999998 107.33 -177.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.6 mp0 -66.8 156.45 35.51 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 112.84 0.681 . . . . 31.059999999999999 112.84 -178.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -66.68 -34.13 77.18 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.093 -0.503 . . . . 54.439999999999998 111.77 -176.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 32.4 p90 -66.02 -23.94 66.66 Favored 'General case' 0 C--O 1.258 1.51 0 O-C-N 123.701 0.625 . . . . 29.43 112.091 -176.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -73.61 -8.25 55.2 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.855 1.057 . . . . 32.600000000000001 113.855 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -95.13 5.96 50.39 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 113.673 0.99 . . . . 28.550000000000001 113.673 -173.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 25.4 t-80 -115.86 140.27 49.39 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.611 0.569 . . . . 29.02 110.577 169.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 4.1 t -138.41 123.07 18.63 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 122.725 0.41 . . . . 22.300000000000001 111.947 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -68.42 -18.48 64.45 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 112.624 0.602 . . . . 22.600000000000001 112.624 175.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 66.5 mt -86.74 -43.89 12.21 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.643 0.608 . . . . 22.149999999999999 112.643 -175.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 75.7 m -41.7 -47.6 9.75 Favored Pre-proline 0 C--O 1.215 -0.711 0 N-CA-C 116.209 1.929 . . . . 18.530000000000001 116.209 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -63.54 -36.39 54.21 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 117.87 -0.954 . . . . 18.649999999999999 112.625 -173.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.2 pp -90.72 3.85 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.006 0 N-CA-C 114.458 1.281 . . . . 21.469999999999999 114.458 175.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -88.78 157.4 18.5 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.19 -0.944 . . . . 19.18 110.722 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 91.7 m -66.66 -43.92 83.25 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.204 -1.035 . . . . 19.550000000000001 108.204 172.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -166.94 179.33 40.77 Favored Glycine 0 C--O 1.226 -0.37 0 CA-C-N 115.742 -0.663 . . . . 21.309999999999999 112.471 -178.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 11.8 t -143.85 139.5 25.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 O-C-N 122.701 -0.293 . . . . 21.52 111.434 -169.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 22.9 mt -129.42 123.45 57.83 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 N-CA-C 108.127 -1.064 . . . . 21.0 108.127 175.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 1.4 m -132.2 145.21 35.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 O-C-N 123.299 0.374 . . . . 19.969999999999999 111.371 176.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 81.39 8.92 86.54 Favored Glycine 0 N--CA 1.471 0.999 0 N-CA-C 118.531 2.172 . . . . 21.16 118.531 170.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 38.8 mt -105.46 19.76 20.04 Favored 'General case' 0 C--O 1.244 0.779 0 O-C-N 122.616 -0.344 . . . . 27.25 110.868 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 57.62 -163.36 7.87 Favored Glycine 0 C--N 1.338 0.676 0 O-C-N 124.0 0.813 . . . . 31.469999999999999 112.231 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 2.9 pp -47.97 -19.62 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 N-CA-C 116.471 2.026 . . . . 42.030000000000001 116.471 174.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -73.33 -21.73 60.48 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.152 0.887 . . . . 56.93 111.562 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -48.98 -41.86 29.57 Favored Glycine 0 C--O 1.221 -0.659 0 C-N-CA 120.906 -0.664 . . . . 28.0 113.192 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -60.37 -44.17 95.85 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 113.009 0.744 . . . . 22.59 113.009 175.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 16.8 mt -67.84 -38.87 83.73 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.765 -0.652 . . . . 23.93 112.115 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 70.0 mt -64.6 -46.76 81.25 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-O 121.133 0.492 . . . . 25.16 111.008 175.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -52.73 -41.27 63.82 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-N 115.547 -0.752 . . . . 26.109999999999999 112.963 170.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 22.8 mt -60.5 -46.37 90.38 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 121.149 -0.969 . . . . 32.75 109.887 176.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 30.6 ttm-85 -63.51 -30.21 71.36 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.316 -0.856 . . . . 47.829999999999998 112.244 -175.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.05 -55.46 32.45 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.02 0.438 . . . . 33.840000000000003 111.059 172.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 14.7 mt -64.56 -29.07 70.09 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.015 -0.993 . . . . 33.409999999999997 111.546 -174.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.56 -25.54 60.12 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.541 1.312 . . . . 36.469999999999999 114.541 167.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.169 0 CA-C-N 118.672 0.669 . . . . 52.670000000000002 112.015 -173.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1143 ' ' W4N . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1144 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1145 ' ' SO4 . . . . . 0.426 ' O3 ' ' NH1' ' A' ' 87' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.5 tt . . . . . 0 N--CA 1.505 2.299 0 N-CA-C 108.782 -0.821 . . . . 48.19 108.782 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.6 mt -102.23 142.79 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 114.3 1.222 . . . . 39.45 114.3 -162.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.8 t -130.35 134.26 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 115.01 -0.995 . . . . 35.21 108.661 176.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -97.99 131.53 44.34 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 120.744 -0.382 . . . . 26.7 110.357 175.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 65.3 t -117.34 114.05 44.48 Favored 'Isoleucine or valine' 0 C--O 1.251 1.162 0 N-CA-C 106.396 -1.705 . . . . 21.27 106.396 174.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 85.3 mt -116.88 121.08 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 107.782 -1.192 . . . . 20.35 107.782 -171.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -110.99 141.93 43.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.147 0.499 . . . . 20.54 110.92 173.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.37 -159.18 29.03 Favored Glycine 0 CA--C 1.521 0.452 0 CA-C-N 115.831 -0.622 . . . . 22.2 114.581 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -49.85 133.65 33.93 Favored 'Trans proline' 0 CA--C 1.508 -0.809 0 C-N-CA 125.03 3.82 . . . . 24.66 114.579 -173.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 80.61 -4.85 1.78 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 116.705 2.113 . . . . 25.37 116.705 176.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.0 mt -82.89 -11.0 58.55 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 112.165 0.432 . . . . 32.55 112.165 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.17 -24.95 63.89 Favored Glycine 0 CA--C 1.521 0.458 0 N-CA-C 111.195 -0.762 . . . . 31.26 111.195 166.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -90.97 -2.13 57.74 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 112.86 0.689 . . . . 37.39 112.86 -168.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.0 tp -37.22 130.24 0.9 Allowed 'General case' 0 CA--C 1.537 0.477 0 O-C-N 123.715 0.634 . . . . 45.41 111.504 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.89 65.14 2.01 Favored Glycine 0 N--CA 1.48 1.586 0 N-CA-C 109.296 -1.522 . . . . 56.15 109.296 -172.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 116.475 2.028 . . . . 76.12 116.475 -150.588 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.922 0 N-CA-C 113.721 0.249 . . . . 50.03 113.721 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 84.2 m -83.18 132.43 35.07 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.373 1.619 . . . . 44.85 115.373 -166.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.0 p -85.59 161.68 19.19 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.346 0.658 . . . . 41.88 111.505 175.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HIS . . . . . 0.481 ' O ' HG23 ' A' ' 33' ' ' VAL . 61.4 t-80 -63.79 -35.24 79.97 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 112.983 0.734 . . . . 34.18 112.983 -178.014 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -64.31 -39.35 93.74 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.46 -0.791 . . . . 31.28 110.475 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -63.78 -42.16 97.8 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 124.357 1.036 . . . . 55.02 111.574 173.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.2 tp -58.57 -40.57 83.47 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 123.836 0.71 . . . . 28.87 111.0 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 29' ' ' HIS . 96.4 t -62.5 -47.53 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 107.275 -1.38 . . . . 26.25 107.275 178.912 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.57 -45.78 90.85 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.367 0.877 . . . . 28.76 113.367 179.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.3 mt -56.13 -48.62 75.88 Favored 'General case' 0 CA--C 1.504 -0.809 0 C-N-CA 122.414 0.286 . . . . 34.43 111.122 176.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 63.2 mt -66.3 -50.35 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 CA-C-N 115.45 -0.795 . . . . 30.83 110.352 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -53.62 -43.41 68.67 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.343 0.868 . . . . 36.03 113.343 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -64.21 -49.75 70.77 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.045 0.757 . . . . 48.49 113.045 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.65 -37.91 85.79 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 110.108 -0.33 . . . . 47.5 110.108 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.8 -43.54 88.42 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.26 -0.427 . . . . 41.09 111.478 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.69 -58.79 5.02 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.352 -0.385 . . . . 38.26 110.302 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -48.3 -37.01 15.34 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.815 1.413 . . . . 68.31 114.815 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.0 mt -85.82 -3.18 58.84 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 112.069 0.396 . . . . 33.76 112.069 -178.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.59 44.03 58.87 Favored Glycine 0 C--O 1.221 -0.66 0 C-N-CA 121.51 -0.376 . . . . 34.51 112.229 -176.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.1 mt -125.81 167.01 15.79 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 108.142 -1.059 . . . . 38.05 108.142 172.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.8 tttt -112.44 129.27 56.38 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.959 -1.019 . . . . 36.89 108.281 163.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -100.79 124.6 46.66 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.527 0.68 . . . . 25.59 109.65 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.7 t -101.75 107.69 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.375 -1.343 . . . . 23.94 107.375 166.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 38.0 t -103.65 142.65 16.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 CA-C-O 120.92 0.391 . . . . 24.65 110.335 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . 0.506 ' HG3' HH11 ' A' ' 50' ' ' ARG . 10.7 mmt85 -148.84 145.21 27.4 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 119.086 -0.483 . . . . 43.45 110.753 -169.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.2 tm0? -139.94 137.64 34.93 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 119.839 -0.744 . . . . 22.63 111.676 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 11.1 t -153.46 140.68 19.5 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.626 0.602 . . . . 19.46 112.626 175.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -83.53 -4.29 58.41 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.461 -0.79 . . . . 23.62 110.326 172.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.1 t -96.67 117.51 31.15 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 123.036 0.534 . . . . 18.06 111.696 -177.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -56.01 -44.27 78.5 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.001 0.741 . . . . 22.82 113.001 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.98 -39.58 90.14 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.263 -0.426 . . . . 20.05 111.086 -178.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -66.08 -44.15 85.25 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.434 -0.803 . . . . 23.73 110.459 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . 0.429 ' O ' HG12 ' A' ' 62' ' ' ILE . 36.2 mt -57.35 -48.53 78.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 119.936 -0.706 . . . . 23.16 110.81 174.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.8 mt -57.76 -36.53 72.24 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.836 0.68 . . . . 24.28 112.836 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -65.72 -44.11 87.04 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.32 -0.993 . . . . 26.38 108.32 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 32.4 m0 -62.04 -35.87 79.88 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.788 0.662 . . . . 25.23 112.788 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 58' ' ' LEU . 35.8 mm -70.1 -41.35 79.08 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.184 0 N-CA-C 109.129 -0.693 . . . . 25.5 109.129 178.315 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 10.4 m-70 -57.47 -49.06 77.5 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.836 0.827 . . . . 28.98 109.958 -179.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -59.27 -44.81 92.43 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.002 -1.454 . . . . 30.68 111.217 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.53 -37.44 86.11 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.017 0.377 . . . . 22.61 112.017 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.49 -60.39 3.6 Favored 'General case' 0 C--O 1.211 -0.971 0 N-CA-C 109.082 -0.71 . . . . 23.42 109.082 171.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -51.83 -46.68 64.44 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.23 0.612 . . . . 26.17 112.56 178.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.05 -15.58 62.03 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 113.599 0.963 . . . . 29.39 113.599 -178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 61.02 34.32 19.32 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.43 1.092 . . . . 27.28 111.061 -170.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -94.89 143.39 26.07 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 123.4 0.68 . . . . 38.94 111.34 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -77.79 162.18 29.9 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 117.249 -1.367 . . . . 27.11 112.462 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 73.0 t -135.65 133.18 51.67 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 O-C-N 124.528 1.143 . . . . 25.06 110.454 -173.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.3 mt -105.2 118.47 52.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 105.128 -2.175 . . . . 20.89 105.128 165.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 59.4 tp -123.02 129.18 51.18 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.499 0.666 . . . . 21.58 112.39 -170.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -126.59 98.09 5.27 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.375 -1.713 . . . . 19.53 106.375 171.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.8 11.01 21.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.745 -0.661 . . . . 23.55 112.393 -167.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 48.61 -137.5 16.18 Favored Glycine 0 C--O 1.253 1.288 0 CA-C-O 121.68 0.6 . . . . 21.04 113.631 -171.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.68 -33.01 54.72 Favored Glycine 0 N--CA 1.469 0.851 0 N-CA-C 116.019 1.167 . . . . 20.81 116.019 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.6 mt -61.9 -18.88 61.79 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 113.714 1.005 . . . . 20.68 113.714 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 86.2 m -52.67 -42.26 64.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.766 -0.652 . . . . 20.55 112.67 174.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -92.86 -4.18 53.33 Favored 'General case' 0 C--O 1.247 0.938 0 CA-C-N 115.448 -0.796 . . . . 22.92 112.54 -171.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 17.3 p -131.25 -31.5 1.64 Allowed 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 116.064 1.876 . . . . 21.48 116.064 -165.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.1 t -93.69 111.43 23.12 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 114.726 1.38 . . . . 22.06 114.726 -172.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 38.6 t -78.39 -33.74 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.415 -1.328 . . . . 21.41 107.415 172.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.34 -48.8 79.66 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 122.011 0.91 . . . . 20.75 112.745 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 10.9 tp -57.57 -45.39 85.25 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.634 -0.712 . . . . 22.4 110.255 174.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 116' ' ' TYR . 6.7 ttt85 -53.62 -41.33 66.59 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 121.076 0.465 . . . . 22.53 111.702 178.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -71.76 -32.1 67.34 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.454 0.909 . . . . 24.72 113.454 -176.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.46 -41.96 72.1 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 119.922 -0.711 . . . . 23.52 110.38 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 55.0 m -66.57 -33.7 76.26 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 110.078 -0.342 . . . . 23.91 110.078 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.91 -23.56 63.6 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.3 0.852 . . . . 26.66 113.3 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -78.25 -26.85 47.4 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.761 1.224 . . . . 44.84 113.253 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 41.7 mt -56.14 132.2 49.75 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 123.311 0.644 . . . . 32.6 110.573 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 69.8 p -94.94 -33.12 12.89 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 120.721 0.296 . . . . 32.8 111.015 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.66 170.06 14.76 Favored Pre-proline 0 CA--C 1.552 1.055 0 CA-C-N 115.97 -0.559 . . . . 28.55 112.41 172.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -62.19 149.36 90.83 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 N-CA-C 114.191 0.804 . . . . 26.39 114.191 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . 0.441 HD23 ' HA ' ' A' ' 121' ' ' ALA . 23.2 tp -127.17 120.09 27.99 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 106.342 -1.725 . . . . 24.18 106.342 175.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 14.2 mm -109.66 121.75 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 106.497 -1.668 . . . . 23.4 106.497 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -87.64 132.21 34.17 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.247 -1.02 . . . . 33.09 108.247 176.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 74.7 t -129.0 137.13 58.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 124.092 0.87 . . . . 25.38 111.56 -174.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -136.86 128.69 29.08 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.883 -1.053 . . . . 32.07 108.47 172.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ILE . . . . . 0.43 HG23 ' HA2' ' A' ' 129' ' ' GLY . 62.3 mt -67.1 -41.66 87.35 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 C-N-CA 124.162 0.985 . . . . 25.99 110.265 -178.339 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 83.7 p -90.59 162.51 14.95 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.382 -0.826 . . . . 24.66 111.51 179.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -84.4 107.33 16.6 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.867 -1.16 . . . . 24.14 107.867 167.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 28.6 m -70.3 -17.99 21.16 Favored 'Isoleucine or valine' 0 C--O 1.251 1.155 0 CA-C-O 121.487 0.66 . . . . 24.87 112.608 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 85.1 m-70 -86.64 -2.21 58.33 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 116.082 -0.508 . . . . 22.16 110.749 -176.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -104.44 1.38 29.98 Favored 'General case' 0 C--O 1.211 -0.95 0 N-CA-C 113.854 1.057 . . . . 26.17 113.854 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -116.72 -135.98 0.35 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 107.33 -1.359 . . . . 65.19 107.33 -177.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.6 mp0 -66.8 156.45 35.51 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 112.84 0.681 . . . . 31.06 112.84 -178.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -66.68 -34.13 77.18 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.093 -0.503 . . . . 54.44 111.77 -176.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 32.4 p90 -66.02 -23.94 66.66 Favored 'General case' 0 C--O 1.258 1.51 0 O-C-N 123.701 0.625 . . . . 29.43 112.091 -176.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -73.61 -8.25 55.2 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.855 1.057 . . . . 32.6 113.855 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -95.13 5.96 50.39 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 113.673 0.99 . . . . 28.55 113.673 -173.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 25.4 t-80 -115.86 140.27 49.39 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.611 0.569 . . . . 29.02 110.577 169.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 4.1 t -138.41 123.07 18.63 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 122.725 0.41 . . . . 22.3 111.947 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' TYR . . . . . 0.449 ' O ' ' HG3' ' A' ' 87' ' ' ARG . 54.7 m-85 -68.42 -18.48 64.45 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 112.624 0.602 . . . . 22.6 112.624 175.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 66.5 mt -86.74 -43.89 12.21 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.643 0.608 . . . . 22.15 112.643 -175.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 75.7 m -41.7 -47.6 9.75 Favored Pre-proline 0 C--O 1.215 -0.711 0 N-CA-C 116.209 1.929 . . . . 18.53 116.209 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -63.54 -36.39 54.21 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 117.87 -0.954 . . . . 18.65 112.625 -173.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.2 pp -90.72 3.85 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.006 0 N-CA-C 114.458 1.281 . . . . 21.47 114.458 175.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ALA . . . . . 0.441 ' HA ' HD23 ' A' ' 97' ' ' LEU . . . -88.78 157.4 18.5 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.19 -0.944 . . . . 19.18 110.722 176.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 91.7 m -66.66 -43.92 83.25 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.204 -1.035 . . . . 19.55 108.204 172.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -166.94 179.33 40.77 Favored Glycine 0 C--O 1.226 -0.37 0 CA-C-N 115.742 -0.663 . . . . 21.31 112.471 -178.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 11.8 t -143.85 139.5 25.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 O-C-N 122.701 -0.293 . . . . 21.52 111.434 -169.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 22.9 mt -129.42 123.45 57.83 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 N-CA-C 108.127 -1.064 . . . . 21.0 108.127 175.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 1.4 m -132.2 145.21 35.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 O-C-N 123.299 0.374 . . . . 19.97 111.371 176.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 81.39 8.92 86.54 Favored Glycine 0 N--CA 1.471 0.999 0 N-CA-C 118.531 2.172 . . . . 21.16 118.531 170.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 38.8 mt -105.46 19.76 20.04 Favored 'General case' 0 C--O 1.244 0.779 0 O-C-N 122.616 -0.344 . . . . 27.25 110.868 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLY . . . . . 0.43 ' HA2' HG23 ' A' ' 102' ' ' ILE . . . 57.62 -163.36 7.87 Favored Glycine 0 C--N 1.338 0.676 0 O-C-N 124.0 0.813 . . . . 31.47 112.231 178.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 2.9 pp -47.97 -19.62 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 N-CA-C 116.471 2.026 . . . . 42.03 116.471 174.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -73.33 -21.73 60.48 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.152 0.887 . . . . 56.93 111.562 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -48.98 -41.86 29.57 Favored Glycine 0 C--O 1.221 -0.659 0 C-N-CA 120.906 -0.664 . . . . 28.0 113.192 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -60.37 -44.17 95.85 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 113.009 0.744 . . . . 22.59 113.009 175.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 16.8 mt -67.84 -38.87 83.73 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.765 -0.652 . . . . 23.93 112.115 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 70.0 mt -64.6 -46.76 81.25 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-O 121.133 0.492 . . . . 25.16 111.008 175.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -52.73 -41.27 63.82 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-N 115.547 -0.752 . . . . 26.11 112.963 170.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 22.8 mt -60.5 -46.37 90.38 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 121.149 -0.969 . . . . 32.75 109.887 176.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 30.6 ttm-85 -63.51 -30.21 71.36 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.316 -0.856 . . . . 47.83 112.244 -175.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.05 -55.46 32.45 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.02 0.438 . . . . 33.84 111.059 172.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 14.7 mt -64.56 -29.07 70.09 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.015 -0.993 . . . . 33.41 111.546 -174.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.56 -25.54 60.12 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.541 1.312 . . . . 36.47 114.541 167.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.169 0 CA-C-N 118.672 0.669 . . . . 52.67 112.015 -173.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1143 ' ' W4N . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1144 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1145 ' ' SO4 . . . . . 0.426 ' O3 ' ' NH1' ' A' ' 87' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.5 tt . . . . . 0 N--CA 1.505 2.299 0 N-CA-C 108.782 -0.821 . . . . 48.189999999999998 108.782 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.6 mt -102.23 142.79 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 114.3 1.222 . . . . 39.450000000000003 114.3 -162.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.8 t -130.35 134.26 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 115.01 -0.995 . . . . 35.210000000000001 108.661 176.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -97.99 131.53 44.34 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 120.744 -0.382 . . . . 26.699999999999999 110.357 175.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 65.3 t -117.34 114.05 44.48 Favored 'Isoleucine or valine' 0 C--O 1.251 1.162 0 N-CA-C 106.396 -1.705 . . . . 21.27 106.396 174.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 85.3 mt -116.88 121.08 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 N-CA-C 107.782 -1.192 . . . . 20.350000000000001 107.782 -171.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -110.99 141.93 43.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.147 0.499 . . . . 20.539999999999999 110.92 173.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.37 -159.18 29.03 Favored Glycine 0 CA--C 1.521 0.452 0 CA-C-N 115.831 -0.622 . . . . 22.199999999999999 114.581 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -49.85 133.65 33.93 Favored 'Trans proline' 0 CA--C 1.508 -0.809 0 C-N-CA 125.03 3.82 . . . . 24.66 114.579 -173.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 80.61 -4.85 1.78 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 116.705 2.113 . . . . 25.370000000000001 116.705 176.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.0 mt -82.89 -11.0 58.55 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 112.165 0.432 . . . . 32.549999999999997 112.165 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.17 -24.95 63.89 Favored Glycine 0 CA--C 1.521 0.458 0 N-CA-C 111.195 -0.762 . . . . 31.260000000000002 111.195 166.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -90.97 -2.13 57.74 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 112.86 0.689 . . . . 37.390000000000001 112.86 -168.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.0 tp -37.22 130.24 0.9 Allowed 'General case' 0 CA--C 1.537 0.477 0 O-C-N 123.715 0.634 . . . . 45.409999999999997 111.504 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.89 65.14 2.01 Favored Glycine 0 N--CA 1.48 1.586 0 N-CA-C 109.296 -1.522 . . . . 56.149999999999999 109.296 -172.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 116.475 2.028 . . . . 76.120000000000005 116.475 -150.588 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.922 0 N-CA-C 113.721 0.249 . . . . 50.030000000000001 113.721 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 84.2 m -83.18 132.43 35.07 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.373 1.619 . . . . 44.850000000000001 115.373 -166.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.0 p -85.59 161.68 19.19 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.346 0.658 . . . . 41.880000000000003 111.505 175.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.481 ' O ' HG23 ' A' ' 33' ' ' VAL . 61.4 t-80 -63.79 -35.24 79.97 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 112.983 0.734 . . . . 34.18 112.983 -178.014 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -64.31 -39.35 93.74 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.46 -0.791 . . . . 31.280000000000001 110.475 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -63.78 -42.16 97.8 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 124.357 1.036 . . . . 55.020000000000003 111.574 173.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.2 tp -58.57 -40.57 83.47 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 123.836 0.71 . . . . 28.870000000000001 111.0 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 29' ' ' HIS . 96.4 t -62.5 -47.53 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 107.275 -1.38 . . . . 26.25 107.275 178.912 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.57 -45.78 90.85 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.367 0.877 . . . . 28.760000000000002 113.367 179.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.3 mt -56.13 -48.62 75.88 Favored 'General case' 0 CA--C 1.504 -0.809 0 C-N-CA 122.414 0.286 . . . . 34.43 111.122 176.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 63.2 mt -66.3 -50.35 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 CA-C-N 115.45 -0.795 . . . . 30.829999999999998 110.352 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -53.62 -43.41 68.67 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.343 0.868 . . . . 36.030000000000001 113.343 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -64.21 -49.75 70.77 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.045 0.757 . . . . 48.490000000000002 113.045 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.65 -37.91 85.79 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 110.108 -0.33 . . . . 47.5 110.108 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.8 -43.54 88.42 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.26 -0.427 . . . . 41.090000000000003 111.478 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.69 -58.79 5.02 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.352 -0.385 . . . . 38.259999999999998 110.302 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -48.3 -37.01 15.34 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.815 1.413 . . . . 68.310000000000002 114.815 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.0 mt -85.82 -3.18 58.84 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 112.069 0.396 . . . . 33.759999999999998 112.069 -178.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.59 44.03 58.87 Favored Glycine 0 C--O 1.221 -0.66 0 C-N-CA 121.51 -0.376 . . . . 34.509999999999998 112.229 -176.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.1 mt -125.81 167.01 15.79 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 108.142 -1.059 . . . . 38.049999999999997 108.142 172.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.8 tttt -112.44 129.27 56.38 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.959 -1.019 . . . . 36.890000000000001 108.281 163.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -100.79 124.6 46.66 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.527 0.68 . . . . 25.59 109.65 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.7 t -101.75 107.69 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.375 -1.343 . . . . 23.940000000000001 107.375 166.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 38.0 t -103.65 142.65 16.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 CA-C-O 120.92 0.391 . . . . 24.649999999999999 110.335 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.506 ' HG3' HH11 ' A' ' 50' ' ' ARG . 10.7 mmt85 -148.84 145.21 27.4 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 119.086 -0.483 . . . . 43.450000000000003 110.753 -169.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.2 tm0? -139.94 137.64 34.93 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 119.839 -0.744 . . . . 22.629999999999999 111.676 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 11.1 t -153.46 140.68 19.5 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.626 0.602 . . . . 19.460000000000001 112.626 175.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -83.53 -4.29 58.41 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.461 -0.79 . . . . 23.620000000000001 110.326 172.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.1 t -96.67 117.51 31.15 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 123.036 0.534 . . . . 18.059999999999999 111.696 -177.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -56.01 -44.27 78.5 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.001 0.741 . . . . 22.82 113.001 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.98 -39.58 90.14 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.263 -0.426 . . . . 20.050000000000001 111.086 -178.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -66.08 -44.15 85.25 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.434 -0.803 . . . . 23.73 110.459 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.429 ' O ' HG12 ' A' ' 62' ' ' ILE . 36.2 mt -57.35 -48.53 78.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 119.936 -0.706 . . . . 23.16 110.81 174.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.8 mt -57.76 -36.53 72.24 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.836 0.68 . . . . 24.280000000000001 112.836 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -65.72 -44.11 87.04 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.32 -0.993 . . . . 26.379999999999999 108.32 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 32.4 m0 -62.04 -35.87 79.88 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.788 0.662 . . . . 25.23 112.788 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 58' ' ' LEU . 35.8 mm -70.1 -41.35 79.08 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.184 0 N-CA-C 109.129 -0.693 . . . . 25.5 109.129 178.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 10.4 m-70 -57.47 -49.06 77.5 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.836 0.827 . . . . 28.98 109.958 -179.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -59.27 -44.81 92.43 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.002 -1.454 . . . . 30.68 111.217 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.53 -37.44 86.11 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.017 0.377 . . . . 22.609999999999999 112.017 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.49 -60.39 3.6 Favored 'General case' 0 C--O 1.211 -0.971 0 N-CA-C 109.082 -0.71 . . . . 23.420000000000002 109.082 171.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -51.83 -46.68 64.44 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.23 0.612 . . . . 26.170000000000002 112.56 178.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.05 -15.58 62.03 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 113.599 0.963 . . . . 29.390000000000001 113.599 -178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 61.02 34.32 19.32 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.43 1.092 . . . . 27.280000000000001 111.061 -170.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -94.89 143.39 26.07 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 123.4 0.68 . . . . 38.939999999999998 111.34 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -77.79 162.18 29.9 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 117.249 -1.367 . . . . 27.109999999999999 112.462 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 73.0 t -135.65 133.18 51.67 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 O-C-N 124.528 1.143 . . . . 25.059999999999999 110.454 -173.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.3 mt -105.2 118.47 52.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 105.128 -2.175 . . . . 20.890000000000001 105.128 165.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 59.4 tp -123.02 129.18 51.18 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.499 0.666 . . . . 21.579999999999998 112.39 -170.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -126.59 98.09 5.27 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.375 -1.713 . . . . 19.530000000000001 106.375 171.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.8 11.01 21.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.745 -0.661 . . . . 23.550000000000001 112.393 -167.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 48.61 -137.5 16.18 Favored Glycine 0 C--O 1.253 1.288 0 CA-C-O 121.68 0.6 . . . . 21.039999999999999 113.631 -171.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.68 -33.01 54.72 Favored Glycine 0 N--CA 1.469 0.851 0 N-CA-C 116.019 1.167 . . . . 20.809999999999999 116.019 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.6 mt -61.9 -18.88 61.79 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 113.714 1.005 . . . . 20.68 113.714 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 86.2 m -52.67 -42.26 64.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.766 -0.652 . . . . 20.550000000000001 112.67 174.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -92.86 -4.18 53.33 Favored 'General case' 0 C--O 1.247 0.938 0 CA-C-N 115.448 -0.796 . . . . 22.920000000000002 112.54 -171.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 17.3 p -131.25 -31.5 1.64 Allowed 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 116.064 1.876 . . . . 21.48 116.064 -165.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.1 t -93.69 111.43 23.12 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 114.726 1.38 . . . . 22.059999999999999 114.726 -172.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 38.6 t -78.39 -33.74 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.415 -1.328 . . . . 21.41 107.415 172.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.34 -48.8 79.66 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 122.011 0.91 . . . . 20.75 112.745 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 10.9 tp -57.57 -45.39 85.25 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.634 -0.712 . . . . 22.399999999999999 110.255 174.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 116' ' ' TYR . 6.7 ttt85 -53.62 -41.33 66.59 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 121.076 0.465 . . . . 22.530000000000001 111.702 178.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -71.76 -32.1 67.34 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.454 0.909 . . . . 24.719999999999999 113.454 -176.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.46 -41.96 72.1 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 119.922 -0.711 . . . . 23.52 110.38 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 55.0 m -66.57 -33.7 76.26 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 110.078 -0.342 . . . . 23.91 110.078 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.91 -23.56 63.6 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.3 0.852 . . . . 26.66 113.3 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -78.25 -26.85 47.4 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.761 1.224 . . . . 44.840000000000003 113.253 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 41.7 mt -56.14 132.2 49.75 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 123.311 0.644 . . . . 32.600000000000001 110.573 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 69.8 p -94.94 -33.12 12.89 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 120.721 0.296 . . . . 32.799999999999997 111.015 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.66 170.06 14.76 Favored Pre-proline 0 CA--C 1.552 1.055 0 CA-C-N 115.97 -0.559 . . . . 28.550000000000001 112.41 172.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -62.19 149.36 90.83 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 N-CA-C 114.191 0.804 . . . . 26.390000000000001 114.191 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.441 HD23 ' HA ' ' A' ' 121' ' ' ALA . 23.2 tp -127.17 120.09 27.99 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 106.342 -1.725 . . . . 24.18 106.342 175.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 14.2 mm -109.66 121.75 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 106.497 -1.668 . . . . 23.399999999999999 106.497 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -87.64 132.21 34.17 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.247 -1.02 . . . . 33.090000000000003 108.247 176.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 74.7 t -129.0 137.13 58.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 124.092 0.87 . . . . 25.379999999999999 111.56 -174.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -136.86 128.69 29.08 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.883 -1.053 . . . . 32.07 108.47 172.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.43 HG23 ' HA2' ' A' ' 129' ' ' GLY . 62.3 mt -67.1 -41.66 87.35 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 C-N-CA 124.162 0.985 . . . . 25.989999999999998 110.265 -178.339 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 83.7 p -90.59 162.51 14.95 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.382 -0.826 . . . . 24.66 111.51 179.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -84.4 107.33 16.6 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.867 -1.16 . . . . 24.140000000000001 107.867 167.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 28.6 m -70.3 -17.99 21.16 Favored 'Isoleucine or valine' 0 C--O 1.251 1.155 0 CA-C-O 121.487 0.66 . . . . 24.870000000000001 112.608 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 85.1 m-70 -86.64 -2.21 58.33 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 116.082 -0.508 . . . . 22.16 110.749 -176.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -104.44 1.38 29.98 Favored 'General case' 0 C--O 1.211 -0.95 0 N-CA-C 113.854 1.057 . . . . 26.170000000000002 113.854 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -116.72 -135.98 0.35 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 107.33 -1.359 . . . . 65.189999999999998 107.33 -177.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.6 mp0 -66.8 156.45 35.51 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 112.84 0.681 . . . . 31.059999999999999 112.84 -178.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -66.68 -34.13 77.18 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.093 -0.503 . . . . 54.439999999999998 111.77 -176.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 32.4 p90 -66.02 -23.94 66.66 Favored 'General case' 0 C--O 1.258 1.51 0 O-C-N 123.701 0.625 . . . . 29.43 112.091 -176.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -73.61 -8.25 55.2 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.855 1.057 . . . . 32.600000000000001 113.855 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -95.13 5.96 50.39 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 113.673 0.99 . . . . 28.550000000000001 113.673 -173.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 25.4 t-80 -115.86 140.27 49.39 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.611 0.569 . . . . 29.02 110.577 169.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 4.1 t -138.41 123.07 18.63 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 122.725 0.41 . . . . 22.300000000000001 111.947 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' TYR . . . . . 0.449 ' O ' ' HG3' ' A' ' 87' ' ' ARG . 54.7 m-85 -68.42 -18.48 64.45 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 112.624 0.602 . . . . 22.600000000000001 112.624 175.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 66.5 mt -86.74 -43.89 12.21 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.643 0.608 . . . . 22.149999999999999 112.643 -175.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 75.7 m -41.7 -47.6 9.75 Favored Pre-proline 0 C--O 1.215 -0.711 0 N-CA-C 116.209 1.929 . . . . 18.530000000000001 116.209 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -63.54 -36.39 54.21 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 117.87 -0.954 . . . . 18.649999999999999 112.625 -173.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.2 pp -90.72 3.85 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.006 0 N-CA-C 114.458 1.281 . . . . 21.469999999999999 114.458 175.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.441 ' HA ' HD23 ' A' ' 97' ' ' LEU . . . -88.78 157.4 18.5 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.19 -0.944 . . . . 19.18 110.722 176.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 91.7 m -66.66 -43.92 83.25 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.204 -1.035 . . . . 19.550000000000001 108.204 172.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -166.94 179.33 40.77 Favored Glycine 0 C--O 1.226 -0.37 0 CA-C-N 115.742 -0.663 . . . . 21.309999999999999 112.471 -178.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 11.8 t -143.85 139.5 25.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 O-C-N 122.701 -0.293 . . . . 21.52 111.434 -169.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 22.9 mt -129.42 123.45 57.83 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 N-CA-C 108.127 -1.064 . . . . 21.0 108.127 175.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 1.4 m -132.2 145.21 35.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 O-C-N 123.299 0.374 . . . . 19.969999999999999 111.371 176.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 81.39 8.92 86.54 Favored Glycine 0 N--CA 1.471 0.999 0 N-CA-C 118.531 2.172 . . . . 21.16 118.531 170.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 38.8 mt -105.46 19.76 20.04 Favored 'General case' 0 C--O 1.244 0.779 0 O-C-N 122.616 -0.344 . . . . 27.25 110.868 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.43 ' HA2' HG23 ' A' ' 102' ' ' ILE . . . 57.62 -163.36 7.87 Favored Glycine 0 C--N 1.338 0.676 0 O-C-N 124.0 0.813 . . . . 31.469999999999999 112.231 178.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 2.9 pp -47.97 -19.62 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 N-CA-C 116.471 2.026 . . . . 42.030000000000001 116.471 174.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -73.33 -21.73 60.48 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.152 0.887 . . . . 56.93 111.562 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -48.98 -41.86 29.57 Favored Glycine 0 C--O 1.221 -0.659 0 C-N-CA 120.906 -0.664 . . . . 28.0 113.192 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -60.37 -44.17 95.85 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 113.009 0.744 . . . . 22.59 113.009 175.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 16.8 mt -67.84 -38.87 83.73 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.765 -0.652 . . . . 23.93 112.115 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 70.0 mt -64.6 -46.76 81.25 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-O 121.133 0.492 . . . . 25.16 111.008 175.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -52.73 -41.27 63.82 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-N 115.547 -0.752 . . . . 26.109999999999999 112.963 170.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 22.8 mt -60.5 -46.37 90.38 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 121.149 -0.969 . . . . 32.75 109.887 176.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 30.6 ttm-85 -63.51 -30.21 71.36 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.316 -0.856 . . . . 47.829999999999998 112.244 -175.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.05 -55.46 32.45 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.02 0.438 . . . . 33.840000000000003 111.059 172.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 14.7 mt -64.56 -29.07 70.09 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.015 -0.993 . . . . 33.409999999999997 111.546 -174.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.56 -25.54 60.12 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.541 1.312 . . . . 36.469999999999999 114.541 167.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.169 0 CA-C-N 118.672 0.669 . . . . 52.670000000000002 112.015 -173.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1143 ' ' W4N . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1144 ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1145 ' ' SO4 . . . . . 0.426 ' O3 ' ' NH1' ' A' ' 87' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_