data_3pi4_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 3pi4 _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 ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.231 . . . . . . . . 47.66 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 45.7 p -53.33 -34.47 57.61 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 119.784 -1.822 . . . . 47.83 112.355 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p 71.28 2.04 4.09 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 125.094 1.358 . . . . 46.98 111.103 -174.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.15 130.06 39.43 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 124.023 0.827 . . . . 45.87 111.582 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 57.5 p -77.65 166.8 22.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.339 -0.846 . . . . 47.02 109.183 176.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -57.92 -44.17 99.16 Favored Pre-proline 0 N--CA 1.468 0.457 0 N-CA-C 115.932 1.827 . . . . 54.26 115.932 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -54.67 -53.36 6.23 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 O-C-N 123.58 1.305 . . . . 47.62 109.61 171.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -53.14 -40.9 64.6 Favored 'General case' 0 C--O 1.242 0.699 0 O-C-N 123.684 0.615 . . . . 43.23 111.112 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.7 mttm -66.78 -46.41 75.39 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.325 -1.361 . . . . 40.84 107.325 -177.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . 0.449 ' O ' ' N ' ' A' ' 13' ' ' SER . . . -60.07 -48.09 83.17 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 120.016 -0.674 . . . . 38.48 111.68 176.287 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -40.74 -54.28 2.66 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 114.052 1.13 . . . . 39.33 114.052 172.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mt -63.54 -49.75 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 107.984 -1.117 . . . . 38.86 107.984 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.4 mtm-85 -48.02 -51.73 22.82 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 108.98 -0.748 . . . . 56.39 108.98 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . 0.449 ' N ' ' O ' ' A' ' 9' ' ' ALA . 10.0 t -64.66 -56.38 14.16 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 118.477 -1.289 . . . . 39.72 110.852 -177.158 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . 0.435 ' OG ' ' NE1' ' A' ' 132' ' ' TRP . 2.2 p -55.76 -38.45 69.85 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 123.804 0.69 . . . . 38.16 112.539 -175.689 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -67.41 -37.8 83.64 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 118.725 -1.19 . . . . 38.54 109.859 175.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.3 t -54.52 -32.21 57.68 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 115.979 -0.555 . . . . 42.55 109.507 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 18' ' ' PHE . 21.4 mttm -74.85 -59.01 2.93 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 115.13 -0.941 . . . . 53.09 109.985 178.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' PHE . . . . . 0.433 ' C ' ' O ' ' A' ' 17' ' ' LYS . 36.6 t80 -41.21 -39.92 1.45 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.849 -1.167 . . . . 43.46 107.849 173.916 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 15.4 mmm -75.43 -13.54 60.39 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 115.278 1.585 . . . . 47.11 115.278 -173.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . 0.917 ' C ' ' ND2' ' A' ' 21' ' ' ASN . 38.2 m-20 -62.27 -34.42 76.52 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 112.67 0.619 . . . . 51.01 112.67 176.389 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . 0.917 ' ND2' ' C ' ' A' ' 20' ' ' ASP . 0.6 OUTLIER -132.86 64.84 1.6 Allowed 'General case' 0 CA--C 1.48 -1.728 0 N-CA-C 104.075 -2.565 . . . . 54.98 104.075 172.386 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.9 -45.26 96.04 Favored Glycine 0 N--CA 1.42 -2.42 0 C-N-CA 119.727 -1.225 . . . . 51.97 115.697 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 10.3 t -67.3 -45.8 85.26 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.684 0 C-N-CA 115.583 -2.447 . . . . 52.8 113.58 -178.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 m -52.44 -56.71 13.23 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 118.896 -1.121 . . . . 56.74 108.767 177.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -51.51 -46.96 63.42 Favored 'General case' 0 CA--C 1.506 -0.74 0 O-C-N 124.083 0.865 . . . . 53.9 112.676 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.37 -45.62 28.62 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 110.8 -0.92 . . . . 54.84 110.8 176.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLN . . . . . 0.598 ' O ' ' N ' ' A' ' 31' ' ' MET . 59.6 mt-30 -73.85 -45.53 50.53 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 119.178 -1.009 . . . . 62.96 109.344 -179.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -48.6 -39.71 23.61 Favored Glycine 0 CA--C 1.497 -1.065 0 N-CA-C 106.971 -2.451 . . . . 56.63 106.971 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -67.66 -53.35 28.56 Favored 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 123.757 0.328 . . . . 57.51 111.121 176.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -54.81 -51.89 64.39 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.538 -1.282 . . . . 67.23 107.538 176.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' MET . . . . . 0.598 ' N ' ' O ' ' A' ' 27' ' ' GLN . 79.7 mmm -48.69 -52.11 25.07 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 108.898 -0.778 . . . . 72.24 108.898 -179.679 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.57 -43.11 79.66 Favored 'General case' 0 C--O 1.242 0.692 0 O-C-N 124.352 1.033 . . . . 63.44 110.836 178.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.5 tp -63.34 -60.07 3.87 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 113.161 0.8 . . . . 62.13 113.161 -176.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -56.85 -42.93 80.59 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 110.253 -0.277 . . . . 63.52 110.253 -176.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . . . -58.09 -48.88 78.83 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.115 0.885 . . . . 65.01 111.339 174.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.96 -51.4 47.97 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.667 0.617 . . . . 66.29 112.667 -176.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -126.24 90.74 49.41 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 108.515 -0.92 . . . . 70.52 108.515 178.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -44.52 -48.86 9.75 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.757 2.305 . . . . 69.47 114.844 -177.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . 0.638 ' N ' ' OE1' ' A' ' 39' ' ' GLU . 17.9 pm0 -46.33 -29.93 1.87 Allowed 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 115.954 1.835 . . . . 76.72 115.954 -170.894 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . 0.444 ' O ' ' CD ' ' A' ' 43' ' ' PRO . 11.3 p -52.09 -48.25 64.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.161 -0.472 . . . . 71.54 112.117 -179.287 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 11.0 tp -42.65 -24.4 0.06 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.87 1.433 . . . . 72.77 114.87 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.5 m -53.93 -58.87 11.48 Favored Pre-proline 0 N--CA 1.476 0.874 0 N-CA-C 113.687 0.995 . . . . 71.59 113.687 -175.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PRO . . . . . 0.444 ' CD ' ' O ' ' A' ' 40' ' ' THR . 23.5 Cg_endo -65.94 -7.88 18.21 Favored 'Trans proline' 0 C--N 1.358 1.064 0 C-N-CA 117.413 -1.258 . . . . 70.47 114.277 -179.081 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -88.04 -10.31 50.66 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 113.978 1.103 . . . . 69.27 113.978 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.7 mmtp -50.17 -30.54 11.6 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.182 1.919 . . . . 69.71 116.182 -179.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 2.1 p -61.63 -39.26 90.66 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.245 -0.91 . . . . 68.27 111.279 175.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 49.7 tp -94.69 -58.13 2.27 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 114.776 -1.102 . . . . 65.18 109.305 -173.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -92.66 15.33 14.66 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 115.681 -0.69 . . . . 61.91 112.578 -175.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -79.25 -18.14 74.86 Favored Glycine 0 CA--C 1.503 -0.668 0 C-N-CA 120.282 -0.961 . . . . 58.74 114.268 -169.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.55 7.79 54.08 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.447 -1.061 . . . . 56.72 110.447 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.1 142.9 51.2 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.952 1.301 . . . . 55.24 111.345 -176.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . 0.474 ' N ' ' OE1' ' A' ' 55' ' ' GLN . 30.6 p -101.11 152.59 20.44 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 106.845 -1.539 . . . . 56.25 106.845 177.598 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . 0.426 ' C ' ' O ' ' A' ' 52' ' ' THR . 0.6 OUTLIER -42.55 -47.29 5.13 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 119.425 -0.91 . . . . 61.02 113.288 -171.444 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -51.95 -33.83 39.36 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.16 0.505 . . . . 58.12 111.816 -174.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLN . . . . . 0.474 ' OE1' ' N ' ' A' ' 52' ' ' THR . 59.5 mt-30 -89.77 -16.85 29.37 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 117.058 2.244 . . . . 59.59 117.058 -170.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . 0.615 ' O ' ' C ' ' A' ' 57' ' ' GLN . 25.5 mt -65.72 -42.1 91.5 Favored 'General case' 0 C--O 1.196 -1.715 0 O-C-N 124.769 1.293 . . . . 61.92 108.264 174.921 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . 0.615 ' C ' ' O ' ' A' ' 56' ' ' LEU . 51.4 tp60 -52.57 126.71 20.46 Favored 'General case' 0 N--CA 1.41 -2.433 0 N-CA-C 104.147 -2.538 . . . . 67.84 104.147 -173.644 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 61.45 20.74 11.44 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 114.823 1.416 . . . . 64.34 114.823 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -86.63 139.1 33.36 Favored Pre-proline 0 C--N 1.311 -1.104 0 N-CA-C 109.328 -0.619 . . . . 56.38 109.328 171.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -43.01 -51.71 5.31 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.62 1.546 . . . . 52.93 114.796 175.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.6 mttp -56.69 -38.53 72.4 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.849 0.833 . . . . 50.43 110.37 179.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.2 tpt -75.64 -42.96 50.07 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 107.783 -1.191 . . . . 57.84 107.783 -174.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -60.96 -42.52 98.45 Favored 'General case' 0 C--O 1.241 0.644 0 O-C-N 124.251 0.969 . . . . 57.85 110.418 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.14 -69.08 0.12 Allowed 'General case' 0 N--CA 1.424 -1.74 0 N-CA-C 105.595 -2.002 . . . . 46.0 105.595 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.4 tp60 -41.39 -50.14 3.82 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 114.716 1.376 . . . . 52.62 114.716 -179.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.1 t -61.63 -36.82 81.84 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.013 0.375 . . . . 42.59 112.013 -177.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 44.7 tp -67.94 -47.91 67.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.683 0.754 . . . . 39.82 110.664 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.6 t -42.79 -63.43 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.988 0 CA-C-N 115.137 -0.938 . . . . 39.93 110.819 168.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -56.3 -38.56 71.42 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.5 -0.773 . . . . 41.35 109.512 -178.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.7 m -63.67 -39.93 95.57 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 113.203 0.816 . . . . 45.23 113.203 178.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . 0.403 ' O ' ' C ' ' A' ' 72' ' ' GLY . 90.6 m-20 -61.57 -56.48 19.53 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 109.126 -0.694 . . . . 47.95 109.126 173.286 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLY . . . . . 0.403 ' C ' ' O ' ' A' ' 71' ' ' ASN . . . -31.96 -68.02 0.15 Allowed Glycine 0 CA--C 1.511 -0.17 0 CA-C-N 114.996 -1.002 . . . . 43.47 112.73 174.161 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 11.6 mmm -58.64 -48.76 79.94 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 113.756 1.021 . . . . 51.01 113.756 -178.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.8 m -51.93 -47.8 64.52 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 106.472 -1.677 . . . . 42.93 106.472 -174.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.2 p -54.68 -50.58 67.9 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.712 -0.676 . . . . 43.22 110.554 -177.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -52.77 -59.35 4.6 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.508 -0.553 . . . . 43.1 109.508 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 74.6 t -52.09 -38.06 23.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.924 -0.58 . . . . 43.16 112.158 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -72.49 -6.9 46.97 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 115.389 1.626 . . . . 51.75 115.389 -177.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -129.63 34.89 4.26 Favored 'General case' 0 CA--C 1.481 -1.694 0 N-CA-C 108.502 -0.925 . . . . 44.4 108.502 -172.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.5 mt -61.05 -33.06 72.71 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 113.921 -1.491 . . . . 40.86 108.895 171.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -98.49 7.59 45.96 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 114.524 1.305 . . . . 42.07 114.524 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASP . . . . . 0.731 ' OD2' ' CE ' ' A' ' 85' ' ' MET . 34.4 t0 -130.19 66.14 1.5 Allowed 'General case' 0 C--O 1.219 -0.501 0 O-C-N 124.265 0.978 . . . . 52.5 108.878 177.896 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . 0.5 ' O ' ' C ' ' A' ' 84' ' ' ASP . 4.7 m-20 -57.71 -35.42 70.64 Favored 'General case' 0 N--CA 1.413 -2.318 0 C-N-CA 118.675 -1.21 . . . . 53.04 111.715 -176.978 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . 0.5 ' C ' ' O ' ' A' ' 83' ' ' ASN . 65.2 m-20 -56.43 -47.93 78.05 Favored 'General case' 0 N--CA 1.412 -2.328 0 C-N-CA 114.792 -2.763 . . . . 46.48 105.861 -173.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' MET . . . . . 0.731 ' CE ' ' OD2' ' A' ' 82' ' ' ASP . 8.2 ttm -69.17 -44.65 71.79 Favored 'General case' 0 C--O 1.18 -2.564 0 C-N-CA 119.413 -0.915 . . . . 56.87 109.442 179.42 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 37.6 tp -49.54 -57.73 6.53 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.494 -0.882 . . . . 43.39 110.42 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 2.9 t -55.74 -40.98 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.847 0 C-N-CA 119.938 -0.705 . . . . 41.12 111.345 -176.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 91.6 t -58.38 -51.95 65.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 C-N-CA 119.26 -0.976 . . . . 42.57 109.817 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.34 -51.02 58.2 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.376 0.51 . . . . 43.72 112.376 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 84.8 mt -53.28 -57.13 5.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.266 0 N-CA-C 109.755 -0.461 . . . . 46.6 109.755 173.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -54.46 -47.26 73.14 Favored 'General case' 0 CA--C 1.5 -0.949 0 C-N-CA 120.71 -0.396 . . . . 58.82 110.232 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -52.48 -53.24 48.39 Favored 'General case' 0 CA--C 1.519 -0.242 0 O-C-N 124.856 1.347 . . . . 54.98 110.051 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' MET . . . . . 0.499 ' CE ' ' ND1' ' A' ' 97' ' ' HIS . 1.6 ttp -51.62 -53.69 35.77 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.869 -1.059 . . . . 62.44 109.924 170.092 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.47 -38.3 59.06 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 114.532 1.308 . . . . 59.57 114.532 -176.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -58.58 -45.49 88.93 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 122.825 0.45 . . . . 67.39 111.558 176.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.7 mt -72.52 -49.56 32.0 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.283 -0.567 . . . . 67.33 110.031 -172.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HIS . . . . . 0.499 ' ND1' ' CE ' ' A' ' 93' ' ' MET . 66.1 m80 -62.83 -18.85 63.43 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 120.349 -0.54 . . . . 68.15 111.037 177.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -71.64 -48.91 44.7 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 120.393 -0.523 . . . . 72.56 112.053 177.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -54.9 -19.53 6.82 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 124.139 0.899 . . . . 73.98 112.925 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 7.5 mtp85 -103.45 10.01 37.44 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.34 0.591 . . . . 87.0 109.803 -179.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 73.96 6.87 74.64 Favored Glycine 0 C--O 1.239 0.452 0 N-CA-C 115.423 0.929 . . . . 75.47 115.423 172.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 2.8 mp -62.57 134.58 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 107.819 -1.178 . . . . 76.77 107.819 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . . . -86.02 157.36 20.11 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 110.36 -0.237 . . . . 76.73 110.36 178.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.72 -38.71 85.97 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 112.377 0.51 . . . . 77.21 112.377 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 89.7 p -79.61 -9.09 59.57 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.92 -0.582 . . . . 77.76 111.417 176.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -76.04 -21.4 56.86 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.382 -0.826 . . . . 78.97 109.877 168.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 11.7 mt -97.71 -35.97 10.39 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 109.159 -0.682 . . . . 73.84 109.159 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 29.8 tpt85 -45.72 -53.45 9.4 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.828 -0.804 . . . . 79.92 108.828 171.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 39.0 p -69.19 -34.04 74.28 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 119.677 -0.809 . . . . 68.96 111.28 -177.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -53.78 -42.29 68.14 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.192 0.441 . . . . 63.8 112.192 173.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -72.52 -33.32 66.81 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 112.73 0.641 . . . . 61.65 112.73 174.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -60.47 -41.78 94.88 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 107.219 -1.4 . . . . 65.04 107.219 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 32.0 mm -68.61 -31.49 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-N 116.225 -0.443 . . . . 59.52 110.503 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.3 tp -70.72 -44.32 67.12 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 120.362 -0.535 . . . . 56.22 110.579 -178.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 59.1 mt -60.19 -49.56 83.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 108.114 -1.069 . . . . 57.32 108.114 177.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -60.03 -48.79 80.26 Favored 'General case' 0 CA--C 1.504 -0.815 0 C-N-CA 119.803 -0.759 . . . . 66.2 110.21 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -48.19 -53.74 15.87 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 123.691 0.619 . . . . 57.23 112.389 172.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 93.5 mtp -63.3 -36.0 82.24 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.629 0.974 . . . . 57.21 113.629 -179.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -63.74 -51.27 65.66 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 107.937 -1.134 . . . . 64.21 107.937 175.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -55.13 -31.52 61.35 Favored 'General case' 0 CA--C 1.489 -1.402 0 O-C-N 124.103 0.877 . . . . 66.07 111.885 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -100.73 14.09 32.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 124.164 0.915 . . . . 59.24 113.288 -177.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 54.29 53.13 11.37 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 122.033 0.92 . . . . 59.94 111.495 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -99.46 -33.43 10.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.115 -1.068 . . . . 57.68 108.115 173.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 5.8 mmt -55.96 112.99 1.33 Allowed 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.736 -0.666 . . . . 54.47 109.744 172.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 18.0 m -77.57 -177.97 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 N-CA-C 106.138 -1.801 . . . . 52.76 106.138 165.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -46.37 129.45 10.93 Favored Glycine 0 C--O 1.223 -0.581 0 N-CA-C 109.621 -1.392 . . . . 50.67 109.621 177.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 52.81 24.44 19.15 Favored Glycine 0 N--CA 1.47 0.945 0 N-CA-C 119.647 2.619 . . . . 48.23 119.647 173.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -83.25 -27.94 29.53 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.602 0.593 . . . . 45.54 112.602 168.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . . . -59.63 -37.84 79.72 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 118.274 -1.37 . . . . 45.73 109.815 175.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -67.07 -49.73 64.11 Favored 'General case' 0 CA--C 1.509 -0.633 0 O-C-N 123.941 0.776 . . . . 50.99 110.404 178.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -56.05 -54.77 40.93 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.414 -1.328 . . . . 43.52 107.414 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' TRP . . . . . 0.435 ' NE1' ' OG ' ' A' ' 14' ' ' SER . 35.1 m95 -55.9 -44.01 77.82 Favored 'General case' 0 CA--C 1.497 -1.072 0 C-N-CA 120.351 -0.54 . . . . 41.45 110.868 -177.384 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -46.1 -62.93 1.12 Allowed 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 123.648 0.592 . . . . 53.74 110.036 175.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 48.1 t -56.58 -52.26 55.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-N 115.382 -0.826 . . . . 39.76 111.004 177.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -44.26 -60.08 2.08 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.08 -0.964 . . . . 40.89 109.943 177.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 2.8 m -67.46 -22.35 28.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 119.288 -0.965 . . . . 39.99 112.122 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -54.39 -65.15 3.69 Favored Glycine 0 CA--C 1.503 -0.689 1 N-CA-C 102.95 -4.06 . . . . 41.84 102.95 173.671 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -45.0 -54.58 6.41 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 113.003 -1.599 . . . . 46.67 114.176 178.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 6.9 mt -52.03 -43.52 37.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.705 0.764 . . . . 45.99 111.76 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 144' ' ' GLY . 88.8 m -74.12 -39.77 63.11 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 119.948 -0.701 . . . . 53.03 111.846 -175.146 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . . . -55.54 -54.37 44.85 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 108.15 -1.055 . . . . 55.29 108.15 172.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 91.4 m -53.45 -40.73 65.46 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-N 116.349 -0.387 . . . . 60.34 110.404 179.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 23.7 mt -63.62 -62.91 1.36 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.405 -1.331 . . . . 64.88 107.405 174.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 140' ' ' CYS . . . -36.99 -67.37 0.43 Allowed Glycine 0 N--CA 1.475 1.267 0 C-N-CA 124.292 0.949 . . . . 69.57 111.583 178.11 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -49.5 -37.69 27.5 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.585 0.957 . . . . 74.1 113.585 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -81.19 -43.13 19.75 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.44 0.904 . . . . 80.42 113.44 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 94.8 mtp -74.3 -33.63 63.27 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.788 -0.57 . . . . 83.43 109.989 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . . . -63.72 -19.85 65.27 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 120.496 -0.482 . . . . 87.16 109.885 168.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -81.7 2.6 28.98 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 122.403 0.281 . . . . 96.01 111.114 173.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.46 173.23 10.75 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 112.423 0.527 . . . . 93.51 112.423 177.006 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.36 0 N-CA-C 113.573 0.953 . . . . 94.64 113.573 -177.856 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 . . . . . . . . 82.32 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' THR . . . . . . . . . . . . . 16.4 p -46.87 151.62 0.59 Allowed 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.954 0.902 . . . . 81.39 110.006 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 10.3 t 55.61 20.64 3.99 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 125.196 1.398 . . . . 78.3 114.676 173.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 15.5 tp -128.48 118.73 23.58 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.936 -1.505 . . . . 74.21 106.936 -169.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.1 p -76.67 177.47 7.51 Favored 'General case' 0 C--O 1.221 -0.407 0 O-C-N 124.057 0.848 . . . . 71.68 111.69 -173.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -99.73 -16.21 0.19 Allowed Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 117.011 2.226 . . . . 74.49 117.011 -168.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -84.38 -18.42 4.93 Favored 'Trans proline' 0 CA--C 1.545 1.037 1 C-N-CA 110.676 -5.749 . . . . 67.9 109.419 158.989 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -67.99 -37.27 81.27 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 122.234 1.016 . . . . 67.1 110.084 173.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -70.61 -37.94 73.9 Favored 'General case' 0 N--CA 1.439 -1.024 0 CA-C-N 115.012 -0.994 . . . . 61.93 109.103 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.83 -42.33 97.64 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.117 0.484 . . . . 56.3 110.024 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.63 -47.59 66.95 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 114.859 -1.064 . . . . 53.2 112.246 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -57.99 -63.78 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 O-C-N 123.776 0.673 . . . . 49.89 110.472 172.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 41.6 mtt85 -43.08 -50.29 6.12 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 119.959 -0.696 . . . . 59.79 112.045 175.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 9.8 m -47.09 -53.31 13.05 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.072 0.939 . . . . 51.84 112.484 175.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 89.1 p -77.17 -35.61 55.8 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 113.29 -1.777 . . . . 45.26 107.483 -168.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' TRP . . . . . . . . . . . . . 67.0 t-105 -72.49 -31.76 65.65 Favored 'General case' 0 N--CA 1.44 -0.953 0 C-N-CA 119.434 -0.906 . . . . 42.62 110.448 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 2.0 t -51.66 -51.86 52.48 Favored 'General case' 0 C--O 1.216 -0.705 0 C-N-CA 120.386 -0.525 . . . . 43.61 111.728 170.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 11.7 mtpt -61.85 -43.89 97.94 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 108.877 -0.786 . . . . 55.45 108.877 -177.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -52.74 -44.76 66.66 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 107.817 -1.179 . . . . 42.53 107.817 177.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' MET . . . . . 0.431 ' C ' ' N ' ' B' ' 21' ' ' ASN . 15.8 mmt -77.28 -34.39 55.65 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 113.47 0.915 . . . . 46.29 113.47 -172.161 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -39.26 -28.23 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.511 0.672 . . . . 45.18 109.305 171.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ASN . . . . . 0.431 ' N ' ' C ' ' B' ' 19' ' ' MET . 7.1 m-80 -124.63 -12.41 7.17 Favored 'General case' 0 C--O 1.189 -2.095 0 N-CA-C 113.898 1.073 . . . . 41.86 113.898 179.275 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 51.61 -118.32 6.86 Favored Glycine 0 C--O 1.182 -3.098 0 N-CA-C 120.701 3.04 . . . . 43.87 120.701 163.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' VAL . . . . . 0.66 ' O ' ' C ' ' B' ' 24' ' ' SER 0.256 26.2 t -57.18 -45.83 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.544 0 CA-C-N 114.648 -0.776 . . . . 44.06 110.351 -174.144 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' SER . . . . . 0.66 ' C ' ' O ' ' B' ' 23' ' ' VAL . 35.9 t -38.39 -57.18 1.16 Allowed 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 117.36 -1.736 . . . . 45.16 107.941 170.401 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -68.04 -26.39 65.84 Favored 'General case' 0 C--O 1.214 -0.814 0 N-CA-C 115.509 1.67 . . . . 48.3 115.509 -177.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.7 -45.04 91.19 Favored Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 106.548 -2.621 . . . . 46.15 106.548 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -61.19 -50.62 72.38 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 109.181 -0.674 . . . . 56.15 109.181 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' GLY . . . . . 0.418 ' C ' ' CE1' ' B' ' 117' ' ' TYR . . . -43.62 -57.76 4.39 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 111.138 -0.785 . . . . 46.08 111.138 175.435 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' PHE . . . . . 0.462 ' O ' ' C ' ' B' ' 30' ' ' TYR . 42.5 t80 -53.93 -57.31 11.46 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 122.534 -0.391 . . . . 46.9 110.271 174.857 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' TYR . . . . . 0.462 ' C ' ' O ' ' B' ' 29' ' ' PHE . 2.5 m-85 -55.69 -39.79 71.46 Favored 'General case' 0 N--CA 1.42 -1.934 0 C-N-CA 117.508 -1.677 . . . . 51.68 108.486 -174.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' MET . . . . . . . . . . . . . 4.9 mmt -60.93 -47.07 88.11 Favored 'General case' 0 C--O 1.198 -1.655 0 C-N-CA 116.36 -2.136 . . . . 60.64 111.503 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -60.43 -38.08 82.96 Favored 'General case' 0 CA--C 1.46 -2.485 0 N-CA-C 106.175 -1.787 . . . . 61.25 106.175 -175.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 63.9 tp -62.52 -54.95 32.22 Favored 'General case' 0 C--N 1.298 -1.668 0 C-N-CA 117.932 -1.507 . . . . 61.56 111.007 -178.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -58.81 -24.77 62.42 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.153 0.501 . . . . 65.61 111.871 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -78.81 -66.13 0.9 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.301 -1.37 . . . . 79.92 107.301 178.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.46 -46.39 76.81 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 113.68 0.993 . . . . 66.8 113.68 179.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -135.8 87.75 24.67 Favored Pre-proline 0 C--O 1.218 -0.561 0 C-N-CA 119.619 -0.833 . . . . 70.21 111.104 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -60.54 -27.95 85.77 Favored 'Trans proline' 0 C--N 1.345 0.392 1 C-N-CA 126.144 4.563 . . . . 67.98 115.076 -172.672 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . . . -50.24 -27.04 5.36 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.564 1.146 . . . . 70.51 111.408 176.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 43.6 p -67.44 -20.76 65.54 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 114.496 1.295 . . . . 71.41 114.496 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 tt -73.23 -19.4 61.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.933 0.397 . . . . 74.01 110.865 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 45.5 m -57.74 -50.68 86.75 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 114.336 1.236 . . . . 74.91 114.336 -171.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -70.26 -21.02 31.73 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 118.038 -0.841 . . . . 75.38 111.872 -176.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' PHE . . . . . 0.49 ' O ' ' C ' ' B' ' 45' ' ' LYS . 48.3 m-85 -75.3 -20.57 59.03 Favored 'General case' 0 CA--C 1.514 -0.416 0 O-C-N 124.091 0.869 . . . . 76.92 112.991 177.175 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LYS . . . . . 0.49 ' C ' ' O ' ' B' ' 44' ' ' PHE . . . -30.43 -52.95 0.17 Allowed 'General case' 0 CA--C 1.543 0.698 0 O-C-N 123.066 0.229 . . . . 79.19 110.66 -179.626 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 8.9 p -70.09 -23.14 63.01 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 117.115 2.265 . . . . 80.79 117.115 -172.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' LEU . . . . . . . . . . . . . 37.9 tp -76.78 -51.68 10.93 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 119.577 -0.849 . . . . 81.05 110.221 171.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -80.11 27.65 0.31 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.769 1.026 . . . . 81.21 113.769 -176.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -69.04 131.52 25.4 Favored Glycine 0 N--CA 1.478 1.453 0 N-CA-C 114.731 0.653 . . . . 82.54 114.731 -171.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 61.09 37.17 93.47 Favored Glycine 0 N--CA 1.47 0.933 0 N-CA-C 110.858 -0.897 . . . . 82.2 110.858 -169.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 9.6 tp -142.01 118.55 10.96 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.203 0.525 . . . . 81.16 110.535 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' THR . . . . . 0.475 ' N ' ' NE2' ' B' ' 55' ' ' GLN . 2.4 t -73.99 154.42 39.3 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.446 -0.797 . . . . 80.61 111.325 -178.985 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mp -60.16 -32.01 70.65 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.001 -0.999 . . . . 77.46 112.362 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.33 -39.53 85.84 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 115.842 -0.617 . . . . 75.09 110.804 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLN . . . . . 0.475 ' NE2' ' N ' ' B' ' 52' ' ' THR . 19.4 pt20 -87.15 0.59 55.07 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 113.154 0.798 . . . . 72.64 113.154 -176.245 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 19.7 mt -60.04 -51.22 70.58 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.271 1.028 . . . . 70.22 113.528 174.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -59.18 124.53 20.29 Favored 'General case' 0 CA--C 1.507 -0.673 0 CA-C-O 121.501 0.667 . . . . 78.76 111.646 -175.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 67.63 -2.28 1.39 Allowed 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 113.167 -1.833 . . . . 68.99 113.599 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -64.82 137.78 97.26 Favored Pre-proline 0 N--CA 1.439 -1.021 0 N-CA-C 106.537 -1.653 . . . . 63.16 106.537 170.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -48.43 -51.49 10.13 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 121.581 1.521 . . . . 57.99 111.648 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 26.4 mttt -51.7 -28.7 15.64 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 119.484 -0.886 . . . . 61.81 112.915 -177.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' MET . . . . . . . . . . . . . 12.6 tpt -83.45 -52.02 6.87 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 110.388 -0.227 . . . . 60.5 110.388 174.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 33.0 mtpt -47.75 -50.65 24.81 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.944 -0.391 . . . . 51.62 109.944 174.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.59 -64.89 0.68 Allowed 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.921 0.391 . . . . 46.29 111.99 176.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -46.54 -44.78 18.18 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 112.443 0.535 . . . . 46.5 112.443 176.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 4.9 t -58.42 -45.39 88.55 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.729 -0.471 . . . . 41.27 109.729 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 36.4 tp -56.25 -55.06 37.87 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-N 115.67 -0.695 . . . . 39.34 110.925 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 66.3 t -45.12 -58.44 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 115.53 -0.759 . . . . 36.71 109.096 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' PHE . . . . . 0.591 ' CE1' ' CBB' ' B' ' 500' ' ' HEM . 43.7 t80 -49.35 -52.05 30.63 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 113.285 0.846 . . . . 36.93 113.285 179.567 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' CYS . . . . . . . . . . . . . 95.4 m -44.6 -56.88 4.0 Favored 'General case' 0 CA--C 1.521 -0.151 0 O-C-N 123.334 0.396 . . . . 37.85 111.57 173.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASN . . . . . 0.412 ' O ' ' N ' ' B' ' 75' ' ' SER . 91.0 m-20 -50.61 -58.85 4.85 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-O 119.396 -0.335 . . . . 41.13 110.659 178.495 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . -42.74 -62.68 2.17 Favored Glycine 0 CA--C 1.522 0.478 0 N-CA-C 111.94 -0.464 . . . . 39.91 111.94 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' MET . . . . . . . . . . . . . 18.6 mmm -52.01 -54.05 34.52 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 113.8 1.037 . . . . 46.39 113.8 177.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 5.6 m -53.12 -51.85 60.59 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 107.906 -1.146 . . . . 42.72 107.906 177.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' SER . . . . . 0.412 ' N ' ' O ' ' B' ' 71' ' ' ASN . 38.6 p -55.32 -14.81 2.02 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.649 -0.705 . . . . 43.94 111.907 -176.902 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 17.8 m-30 -91.03 -49.65 6.3 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 108.187 -1.042 . . . . 45.8 108.187 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 13.9 t -58.86 -29.19 39.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.019 -0.991 . . . . 50.23 112.161 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -83.48 -29.77 27.72 Favored 'General case' 0 N--CA 1.442 -0.866 0 C-N-CA 119.226 -0.99 . . . . 55.82 109.782 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -97.14 25.22 5.63 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 122.055 0.931 . . . . 60.74 111.77 -177.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 32.1 mt -58.37 -30.67 66.96 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-N 114.17 -1.377 . . . . 59.49 111.013 172.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -94.2 -39.01 10.77 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.53 0.937 . . . . 65.05 113.53 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -75.28 45.77 0.3 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.015 0.526 . . . . 72.36 111.977 -178.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -41.98 -47.25 4.34 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 121.057 3.725 . . . . 69.66 121.057 -162.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -56.69 -29.42 62.36 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.364 -0.976 . . . . 72.4 108.364 -175.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' MET . . . . . . . . . . . . . 16.8 ttt -82.68 -42.86 17.59 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 114.935 -1.03 . . . . 64.27 110.578 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 14.8 tp -40.42 -60.16 1.16 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 109.248 -0.649 . . . . 57.37 109.248 169.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 71.6 t -44.6 -42.6 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 N-CA-C 114.504 1.298 . . . . 53.08 114.504 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' VAL . . . . . 0.436 ' O ' ' N ' ' B' ' 92' ' ' LYS . 2.4 t -73.9 -43.78 52.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 116.434 -0.348 . . . . 51.98 110.603 -173.317 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.5 -46.35 76.95 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 107.457 -1.312 . . . . 51.48 107.457 176.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 91.1 mt -59.25 -50.5 79.59 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.728 0 N-CA-C 107.768 -1.197 . . . . 52.61 107.768 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -58.0 -42.24 84.74 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.235 -0.986 . . . . 63.24 112.407 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' LYS . . . . . 0.436 ' N ' ' O ' ' B' ' 88' ' ' VAL . 25.2 mtpp -57.3 -48.02 80.0 Favored 'General case' 0 CA--C 1.504 -0.803 0 N-CA-C 109.845 -0.428 . . . . 63.76 109.845 174.744 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' MET . . . . . . . . . . . . . 3.2 ttp -58.21 -53.31 59.75 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 120.056 -0.658 . . . . 63.08 110.353 178.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.11 -45.23 64.8 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.838 -0.619 . . . . 66.93 112.614 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 33.2 tttt -58.13 -47.81 82.16 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 120.362 -0.535 . . . . 76.67 111.793 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 10.1 mt -62.63 -51.55 66.86 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 120.711 0.291 . . . . 75.49 110.436 -176.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -65.63 -15.29 62.61 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.707 -0.679 . . . . 76.51 112.824 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 22.0 t30 -73.66 -50.68 19.78 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.886 -0.508 . . . . 81.79 111.362 170.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -51.16 -52.57 42.86 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.672 -0.862 . . . . 85.2 108.672 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . . . -68.42 14.73 0.06 Allowed 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 114.359 1.244 . . . . 81.99 114.359 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 66.74 44.1 90.22 Favored Glycine 0 N--CA 1.467 0.737 0 N-CA-C 117.431 1.733 . . . . 81.29 117.431 171.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ILE . . . . . . . . . . . . . 2.7 mp -113.09 153.71 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 122.766 0.427 . . . . 80.35 111.838 -178.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 4.6 mtt85 -107.41 153.72 22.37 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.8 0.334 . . . . 83.27 110.158 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.16 -34.28 56.18 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.461 0.912 . . . . 78.0 113.461 175.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 76.5 p -78.5 -25.79 45.74 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.987 -0.552 . . . . 75.66 111.708 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -58.31 -43.21 88.02 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 106.973 -1.492 . . . . 73.15 106.973 169.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 8.0 mt -77.65 -41.29 38.81 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 119.762 -0.775 . . . . 68.9 112.119 -177.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ARG . . . . . 0.466 ' NH1' ' OD1' ' B' ' 112' ' ' ASP . 12.1 tpt85 -53.51 -37.69 63.01 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.153 0.433 . . . . 66.57 110.969 -179.112 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 75.0 p -79.04 -32.1 44.83 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.336 -0.847 . . . . 66.16 110.88 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.6 -28.91 70.22 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 121.156 0.503 . . . . 64.73 110.647 177.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -76.84 -41.25 44.87 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.917 -0.713 . . . . 69.35 111.709 174.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' ASP . . . . . 0.466 ' OD1' ' NH1' ' B' ' 108' ' ' ARG . 93.6 m-20 -54.83 -38.94 68.04 Favored 'General case' 0 CA--C 1.502 -0.904 0 N-CA-C 109.944 -0.391 . . . . 66.25 109.944 178.151 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 1.1 mp -67.85 -40.63 83.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 107.362 -1.347 . . . . 59.88 107.362 177.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.8 tp -54.64 -48.88 71.73 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 123.918 0.761 . . . . 56.95 109.226 176.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ILE . . . . . . . . . . . . . 2.4 mp -61.1 -47.49 93.31 Favored 'Isoleucine or valine' 0 C--O 1.245 0.828 0 N-CA-C 111.98 0.363 . . . . 56.05 111.98 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -56.33 -57.64 11.38 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.776 -0.824 . . . . 56.86 108.776 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' TYR . . . . . 0.418 ' CE1' ' C ' ' B' ' 28' ' ' GLY . 52.7 t80 -43.45 -53.35 5.5 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 122.184 0.992 . . . . 57.17 112.604 174.616 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' MET . . . . . . . . . . . . . 28.5 mtp -62.12 -47.05 86.3 Favored 'General case' 0 N--CA 1.426 -1.672 0 CA-C-N 114.86 -1.064 . . . . 58.04 108.629 -177.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -56.48 -48.27 77.48 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.787 -1.165 . . . . 68.73 112.821 175.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -54.68 -46.68 74.11 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 113.577 0.954 . . . . 66.73 113.577 -178.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -88.84 21.28 3.12 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 114.279 1.214 . . . . 60.61 114.279 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 57.03 34.36 24.8 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 113.637 0.977 . . . . 65.07 113.637 172.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HIS . . . . . . . . . . . . . 42.8 m170 -79.01 -33.87 44.55 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.304 -0.862 . . . . 58.84 108.692 171.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 12.3 mmt -62.76 138.08 58.43 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 114.95 -1.023 . . . . 62.48 111.752 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 5.7 m -117.81 -178.59 1.33 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.003 0 CA-C-N 114.529 -1.214 . . . . 65.42 109.101 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -56.06 113.61 4.19 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-N 116.268 -0.424 . . . . 68.85 112.072 169.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 106.17 -30.18 10.02 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 123.67 0.652 . . . . 69.23 112.343 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.68 -49.75 76.27 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 117.09 2.255 . . . . 69.34 117.09 -164.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . . . -63.4 -44.61 94.16 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.234 -0.654 . . . . 69.2 109.234 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -52.48 -60.66 2.96 Favored 'General case' 0 C--O 1.248 1.003 0 N-CA-C 109.021 -0.733 . . . . 72.23 109.021 172.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' ALA . . . . . . . . . . . . . . . -47.71 -50.42 25.15 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.448 -1.251 . . . . 65.73 114.128 -178.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' TRP . . . . . . . . . . . . . 35.2 m95 -62.87 -37.43 86.83 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 113.022 0.749 . . . . 62.46 113.022 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -59.45 -50.98 71.86 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 108.418 -0.956 . . . . 72.09 108.418 -178.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . 41.3 t -56.37 -54.03 33.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 108.629 -0.878 . . . . 61.17 108.629 176.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -44.79 -59.53 2.48 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 124.15 0.907 . . . . 60.42 110.952 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' VAL . . . . . . . . . . . . . 49.0 t -55.37 -48.0 77.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.933 -0.576 . . . . 61.91 112.166 178.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' GLY . . . . . . . . . . . . . . . -51.59 -48.18 50.13 Favored Glycine 0 N--CA 1.464 0.564 0 N-CA-C 108.369 -1.892 . . . . 64.37 108.369 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -58.76 -57.11 14.49 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.576 -0.812 . . . . 71.66 112.679 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 15.5 mt -43.56 -49.35 1.59 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 N-CA-C 108.314 -0.995 . . . . 68.21 108.314 175.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' CYS . . . . . . . . . . . . . 61.7 m -76.96 -32.14 57.07 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 115.141 1.534 . . . . 72.28 115.141 -173.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . . . -50.59 -58.77 5.05 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 106.568 -1.641 . . . . 73.25 106.568 166.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 2.2 m -50.55 -54.0 25.89 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 115.339 1.607 . . . . 75.63 115.339 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' LEU . . . . . 0.519 ' O ' ' CG ' ' B' ' 147' ' ' MET . 4.5 pp -79.69 -23.44 42.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.602 0.593 . . . . 79.92 112.602 -172.119 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' GLY . . . . . . . . . . . . . . . -68.68 -51.96 27.7 Favored Glycine 0 C--O 1.243 0.666 0 N-CA-C 107.451 -2.259 . . . . 82.14 107.451 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -59.28 -41.02 87.92 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 109.165 -0.68 . . . . 85.47 109.165 -178.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -65.03 -36.68 85.16 Favored 'General case' 0 C--O 1.201 -1.452 0 N-CA-C 113.686 0.995 . . . . 88.43 113.686 178.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' MET . . . . . 0.519 ' CG ' ' O ' ' B' ' 143' ' ' LEU . 70.2 mtp -71.66 5.35 2.51 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 122.017 0.913 . . . . 92.85 109.627 -171.625 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . . . -62.26 -11.55 15.58 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 104.333 -2.469 . . . . 96.17 104.333 176.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' GLU . . . . . 0.467 ' N ' ' C ' ' B' ' 147' ' ' MET . . . -58.23 138.7 56.1 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.289 -1.374 . . . . 98.52 107.289 175.466 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' LEU . . . . . 0.787 ' CD2' ' N ' ' B' ' 150' ' ' LEU . 0.0 OUTLIER -67.5 158.51 31.74 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 120.289 3.441 . . . . 100.08 120.289 -169.494 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' SER . . . . . 0.434 ' O ' ' O ' ' B' ' 150' ' ' LEU . . . . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.952 -0.567 . . . . 100.17 109.557 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 500' ' ' HEM . . . . . 0.576 ' CHC' ' CBB' ' A' ' 500' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 500' ' ' HEM . . . . . 0.591 ' CBB' ' CE1' ' B' ' 69' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' ACE . . . . . 0.568 ' H1 ' ' H ' ' A' ' 2' ' ' THR . . . . . . . . 0 C--O 1.225 -0.231 . . . . . . . . 47.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' THR . . . . . 0.412 ' HB ' HD12 ' A' ' 3' ' ' LEU . 45.7 p -53.33 -34.47 57.61 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 119.784 -1.822 . . . . 47.83 112.355 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . 0.568 ' H ' ' H1 ' ' A' ' 0' ' ' ACE . 4.2 p 71.28 2.04 4.09 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 125.094 1.358 . . . . 46.98 111.103 -174.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . 0.412 HD12 ' HB ' ' A' ' 1' ' ' THR . 15.6 mt -73.15 130.06 39.43 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 124.023 0.827 . . . . 45.87 111.582 178.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 57.5 p -77.65 166.8 22.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.339 -0.846 . . . . 47.02 109.183 176.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -57.92 -44.17 99.16 Favored Pre-proline 0 N--CA 1.468 0.457 0 N-CA-C 115.932 1.827 . . . . 54.26 115.932 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -54.67 -53.36 6.23 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 O-C-N 123.58 1.305 . . . . 47.62 109.61 171.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -53.14 -40.9 64.6 Favored 'General case' 0 C--O 1.242 0.699 0 O-C-N 123.684 0.615 . . . . 43.23 111.112 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.7 mttm -66.78 -46.41 75.39 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.325 -1.361 . . . . 40.84 107.325 -177.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.07 -48.09 83.17 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 120.016 -0.674 . . . . 38.48 111.68 176.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -40.74 -54.28 2.66 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 114.052 1.13 . . . . 39.33 114.052 172.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mt -63.54 -49.75 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 107.984 -1.117 . . . . 38.86 107.984 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.4 mtm-85 -48.02 -51.73 22.82 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 108.98 -0.748 . . . . 56.39 108.98 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . 0.59 ' O ' ' HB3' ' A' ' 16' ' ' SER . 10.0 t -64.66 -56.38 14.16 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 118.477 -1.289 . . . . 39.72 110.852 -177.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . 0.505 ' HG ' ' HE1' ' A' ' 132' ' ' TRP . 2.2 p -55.76 -38.45 69.85 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 123.804 0.69 . . . . 38.16 112.539 -175.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' TRP . . . . . 0.503 ' CZ2' ' HB2' ' A' ' 73' ' ' MET . 74.2 t-105 -67.41 -37.8 83.64 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 118.725 -1.19 . . . . 38.54 109.859 175.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' SER . . . . . 0.59 ' HB3' ' O ' ' A' ' 13' ' ' SER . 45.3 t -54.52 -32.21 57.68 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 115.979 -0.555 . . . . 42.55 109.507 179.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 18' ' ' PHE . 21.4 mttm -74.85 -59.01 2.93 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 115.13 -0.941 . . . . 53.09 109.985 178.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' PHE . . . . . 0.433 ' C ' ' O ' ' A' ' 17' ' ' LYS . 36.6 t80 -41.21 -39.92 1.45 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.849 -1.167 . . . . 43.46 107.849 173.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 15.4 mmm -75.43 -13.54 60.39 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 115.278 1.585 . . . . 47.11 115.278 -173.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . 0.767 ' C ' ' OD1' ' A' ' 21' ' ' ASN . 38.2 m-20 -62.27 -34.42 76.52 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 112.67 0.619 . . . . 51.01 112.67 176.389 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . 0.767 ' OD1' ' C ' ' A' ' 20' ' ' ASP . 2.1 m-20 -132.86 64.84 1.6 Allowed 'General case' 0 CA--C 1.48 -1.728 0 N-CA-C 104.075 -2.565 . . . . 54.98 104.075 172.386 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.9 -45.26 96.04 Favored Glycine 0 N--CA 1.42 -2.42 0 C-N-CA 119.727 -1.225 . . . . 51.97 115.697 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 10.3 t -67.3 -45.8 85.26 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.684 0 C-N-CA 115.583 -2.447 . . . . 52.8 113.58 -178.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 m -52.44 -56.71 13.23 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 118.896 -1.121 . . . . 56.74 108.767 177.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASN . . . . . 0.433 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 29.4 m120 -51.51 -46.96 63.42 Favored 'General case' 0 CA--C 1.506 -0.74 0 O-C-N 124.083 0.865 . . . . 53.9 112.676 178.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . 0.473 ' HA3' ' OG ' ' A' ' 66' ' ' SER . . . -48.37 -45.62 28.62 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 110.8 -0.92 . . . . 54.84 110.8 176.524 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLN . . . . . 0.543 ' HG2' ' HG3' ' A' ' 62' ' ' MET . 9.3 mt-30 -73.85 -45.53 50.53 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 119.178 -1.009 . . . . 62.96 109.344 -179.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -48.6 -39.71 23.61 Favored Glycine 0 CA--C 1.497 -1.065 0 N-CA-C 106.971 -2.451 . . . . 56.63 106.971 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -67.66 -53.35 28.56 Favored 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 123.757 0.328 . . . . 57.51 111.121 176.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -54.81 -51.89 64.39 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.538 -1.282 . . . . 67.23 107.538 176.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 79.7 mmm -48.69 -52.11 25.07 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 108.898 -0.778 . . . . 72.24 108.898 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.57 -43.11 79.66 Favored 'General case' 0 C--O 1.242 0.692 0 O-C-N 124.352 1.033 . . . . 63.44 110.836 178.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.5 tp -63.34 -60.07 3.87 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 113.161 0.8 . . . . 62.13 113.161 -176.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -56.85 -42.93 80.59 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 110.253 -0.277 . . . . 63.52 110.253 -176.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . . . -58.09 -48.88 78.83 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.115 0.885 . . . . 65.01 111.339 174.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.96 -51.4 47.97 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.667 0.617 . . . . 66.29 112.667 -176.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HIS . . . . . 0.449 ' HE1' HD11 ' A' ' 113' ' ' ILE . 2.5 m80 -126.24 90.74 49.41 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 108.515 -0.92 . . . . 70.52 108.515 178.066 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -44.52 -48.86 9.75 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.757 2.305 . . . . 69.47 114.844 -177.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . 0.638 ' N ' ' OE1' ' A' ' 39' ' ' GLU . 17.9 pm0 -46.33 -29.93 1.87 Allowed 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 115.954 1.835 . . . . 76.72 115.954 -170.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.885 ' O ' ' HD2' ' A' ' 43' ' ' PRO . 11.3 p -52.09 -48.25 64.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.161 -0.472 . . . . 71.54 112.117 -179.287 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 11.0 tp -42.65 -24.4 0.06 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.87 1.433 . . . . 72.77 114.87 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.5 m -53.93 -58.87 11.48 Favored Pre-proline 0 N--CA 1.476 0.874 0 N-CA-C 113.687 0.995 . . . . 71.59 113.687 -175.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PRO . . . . . 0.885 ' HD2' ' O ' ' A' ' 40' ' ' THR . 23.5 Cg_endo -65.94 -7.88 18.21 Favored 'Trans proline' 0 C--N 1.358 1.064 0 C-N-CA 117.413 -1.258 . . . . 70.47 114.277 -179.081 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -88.04 -10.31 50.66 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 113.978 1.103 . . . . 69.27 113.978 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . 0.505 ' O ' ' HA3' ' A' ' 49' ' ' GLY . 6.7 mmtp -50.17 -30.54 11.6 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.182 1.919 . . . . 69.71 116.182 -179.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 2.1 p -61.63 -39.26 90.66 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.245 -0.91 . . . . 68.27 111.279 175.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 49.7 tp -94.69 -58.13 2.27 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 114.776 -1.102 . . . . 65.18 109.305 -173.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -92.66 15.33 14.66 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 115.681 -0.69 . . . . 61.91 112.578 -175.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . 0.505 ' HA3' ' O ' ' A' ' 45' ' ' LYS . . . -79.25 -18.14 74.86 Favored Glycine 0 CA--C 1.503 -0.668 0 C-N-CA 120.282 -0.961 . . . . 58.74 114.268 -169.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.55 7.79 54.08 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.447 -1.061 . . . . 56.72 110.447 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.1 142.9 51.2 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.952 1.301 . . . . 55.24 111.345 -176.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . 0.426 ' O ' ' C ' ' A' ' 53' ' ' LEU . 30.6 p -101.11 152.59 20.44 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 106.845 -1.539 . . . . 56.25 106.845 177.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . 0.426 ' C ' ' O ' ' A' ' 52' ' ' THR . 0.6 OUTLIER -42.55 -47.29 5.13 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 119.425 -0.91 . . . . 61.02 113.288 -171.444 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -51.95 -33.83 39.36 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.16 0.505 . . . . 58.12 111.816 -174.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -89.77 -16.85 29.37 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 117.058 2.244 . . . . 59.59 117.058 -170.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . 0.615 ' O ' ' C ' ' A' ' 57' ' ' GLN . 25.5 mt -65.72 -42.1 91.5 Favored 'General case' 0 C--O 1.196 -1.715 0 O-C-N 124.769 1.293 . . . . 61.92 108.264 174.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . 0.615 ' C ' ' O ' ' A' ' 56' ' ' LEU . 51.4 tp60 -52.57 126.71 20.46 Favored 'General case' 0 N--CA 1.41 -2.433 0 N-CA-C 104.147 -2.538 . . . . 67.84 104.147 -173.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 61.45 20.74 11.44 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 114.823 1.416 . . . . 64.34 114.823 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -86.63 139.1 33.36 Favored Pre-proline 0 C--N 1.311 -1.104 0 N-CA-C 109.328 -0.619 . . . . 56.38 109.328 171.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -43.01 -51.71 5.31 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.62 1.546 . . . . 52.93 114.796 175.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HA ' HG11 ' B' ' 88' ' ' VAL . 43.6 mttp -56.69 -38.53 72.4 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.849 0.833 . . . . 50.43 110.37 179.663 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' MET . . . . . 0.543 ' HG3' ' HG2' ' A' ' 27' ' ' GLN . 1.2 tpt -75.64 -42.96 50.07 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 107.783 -1.191 . . . . 57.84 107.783 -174.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -60.96 -42.52 98.45 Favored 'General case' 0 C--O 1.241 0.644 0 O-C-N 124.251 0.969 . . . . 57.85 110.418 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.14 -69.08 0.12 Allowed 'General case' 0 N--CA 1.424 -1.74 0 N-CA-C 105.595 -2.002 . . . . 46.0 105.595 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLN . . . . . 0.435 ' O ' ' HB ' ' A' ' 68' ' ' VAL . 36.4 tp60 -41.39 -50.14 3.82 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 114.716 1.376 . . . . 52.62 114.716 -179.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . 0.473 ' OG ' ' HA3' ' A' ' 26' ' ' GLY . 2.1 t -61.63 -36.82 81.84 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.013 0.375 . . . . 42.59 112.013 -177.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . 0.414 HD21 ' HB2' ' B' ' 75' ' ' SER . 44.7 tp -67.94 -47.91 67.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.683 0.754 . . . . 39.82 110.664 178.667 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . 0.506 HG21 ' HE2' ' B' ' 92' ' ' LYS . 17.6 t -42.79 -63.43 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.988 0 CA-C-N 115.137 -0.938 . . . . 39.93 110.819 168.126 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -56.3 -38.56 71.42 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.5 -0.773 . . . . 41.35 109.512 -178.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.7 m -63.67 -39.93 95.57 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 113.203 0.816 . . . . 45.23 113.203 178.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . 0.403 ' O ' ' C ' ' A' ' 72' ' ' GLY . 90.6 m-20 -61.57 -56.48 19.53 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 109.126 -0.694 . . . . 47.95 109.126 173.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLY . . . . . 0.403 ' C ' ' O ' ' A' ' 71' ' ' ASN . . . -31.96 -68.02 0.15 Allowed Glycine 0 CA--C 1.511 -0.17 0 CA-C-N 114.996 -1.002 . . . . 43.47 112.73 174.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' MET . . . . . 0.503 ' HB2' ' CZ2' ' A' ' 15' ' ' TRP . 11.6 mmm -58.64 -48.76 79.94 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 113.756 1.021 . . . . 51.01 113.756 -178.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.8 m -51.93 -47.8 64.52 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 106.472 -1.677 . . . . 42.93 106.472 -174.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.2 p -54.68 -50.58 67.9 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.712 -0.676 . . . . 43.22 110.554 -177.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -52.77 -59.35 4.6 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.508 -0.553 . . . . 43.1 109.508 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 74.6 t -52.09 -38.06 23.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.924 -0.58 . . . . 43.16 112.158 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -72.49 -6.9 46.97 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 115.389 1.626 . . . . 51.75 115.389 -177.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -129.63 34.89 4.26 Favored 'General case' 0 CA--C 1.481 -1.694 0 N-CA-C 108.502 -0.925 . . . . 44.4 108.502 -172.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.5 mt -61.05 -33.06 72.71 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 113.921 -1.491 . . . . 40.86 108.895 171.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -98.49 7.59 45.96 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 114.524 1.305 . . . . 42.07 114.524 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASP . . . . . 1.019 ' OD2' ' HE3' ' A' ' 85' ' ' MET . 34.4 t0 -130.19 66.14 1.5 Allowed 'General case' 0 C--O 1.219 -0.501 0 O-C-N 124.265 0.978 . . . . 52.5 108.878 177.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . 0.698 ' O ' HG23 ' A' ' 87' ' ' VAL . 4.7 m-20 -57.71 -35.42 70.64 Favored 'General case' 0 N--CA 1.413 -2.318 0 C-N-CA 118.675 -1.21 . . . . 53.04 111.715 -176.978 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . 0.5 ' C ' ' O ' ' A' ' 83' ' ' ASN . 65.2 m-20 -56.43 -47.93 78.05 Favored 'General case' 0 N--CA 1.412 -2.328 0 C-N-CA 114.792 -2.763 . . . . 46.48 105.861 -173.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' MET . . . . . 1.019 ' HE3' ' OD2' ' A' ' 82' ' ' ASP . 8.2 ttm -69.17 -44.65 71.79 Favored 'General case' 0 C--O 1.18 -2.564 0 C-N-CA 119.413 -0.915 . . . . 56.87 109.442 179.42 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . 0.601 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 37.6 tp -49.54 -57.73 6.53 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.494 -0.882 . . . . 43.39 110.42 179.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . 0.698 HG23 ' O ' ' A' ' 83' ' ' ASN . 2.9 t -55.74 -40.98 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.847 0 C-N-CA 119.938 -0.705 . . . . 41.12 111.345 -176.459 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 91.6 t -58.38 -51.95 65.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 C-N-CA 119.26 -0.976 . . . . 42.57 109.817 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.34 -51.02 58.2 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.376 0.51 . . . . 43.72 112.376 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 84.8 mt -53.28 -57.13 5.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.266 0 N-CA-C 109.755 -0.461 . . . . 46.6 109.755 173.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -54.46 -47.26 73.14 Favored 'General case' 0 CA--C 1.5 -0.949 0 C-N-CA 120.71 -0.396 . . . . 58.82 110.232 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -52.48 -53.24 48.39 Favored 'General case' 0 CA--C 1.519 -0.242 0 O-C-N 124.856 1.347 . . . . 54.98 110.051 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' MET . . . . . 0.534 ' HG2' ' CE1' ' A' ' 97' ' ' HIS . 1.6 ttp -51.62 -53.69 35.77 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.869 -1.059 . . . . 62.44 109.924 170.092 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . 0.611 ' HB2' HD23 ' A' ' 143' ' ' LEU . . . -52.47 -38.3 59.06 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 114.532 1.308 . . . . 59.57 114.532 -176.401 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -58.58 -45.49 88.93 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 122.825 0.45 . . . . 67.39 111.558 176.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . 0.509 HD13 ' CBA' ' A' ' 500' ' ' HEM . 2.7 mt -72.52 -49.56 32.0 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.283 -0.567 . . . . 67.33 110.031 -172.655 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HIS . . . . . 0.534 ' CE1' ' HG2' ' A' ' 93' ' ' MET . 66.1 m80 -62.83 -18.85 63.43 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 120.349 -0.54 . . . . 68.15 111.037 177.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 94' ' ' ALA . 50.8 t30 -71.64 -48.91 44.7 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 120.393 -0.523 . . . . 72.56 112.053 177.613 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -54.9 -19.53 6.82 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 124.139 0.899 . . . . 73.98 112.925 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ARG . . . . . 0.566 ' HB2' HD12 ' A' ' 102' ' ' ILE . 7.5 mtp85 -103.45 10.01 37.44 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.34 0.591 . . . . 87.0 109.803 -179.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 73.96 6.87 74.64 Favored Glycine 0 C--O 1.239 0.452 0 N-CA-C 115.423 0.929 . . . . 75.47 115.423 172.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ILE . . . . . 0.566 HD12 ' HB2' ' A' ' 100' ' ' ARG . 2.8 mp -62.57 134.58 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 107.819 -1.178 . . . . 76.77 107.819 176.271 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . 0.573 ' O ' ' HB2' ' A' ' 106' ' ' ASP . . . -86.02 157.36 20.11 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 110.36 -0.237 . . . . 76.73 110.36 178.505 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.72 -38.71 85.97 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 112.377 0.51 . . . . 77.21 112.377 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 89.7 p -79.61 -9.09 59.57 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.92 -0.582 . . . . 77.76 111.417 176.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASP . . . . . 0.573 ' HB2' ' O ' ' A' ' 103' ' ' ARG . 2.4 m-20 -76.04 -21.4 56.86 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.382 -0.826 . . . . 78.97 109.877 168.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 11.7 mt -97.71 -35.97 10.39 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 109.159 -0.682 . . . . 73.84 109.159 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ARG . . . . . 0.422 ' HA ' ' SG ' ' A' ' 140' ' ' CYS . 29.8 tpt85 -45.72 -53.45 9.4 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.828 -0.804 . . . . 79.92 108.828 171.87 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 39.0 p -69.19 -34.04 74.28 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 119.677 -0.809 . . . . 68.96 111.28 -177.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . 0.412 ' CB ' HMC2 ' A' ' 500' ' ' HEM . . . -53.78 -42.29 68.14 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.192 0.441 . . . . 63.8 112.192 173.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TYR . . . . . 0.409 ' CZ ' ' HAB' ' A' ' 500' ' ' HEM . 40.3 m-85 -72.52 -33.32 66.81 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 112.73 0.641 . . . . 61.65 112.73 174.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -60.47 -41.78 94.88 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 107.219 -1.4 . . . . 65.04 107.219 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ILE . . . . . 0.449 HD11 ' HE1' ' A' ' 37' ' ' HIS . 32.0 mm -68.61 -31.49 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-N 116.225 -0.443 . . . . 59.52 110.503 179.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.3 tp -70.72 -44.32 67.12 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 120.362 -0.535 . . . . 56.22 110.579 -178.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 59.1 mt -60.19 -49.56 83.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 108.114 -1.069 . . . . 57.32 108.114 177.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -60.03 -48.79 80.26 Favored 'General case' 0 CA--C 1.504 -0.815 0 C-N-CA 119.803 -0.759 . . . . 66.2 110.21 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -48.19 -53.74 15.87 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 123.691 0.619 . . . . 57.23 112.389 172.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 93.5 mtp -63.3 -36.0 82.24 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.629 0.974 . . . . 57.21 113.629 -179.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -63.74 -51.27 65.66 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 107.937 -1.134 . . . . 64.21 107.937 175.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -55.13 -31.52 61.35 Favored 'General case' 0 CA--C 1.489 -1.402 0 O-C-N 124.103 0.877 . . . . 66.07 111.885 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -100.73 14.09 32.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 124.164 0.915 . . . . 59.24 113.288 -177.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 54.29 53.13 11.37 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 122.033 0.92 . . . . 59.94 111.495 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -99.46 -33.43 10.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.115 -1.068 . . . . 57.68 108.115 173.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 5.8 mmt -55.96 112.99 1.33 Allowed 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.736 -0.666 . . . . 54.47 109.744 172.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 18.0 m -77.57 -177.97 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 N-CA-C 106.138 -1.801 . . . . 52.76 106.138 165.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -46.37 129.45 10.93 Favored Glycine 0 C--O 1.223 -0.581 0 N-CA-C 109.621 -1.392 . . . . 50.67 109.621 177.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 52.81 24.44 19.15 Favored Glycine 0 N--CA 1.47 0.945 0 N-CA-C 119.647 2.619 . . . . 48.23 119.647 173.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -83.25 -27.94 29.53 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.602 0.593 . . . . 45.54 112.602 168.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . . . -59.63 -37.84 79.72 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 118.274 -1.37 . . . . 45.73 109.815 175.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASP . . . . . 0.41 ' O ' HG23 ' A' ' 134' ' ' VAL . 3.6 m-20 -67.07 -49.73 64.11 Favored 'General case' 0 CA--C 1.509 -0.633 0 O-C-N 123.941 0.776 . . . . 50.99 110.404 178.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -56.05 -54.77 40.93 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.414 -1.328 . . . . 43.52 107.414 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' TRP . . . . . 0.505 ' HE1' ' HG ' ' A' ' 14' ' ' SER . 35.1 m95 -55.9 -44.01 77.82 Favored 'General case' 0 CA--C 1.497 -1.072 0 C-N-CA 120.351 -0.54 . . . . 41.45 110.868 -177.384 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -46.1 -62.93 1.12 Allowed 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 123.648 0.592 . . . . 53.74 110.036 175.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 130' ' ' ASP . 48.1 t -56.58 -52.26 55.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-N 115.382 -0.826 . . . . 39.76 111.004 177.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' PHE . . . . . 0.445 ' O ' ' HB3' ' A' ' 138' ' ' PHE . 5.9 t80 -44.26 -60.08 2.08 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.08 -0.964 . . . . 40.89 109.943 177.152 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 2.8 m -67.46 -22.35 28.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 119.288 -0.965 . . . . 39.99 112.122 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -54.39 -65.15 3.69 Favored Glycine 0 CA--C 1.503 -0.689 1 N-CA-C 102.95 -4.06 . . . . 41.84 102.95 173.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' PHE . . . . . 0.445 ' HB3' ' O ' ' A' ' 135' ' ' PHE . 87.2 t80 -45.0 -54.58 6.41 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 113.003 -1.599 . . . . 46.67 114.176 178.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 6.9 mt -52.03 -43.52 37.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.705 0.764 . . . . 45.99 111.76 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' CYS . . . . . 0.545 ' HA ' HD12 ' A' ' 143' ' ' LEU . 88.8 m -74.12 -39.77 63.11 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 119.948 -0.701 . . . . 53.03 111.846 -175.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . . . -55.54 -54.37 44.85 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 108.15 -1.055 . . . . 55.29 108.15 172.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 91.4 m -53.45 -40.73 65.46 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-N 116.349 -0.387 . . . . 60.34 110.404 179.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' LEU . . . . . 0.611 HD23 ' HB2' ' A' ' 94' ' ' ALA . 23.7 mt -63.62 -62.91 1.36 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.405 -1.331 . . . . 64.88 107.405 174.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -36.99 -67.37 0.43 Allowed Glycine 0 N--CA 1.475 1.267 0 C-N-CA 124.292 0.949 . . . . 69.57 111.583 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -49.5 -37.69 27.5 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.585 0.957 . . . . 74.1 113.585 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' TYR . . . . . 0.414 ' O ' ' HB3' ' A' ' 149' ' ' GLU . 76.0 t80 -81.19 -43.13 19.75 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.44 0.904 . . . . 80.42 113.44 -176.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 94.8 mtp -74.3 -33.63 63.27 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.788 -0.57 . . . . 83.43 109.989 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . . . -63.72 -19.85 65.27 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 120.496 -0.482 . . . . 87.16 109.885 168.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' GLU . . . . . 0.414 ' HB3' ' O ' ' A' ' 146' ' ' TYR . 1.9 tp10 -81.7 2.6 28.98 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 122.403 0.281 . . . . 96.01 111.114 173.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.46 173.23 10.75 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 112.423 0.527 . . . . 93.51 112.423 177.006 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.36 0 N-CA-C 113.573 0.953 . . . . 94.64 113.573 -177.856 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 . . . . . . . . 82.32 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' THR . . . . . . . . . . . . . 16.4 p -46.87 151.62 0.59 Allowed 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.954 0.902 . . . . 81.39 110.006 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 10.3 t 55.61 20.64 3.99 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 125.196 1.398 . . . . 78.3 114.676 173.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 15.5 tp -128.48 118.73 23.58 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.936 -1.505 . . . . 74.21 106.936 -169.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' THR . . . . . 0.476 ' O ' ' HG3' ' B' ' 8' ' ' LYS . 1.1 p -76.67 177.47 7.51 Favored 'General case' 0 C--O 1.221 -0.407 0 O-C-N 124.057 0.848 . . . . 71.68 111.69 -173.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -99.73 -16.21 0.19 Allowed Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 117.011 2.226 . . . . 74.49 117.011 -168.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -84.38 -18.42 4.93 Favored 'Trans proline' 0 CA--C 1.545 1.037 1 C-N-CA 110.676 -5.749 . . . . 67.9 109.419 158.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -67.99 -37.27 81.27 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 122.234 1.016 . . . . 67.1 110.084 173.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' B' ' 4' ' ' THR . 60.7 mttt -70.61 -37.94 73.9 Favored 'General case' 0 N--CA 1.439 -1.024 0 CA-C-N 115.012 -0.994 . . . . 61.93 109.103 177.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.83 -42.33 97.64 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.117 0.484 . . . . 56.3 110.024 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.63 -47.59 66.95 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 114.859 -1.064 . . . . 53.2 112.246 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -57.99 -63.78 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 O-C-N 123.776 0.673 . . . . 49.89 110.472 172.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 41.6 mtt85 -43.08 -50.29 6.12 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 119.959 -0.696 . . . . 59.79 112.045 175.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 9.8 m -47.09 -53.31 13.05 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.072 0.939 . . . . 51.84 112.484 175.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 89.1 p -77.17 -35.61 55.8 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 113.29 -1.777 . . . . 45.26 107.483 -168.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' TRP . . . . . 0.473 ' CZ2' ' HB3' ' B' ' 73' ' ' MET . 67.0 t-105 -72.49 -31.76 65.65 Favored 'General case' 0 N--CA 1.44 -0.953 0 C-N-CA 119.434 -0.906 . . . . 42.62 110.448 -178.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 2.0 t -51.66 -51.86 52.48 Favored 'General case' 0 C--O 1.216 -0.705 0 C-N-CA 120.386 -0.525 . . . . 43.61 111.728 170.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 11.7 mtpt -61.85 -43.89 97.94 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 108.877 -0.786 . . . . 55.45 108.877 -177.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' PHE . . . . . 0.471 ' CE1' ' HB3' ' B' ' 25' ' ' ASN . 29.3 t80 -52.74 -44.76 66.66 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 107.817 -1.179 . . . . 42.53 107.817 177.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' MET . . . . . 0.431 ' C ' ' N ' ' B' ' 21' ' ' ASN . 15.8 mmt -77.28 -34.39 55.65 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 113.47 0.915 . . . . 46.29 113.47 -172.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -39.26 -28.23 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.511 0.672 . . . . 45.18 109.305 171.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ASN . . . . . 0.431 ' N ' ' C ' ' B' ' 19' ' ' MET . 7.1 m-80 -124.63 -12.41 7.17 Favored 'General case' 0 C--O 1.189 -2.095 0 N-CA-C 113.898 1.073 . . . . 41.86 113.898 179.275 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 51.61 -118.32 6.86 Favored Glycine 0 C--O 1.182 -3.098 0 N-CA-C 120.701 3.04 . . . . 43.87 120.701 163.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' VAL . . . . . 0.66 ' O ' ' C ' ' B' ' 24' ' ' SER 0.256 26.2 t -57.18 -45.83 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.544 0 CA-C-N 114.648 -0.776 . . . . 44.06 110.351 -174.144 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 24' ' ' SER . . . . . 0.66 ' C ' ' O ' ' B' ' 23' ' ' VAL . 35.9 t -38.39 -57.18 1.16 Allowed 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 117.36 -1.736 . . . . 45.16 107.941 170.401 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ASN . . . . . 0.471 ' HB3' ' CE1' ' B' ' 18' ' ' PHE . 80.7 m-20 -68.04 -26.39 65.84 Favored 'General case' 0 C--O 1.214 -0.814 0 N-CA-C 115.509 1.67 . . . . 48.3 115.509 -177.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.7 -45.04 91.19 Favored Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 106.548 -2.621 . . . . 46.15 106.548 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' B' ' 31' ' ' MET . 30.5 mt-30 -61.19 -50.62 72.38 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 109.181 -0.674 . . . . 56.15 109.181 174.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' GLY . . . . . 0.441 ' HA3' ' CE1' ' B' ' 117' ' ' TYR . . . -43.62 -57.76 4.39 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 111.138 -0.785 . . . . 46.08 111.138 175.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' PHE . . . . . 0.462 ' O ' ' C ' ' B' ' 30' ' ' TYR . 42.5 t80 -53.93 -57.31 11.46 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 122.534 -0.391 . . . . 46.9 110.271 174.857 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' TYR . . . . . 0.462 ' C ' ' O ' ' B' ' 29' ' ' PHE . 2.5 m-85 -55.69 -39.79 71.46 Favored 'General case' 0 N--CA 1.42 -1.934 0 C-N-CA 117.508 -1.677 . . . . 51.68 108.486 -174.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 4.9 mmt -60.93 -47.07 88.11 Favored 'General case' 0 C--O 1.198 -1.655 0 C-N-CA 116.36 -2.136 . . . . 60.64 111.503 -179.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -60.43 -38.08 82.96 Favored 'General case' 0 CA--C 1.46 -2.485 0 N-CA-C 106.175 -1.787 . . . . 61.25 106.175 -175.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 63.9 tp -62.52 -54.95 32.22 Favored 'General case' 0 C--N 1.298 -1.668 0 C-N-CA 117.932 -1.507 . . . . 61.56 111.007 -178.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -58.81 -24.77 62.42 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.153 0.501 . . . . 65.61 111.871 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -78.81 -66.13 0.9 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.301 -1.37 . . . . 79.92 107.301 178.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.46 -46.39 76.81 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 113.68 0.993 . . . . 66.8 113.68 179.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -135.8 87.75 24.67 Favored Pre-proline 0 C--O 1.218 -0.561 0 C-N-CA 119.619 -0.833 . . . . 70.21 111.104 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -60.54 -27.95 85.77 Favored 'Trans proline' 0 C--N 1.345 0.392 1 C-N-CA 126.144 4.563 . . . . 67.98 115.076 -172.672 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . . . -50.24 -27.04 5.36 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.564 1.146 . . . . 70.51 111.408 176.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 43.6 p -67.44 -20.76 65.54 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 114.496 1.295 . . . . 71.41 114.496 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' LEU . . . . . 0.422 ' O ' HD23 ' B' ' 41' ' ' LEU . 3.0 tt -73.23 -19.4 61.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.933 0.397 . . . . 74.01 110.865 178.423 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 45.5 m -57.74 -50.68 86.75 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 114.336 1.236 . . . . 74.91 114.336 -171.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' PRO . . . . . 0.463 ' HG3' HBC1 ' B' ' 500' ' ' HEM . 48.3 Cg_endo -70.26 -21.02 31.73 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 118.038 -0.841 . . . . 75.38 111.872 -176.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' PHE . . . . . 0.49 ' O ' ' C ' ' B' ' 45' ' ' LYS . 48.3 m-85 -75.3 -20.57 59.03 Favored 'General case' 0 CA--C 1.514 -0.416 0 O-C-N 124.091 0.869 . . . . 76.92 112.991 177.175 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LYS . . . . . 0.49 ' C ' ' O ' ' B' ' 44' ' ' PHE . . . -30.43 -52.95 0.17 Allowed 'General case' 0 CA--C 1.543 0.698 0 O-C-N 123.066 0.229 . . . . 79.19 110.66 -179.626 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 8.9 p -70.09 -23.14 63.01 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 117.115 2.265 . . . . 80.79 117.115 -172.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' LEU . . . . . . . . . . . . . 37.9 tp -76.78 -51.68 10.93 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 119.577 -0.849 . . . . 81.05 110.221 171.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -80.11 27.65 0.31 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.769 1.026 . . . . 81.21 113.769 -176.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -69.04 131.52 25.4 Favored Glycine 0 N--CA 1.478 1.453 0 N-CA-C 114.731 0.653 . . . . 82.54 114.731 -171.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 61.09 37.17 93.47 Favored Glycine 0 N--CA 1.47 0.933 0 N-CA-C 110.858 -0.897 . . . . 82.2 110.858 -169.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 9.6 tp -142.01 118.55 10.96 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.203 0.525 . . . . 81.16 110.535 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' THR . . . . . 0.955 HG22 ' HG2' ' B' ' 55' ' ' GLN . 2.4 t -73.99 154.42 39.3 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.446 -0.797 . . . . 80.61 111.325 -178.985 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' LEU . . . . . 0.566 ' H ' HD12 ' B' ' 53' ' ' LEU . 3.5 mp -60.16 -32.01 70.65 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.001 -0.999 . . . . 77.46 112.362 179.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.33 -39.53 85.84 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 115.842 -0.617 . . . . 75.09 110.804 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLN . . . . . 0.955 ' HG2' HG22 ' B' ' 52' ' ' THR . 2.9 pt20 -87.15 0.59 55.07 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 113.154 0.798 . . . . 72.64 113.154 -176.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' B' ' 53' ' ' LEU . 19.7 mt -60.04 -51.22 70.58 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.271 1.028 . . . . 70.22 113.528 174.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -59.18 124.53 20.29 Favored 'General case' 0 CA--C 1.507 -0.673 0 CA-C-O 121.501 0.667 . . . . 78.76 111.646 -175.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 67.63 -2.28 1.39 Allowed 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 113.167 -1.833 . . . . 68.99 113.599 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -64.82 137.78 97.26 Favored Pre-proline 0 N--CA 1.439 -1.021 0 N-CA-C 106.537 -1.653 . . . . 63.16 106.537 170.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -48.43 -51.49 10.13 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 121.581 1.521 . . . . 57.99 111.648 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 26.4 mttt -51.7 -28.7 15.64 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 119.484 -0.886 . . . . 61.81 112.915 -177.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' MET . . . . . . . . . . . . . 12.6 tpt -83.45 -52.02 6.87 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 110.388 -0.227 . . . . 60.5 110.388 174.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 33.0 mtpt -47.75 -50.65 24.81 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.944 -0.391 . . . . 51.62 109.944 174.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.59 -64.89 0.68 Allowed 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.921 0.391 . . . . 46.29 111.99 176.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -46.54 -44.78 18.18 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 112.443 0.535 . . . . 46.5 112.443 176.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 4.9 t -58.42 -45.39 88.55 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.729 -0.471 . . . . 41.27 109.729 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 36.4 tp -56.25 -55.06 37.87 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-N 115.67 -0.695 . . . . 39.34 110.925 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 66.3 t -45.12 -58.44 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 115.53 -0.759 . . . . 36.71 109.096 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' PHE . . . . . 1.084 ' HE1' HBB2 ' B' ' 500' ' ' HEM . 43.7 t80 -49.35 -52.05 30.63 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 113.285 0.846 . . . . 36.93 113.285 179.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' CYS . . . . . 0.428 ' HB3' ' HE3' ' B' ' 19' ' ' MET . 95.4 m -44.6 -56.88 4.0 Favored 'General case' 0 CA--C 1.521 -0.151 0 O-C-N 123.334 0.396 . . . . 37.85 111.57 173.682 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -50.61 -58.85 4.85 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-O 119.396 -0.335 . . . . 41.13 110.659 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . -42.74 -62.68 2.17 Favored Glycine 0 CA--C 1.522 0.478 0 N-CA-C 111.94 -0.464 . . . . 39.91 111.94 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' MET . . . . . 0.473 ' HB3' ' CZ2' ' B' ' 15' ' ' TRP . 18.6 mmm -52.01 -54.05 34.52 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 113.8 1.037 . . . . 46.39 113.8 177.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 5.6 m -53.12 -51.85 60.59 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 107.906 -1.146 . . . . 42.72 107.906 177.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' SER . . . . . 0.414 ' HB2' HD21 ' A' ' 67' ' ' LEU . 38.6 p -55.32 -14.81 2.02 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.649 -0.705 . . . . 43.94 111.907 -176.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 17.8 m-30 -91.03 -49.65 6.3 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 108.187 -1.042 . . . . 45.8 108.187 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 13.9 t -58.86 -29.19 39.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.019 -0.991 . . . . 50.23 112.161 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -83.48 -29.77 27.72 Favored 'General case' 0 N--CA 1.442 -0.866 0 C-N-CA 119.226 -0.99 . . . . 55.82 109.782 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 -97.14 25.22 5.63 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 122.055 0.931 . . . . 60.74 111.77 -177.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 32.1 mt -58.37 -30.67 66.96 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-N 114.17 -1.377 . . . . 59.49 111.013 172.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -94.2 -39.01 10.77 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.53 0.937 . . . . 65.05 113.53 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -75.28 45.77 0.3 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.015 0.526 . . . . 72.36 111.977 -178.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ASN . . . . . 0.423 ' C ' HD21 ' B' ' 83' ' ' ASN . 0.3 OUTLIER -41.98 -47.25 4.34 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 121.057 3.725 . . . . 69.66 121.057 -162.332 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ASP . . . . . 0.411 ' O ' HG23 ' B' ' 88' ' ' VAL . 3.5 t70 -56.69 -29.42 62.36 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.364 -0.976 . . . . 72.4 108.364 -175.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' MET . . . . . . . . . . . . . 16.8 ttt -82.68 -42.86 17.59 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 114.935 -1.03 . . . . 64.27 110.578 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LEU . . . . . 0.434 ' HA ' HD12 ' B' ' 89' ' ' LEU . 14.8 tp -40.42 -60.16 1.16 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 109.248 -0.649 . . . . 57.37 109.248 169.718 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 71.6 t -44.6 -42.6 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 N-CA-C 114.504 1.298 . . . . 53.08 114.504 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' VAL . . . . . 0.457 HG11 ' HA ' ' A' ' 61' ' ' LYS . 2.4 t -73.9 -43.78 52.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 116.434 -0.348 . . . . 51.98 110.603 -173.317 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' B' ' 86' ' ' LEU . 14.2 mt -55.5 -46.35 76.95 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 107.457 -1.312 . . . . 51.48 107.457 176.454 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ILE . . . . . 0.429 HG21 ' HB ' ' B' ' 142' ' ' THR . 91.1 mt -59.25 -50.5 79.59 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.728 0 N-CA-C 107.768 -1.197 . . . . 52.61 107.768 177.104 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -58.0 -42.24 84.74 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.235 -0.986 . . . . 63.24 112.407 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' LYS . . . . . 0.506 ' HE2' HG21 ' A' ' 68' ' ' VAL . 25.2 mtpp -57.3 -48.02 80.0 Favored 'General case' 0 CA--C 1.504 -0.803 0 N-CA-C 109.845 -0.428 . . . . 63.76 109.845 174.744 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' MET . . . . . 0.581 ' HG3' ' HD1' ' B' ' 97' ' ' HIS . 3.2 ttp -58.21 -53.31 59.75 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 120.056 -0.658 . . . . 63.08 110.353 178.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.11 -45.23 64.8 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.838 -0.619 . . . . 66.93 112.614 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 33.2 tttt -58.13 -47.81 82.16 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 120.362 -0.535 . . . . 76.67 111.793 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LEU . . . . . 0.549 HD12 ' CBA' ' B' ' 500' ' ' HEM . 10.1 mt -62.63 -51.55 66.86 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 120.711 0.291 . . . . 75.49 110.436 -176.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' HIS . . . . . 0.581 ' HD1' ' HG3' ' B' ' 93' ' ' MET . 45.2 m80 -65.63 -15.29 62.61 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.707 -0.679 . . . . 76.51 112.824 179.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 22.0 t30 -73.66 -50.68 19.78 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.886 -0.508 . . . . 81.79 111.362 170.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -51.16 -52.57 42.86 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.672 -0.862 . . . . 85.2 108.672 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . . . -68.42 14.73 0.06 Allowed 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 114.359 1.244 . . . . 81.99 114.359 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 66.74 44.1 90.22 Favored Glycine 0 N--CA 1.467 0.737 0 N-CA-C 117.431 1.733 . . . . 81.29 117.431 171.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ILE . . . . . 0.58 HG12 ' CBC' ' B' ' 500' ' ' HEM . 2.7 mp -113.09 153.71 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 122.766 0.427 . . . . 80.35 111.838 -178.204 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ARG . . . . . 0.406 ' O ' ' HB2' ' B' ' 106' ' ' ASP . 4.6 mtt85 -107.41 153.72 22.37 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.8 0.334 . . . . 83.27 110.158 176.802 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.16 -34.28 56.18 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.461 0.912 . . . . 78.0 113.461 175.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 76.5 p -78.5 -25.79 45.74 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.987 -0.552 . . . . 75.66 111.708 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' B' ' 103' ' ' ARG . 27.5 m-20 -58.31 -43.21 88.02 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 106.973 -1.492 . . . . 73.15 106.973 169.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 8.0 mt -77.65 -41.29 38.81 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 119.762 -0.775 . . . . 68.9 112.119 -177.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ARG . . . . . 0.466 ' NH1' ' OD1' ' B' ' 112' ' ' ASP . 12.1 tpt85 -53.51 -37.69 63.01 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.153 0.433 . . . . 66.69 110.969 -179.112 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 75.0 p -79.04 -32.1 44.83 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.336 -0.847 . . . . 66.16 110.88 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.6 -28.91 70.22 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 121.156 0.503 . . . . 64.73 110.647 177.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' TYR . . . . . 0.535 ' O ' HD12 ' B' ' 115' ' ' ILE . 73.7 m-85 -76.84 -41.25 44.87 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.917 -0.713 . . . . 69.35 111.709 174.732 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' ASP . . . . . 0.466 ' OD1' ' NH1' ' B' ' 108' ' ' ARG . 93.6 m-20 -54.83 -38.94 68.04 Favored 'General case' 0 CA--C 1.502 -0.904 0 N-CA-C 109.944 -0.391 . . . . 66.25 109.944 178.151 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 1.1 mp -67.85 -40.63 83.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 107.362 -1.347 . . . . 59.88 107.362 177.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LEU . . . . . 0.788 ' O ' ' HG3' ' B' ' 118' ' ' MET . 45.8 tp -54.64 -48.88 71.73 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 123.918 0.761 . . . . 56.95 109.226 176.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ILE . . . . . 0.659 HD11 HG21 ' B' ' 136' ' ' VAL . 2.4 mp -61.1 -47.49 93.31 Favored 'Isoleucine or valine' 0 C--O 1.245 0.828 0 N-CA-C 111.98 0.363 . . . . 56.05 111.98 178.589 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -56.33 -57.64 11.38 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.776 -0.824 . . . . 60.19 108.776 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' TYR . . . . . 0.441 ' CE1' ' HA3' ' B' ' 28' ' ' GLY . 52.7 t80 -43.45 -53.35 5.5 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 122.184 0.992 . . . . 57.17 112.604 174.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' MET . . . . . 0.788 ' HG3' ' O ' ' B' ' 114' ' ' LEU . 28.5 mtp -62.12 -47.05 86.3 Favored 'General case' 0 N--CA 1.426 -1.672 0 CA-C-N 114.86 -1.064 . . . . 58.04 108.629 -177.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -56.48 -48.27 77.48 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.787 -1.165 . . . . 68.73 112.821 175.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -54.68 -46.68 74.11 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 113.577 0.954 . . . . 66.73 113.577 -178.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -88.84 21.28 3.12 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 114.279 1.214 . . . . 60.61 114.279 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 57.03 34.36 24.8 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 113.637 0.977 . . . . 65.07 113.637 172.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HIS . . . . . . . . . . . . . 42.8 m170 -79.01 -33.87 44.55 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.304 -0.862 . . . . 58.84 108.692 171.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 12.3 mmt -62.76 138.08 58.43 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 114.95 -1.023 . . . . 62.48 111.752 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' VAL . . . . . 0.431 HG22 ' HB2' ' B' ' 128' ' ' ALA . 5.7 m -117.81 -178.59 1.33 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.003 0 CA-C-N 114.529 -1.214 . . . . 65.42 109.101 177.059 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -56.06 113.61 4.19 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-N 116.268 -0.424 . . . . 68.85 112.072 169.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 106.17 -30.18 10.02 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 123.67 0.652 . . . . 69.23 112.343 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ALA . . . . . 0.431 ' HB2' HG22 ' B' ' 125' ' ' VAL . . . -60.68 -49.75 76.27 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 117.09 2.255 . . . . 69.34 117.09 -164.535 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . . . -63.4 -44.61 94.16 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.234 -0.654 . . . . 69.2 109.234 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -52.48 -60.66 2.96 Favored 'General case' 0 C--O 1.248 1.003 0 N-CA-C 109.021 -0.733 . . . . 72.23 109.021 172.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' ALA . . . . . . . . . . . . . . . -47.71 -50.42 25.15 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.448 -1.251 . . . . 65.73 114.128 -178.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' TRP . . . . . . . . . . . . . 35.2 m95 -62.87 -37.43 86.83 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 113.022 0.749 . . . . 62.46 113.022 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -59.45 -50.98 71.86 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 108.418 -0.956 . . . . 72.09 108.418 -178.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . 41.3 t -56.37 -54.03 33.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 108.629 -0.878 . . . . 61.17 108.629 176.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -44.79 -59.53 2.48 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 124.15 0.907 . . . . 60.42 110.952 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' VAL . . . . . 0.659 HG21 HD11 ' B' ' 115' ' ' ILE . 49.0 t -55.37 -48.0 77.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.933 -0.576 . . . . 61.91 112.166 178.447 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 137' ' ' GLY . . . . . . . . . . . . . . . -51.59 -48.18 50.13 Favored Glycine 0 N--CA 1.464 0.564 0 N-CA-C 108.369 -1.892 . . . . 64.37 108.369 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -58.76 -57.11 14.49 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.576 -0.812 . . . . 71.66 112.679 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 15.5 mt -43.56 -49.35 1.59 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 N-CA-C 108.314 -0.995 . . . . 68.21 108.314 175.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' CYS . . . . . . . . . . . . . 61.7 m -76.96 -32.14 57.07 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 115.141 1.534 . . . . 72.28 115.141 -173.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . . . -50.59 -58.77 5.05 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 106.568 -1.641 . . . . 73.25 106.568 166.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' THR . . . . . 0.429 ' HB ' HG21 ' B' ' 90' ' ' ILE . 2.2 m -50.55 -54.0 25.89 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 115.339 1.607 . . . . 75.63 115.339 -176.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 143' ' ' LEU . . . . . 0.977 ' O ' ' HG3' ' B' ' 147' ' ' MET . 4.5 pp -79.69 -23.44 42.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.602 0.593 . . . . 79.92 112.602 -172.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 144' ' ' GLY . . . . . 0.459 ' N ' HD12 ' B' ' 143' ' ' LEU . . . -68.68 -51.96 27.7 Favored Glycine 0 C--O 1.243 0.666 0 N-CA-C 107.451 -2.259 . . . . 82.14 107.451 176.066 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 145' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -59.28 -41.02 87.92 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 109.165 -0.68 . . . . 85.47 109.165 -178.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' TYR . . . . . 0.472 ' C ' ' H ' ' B' ' 148' ' ' LYS . 20.0 t80 -65.03 -36.68 85.16 Favored 'General case' 0 C--O 1.201 -1.452 0 N-CA-C 113.686 0.995 . . . . 88.43 113.686 178.774 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 147' ' ' MET . . . . . 0.977 ' HG3' ' O ' ' B' ' 143' ' ' LEU . 70.2 mtp -71.66 5.35 2.51 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 122.017 0.913 . . . . 92.85 109.627 -171.625 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 148' ' ' LYS . . . . . 0.472 ' H ' ' C ' ' B' ' 146' ' ' TYR . . . -62.26 -11.55 15.58 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 104.333 -2.469 . . . . 96.17 104.333 176.464 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 149' ' ' GLU . . . . . 0.467 ' N ' ' C ' ' B' ' 147' ' ' MET . . . -58.23 138.7 56.1 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.289 -1.374 . . . . 98.52 107.289 175.466 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 150' ' ' LEU . . . . . 1.053 ' N ' HD23 ' B' ' 150' ' ' LEU . 0.0 OUTLIER -67.5 158.51 31.74 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 120.289 3.441 . . . . 100.08 120.289 -169.494 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 151' ' ' SER . . . . . 0.434 ' O ' ' O ' ' B' ' 150' ' ' LEU . . . . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.952 -0.567 . . . . 100.17 109.557 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 500' ' ' HEM . . . . . 1.173 HBB2 ' HHC' ' A' ' 500' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 500' ' ' HEM . . . . . 1.084 HBB2 ' HE1' ' B' ' 69' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.568 ' H1 ' ' H ' ' A' ' 2' ' ' THR . . . . . . . . 0 C--O 1.225 -0.231 . . . . . . . . 47.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' THR . . . . . 0.412 ' HB ' HD12 ' A' ' 3' ' ' LEU . 45.7 p -53.33 -34.47 57.61 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 119.784 -1.822 . . . . 47.83 112.355 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . 0.568 ' H ' ' H1 ' ' A' ' 0' ' ' ACE . 4.2 p 71.28 2.04 4.09 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 125.094 1.358 . . . . 46.98 111.103 -174.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.412 HD12 ' HB ' ' A' ' 1' ' ' THR . 15.6 mt -73.15 130.06 39.43 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 124.023 0.827 . . . . 45.87 111.582 178.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 57.5 p -77.65 166.8 22.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.339 -0.846 . . . . 47.02 109.183 176.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -57.92 -44.17 99.16 Favored Pre-proline 0 N--CA 1.468 0.457 0 N-CA-C 115.932 1.827 . . . . 54.26 115.932 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -54.67 -53.36 6.23 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 O-C-N 123.58 1.305 . . . . 47.62 109.61 171.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -53.14 -40.9 64.6 Favored 'General case' 0 C--O 1.242 0.699 0 O-C-N 123.684 0.615 . . . . 43.23 111.112 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.7 mttm -66.78 -46.41 75.39 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.325 -1.361 . . . . 40.84 107.325 -177.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.07 -48.09 83.17 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 120.016 -0.674 . . . . 38.48 111.68 176.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -40.74 -54.28 2.66 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 114.052 1.13 . . . . 39.33 114.052 172.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mt -63.54 -49.75 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 107.984 -1.117 . . . . 38.86 107.984 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.4 mtm-85 -48.02 -51.73 22.82 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 108.98 -0.748 . . . . 56.39 108.98 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . 0.59 ' O ' ' HB3' ' A' ' 16' ' ' SER . 10.0 t -64.66 -56.38 14.16 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 118.477 -1.289 . . . . 39.72 110.852 -177.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . 0.505 ' HG ' ' HE1' ' A' ' 132' ' ' TRP . 2.2 p -55.76 -38.45 69.85 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 123.804 0.69 . . . . 38.16 112.539 -175.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.503 ' CZ2' ' HB2' ' A' ' 73' ' ' MET . 74.2 t-105 -67.41 -37.8 83.64 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 118.725 -1.19 . . . . 38.54 109.859 175.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' SER . . . . . 0.59 ' HB3' ' O ' ' A' ' 13' ' ' SER . 45.3 t -54.52 -32.21 57.68 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 115.979 -0.555 . . . . 42.55 109.507 179.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 18' ' ' PHE . 21.4 mttm -74.85 -59.01 2.93 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 115.13 -0.941 . . . . 53.09 109.985 178.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.433 ' C ' ' O ' ' A' ' 17' ' ' LYS . 36.6 t80 -41.21 -39.92 1.45 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.849 -1.167 . . . . 43.46 107.849 173.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 15.4 mmm -75.43 -13.54 60.39 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 115.278 1.585 . . . . 47.11 115.278 -173.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . 1.158 ' C ' HD22 ' A' ' 21' ' ' ASN . 38.2 m-20 -62.27 -34.42 76.52 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 112.67 0.619 . . . . 51.01 112.67 176.389 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . 1.158 HD22 ' C ' ' A' ' 20' ' ' ASP . 0.6 OUTLIER -132.86 64.84 1.6 Allowed 'General case' 0 CA--C 1.48 -1.728 0 N-CA-C 104.075 -2.565 . . . . 54.98 104.075 172.386 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.9 -45.26 96.04 Favored Glycine 0 N--CA 1.42 -2.42 0 C-N-CA 119.727 -1.225 . . . . 51.97 115.697 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 10.3 t -67.3 -45.8 85.26 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.684 0 C-N-CA 115.583 -2.447 . . . . 52.8 113.58 -178.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 m -52.44 -56.71 13.23 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 118.896 -1.121 . . . . 56.74 108.767 177.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.433 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 29.4 m120 -51.51 -46.96 63.42 Favored 'General case' 0 CA--C 1.506 -0.74 0 O-C-N 124.083 0.865 . . . . 53.9 112.676 178.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.473 ' HA3' ' OG ' ' A' ' 66' ' ' SER . . . -48.37 -45.62 28.62 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 110.8 -0.92 . . . . 54.84 110.8 176.524 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.543 ' HG2' ' HG3' ' A' ' 62' ' ' MET . 59.6 mt-30 -73.85 -45.53 50.53 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 119.178 -1.009 . . . . 62.96 109.344 -179.55 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -48.6 -39.71 23.61 Favored Glycine 0 CA--C 1.497 -1.065 0 N-CA-C 106.971 -2.451 . . . . 56.63 106.971 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -67.66 -53.35 28.56 Favored 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 123.757 0.328 . . . . 57.51 111.121 176.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -54.81 -51.89 64.39 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.538 -1.282 . . . . 67.23 107.538 176.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 79.7 mmm -48.69 -52.11 25.07 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 108.898 -0.778 . . . . 72.24 108.898 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.57 -43.11 79.66 Favored 'General case' 0 C--O 1.242 0.692 0 O-C-N 124.352 1.033 . . . . 63.44 110.836 178.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.5 tp -63.34 -60.07 3.87 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 113.161 0.8 . . . . 62.13 113.161 -176.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -56.85 -42.93 80.59 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 110.253 -0.277 . . . . 63.52 110.253 -176.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . . . -58.09 -48.88 78.83 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.115 0.885 . . . . 65.01 111.339 174.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.96 -51.4 47.97 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.667 0.617 . . . . 66.29 112.667 -176.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.449 ' HE1' HD11 ' A' ' 113' ' ' ILE . 2.5 m80 -126.24 90.74 49.41 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 108.515 -0.92 . . . . 70.52 108.515 178.066 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -44.52 -48.86 9.75 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.757 2.305 . . . . 69.47 114.844 -177.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.638 ' N ' ' OE1' ' A' ' 39' ' ' GLU . 17.9 pm0 -46.33 -29.93 1.87 Allowed 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 115.954 1.835 . . . . 76.72 115.954 -170.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.885 ' O ' ' HD2' ' A' ' 43' ' ' PRO . 11.3 p -52.09 -48.25 64.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.161 -0.472 . . . . 71.54 112.117 -179.287 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 11.0 tp -42.65 -24.4 0.06 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.87 1.433 . . . . 72.77 114.87 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.5 m -53.93 -58.87 11.48 Favored Pre-proline 0 N--CA 1.476 0.874 0 N-CA-C 113.687 0.995 . . . . 71.59 113.687 -175.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.885 ' HD2' ' O ' ' A' ' 40' ' ' THR . 23.5 Cg_endo -65.94 -7.88 18.21 Favored 'Trans proline' 0 C--N 1.358 1.064 0 C-N-CA 117.413 -1.258 . . . . 70.47 114.277 -179.081 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -88.04 -10.31 50.66 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 113.978 1.103 . . . . 69.27 113.978 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.505 ' O ' ' HA3' ' A' ' 49' ' ' GLY . 6.7 mmtp -50.17 -30.54 11.6 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.182 1.919 . . . . 69.71 116.182 -179.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 2.1 p -61.63 -39.26 90.66 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.245 -0.91 . . . . 68.27 111.279 175.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 49.7 tp -94.69 -58.13 2.27 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 114.776 -1.102 . . . . 65.18 109.305 -173.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -92.66 15.33 14.66 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 115.681 -0.69 . . . . 61.91 112.578 -175.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.505 ' HA3' ' O ' ' A' ' 45' ' ' LYS . . . -79.25 -18.14 74.86 Favored Glycine 0 CA--C 1.503 -0.668 0 C-N-CA 120.282 -0.961 . . . . 58.74 114.268 -169.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.55 7.79 54.08 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.447 -1.061 . . . . 56.72 110.447 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.1 142.9 51.2 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.952 1.301 . . . . 55.24 111.345 -176.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . 0.426 ' O ' ' C ' ' A' ' 53' ' ' LEU . 30.6 p -101.11 152.59 20.44 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 106.845 -1.539 . . . . 56.25 106.845 177.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.426 ' C ' ' O ' ' A' ' 52' ' ' THR . 0.6 OUTLIER -42.55 -47.29 5.13 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 119.425 -0.91 . . . . 61.02 113.288 -171.444 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -51.95 -33.83 39.36 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.16 0.505 . . . . 58.12 111.816 -174.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -89.77 -16.85 29.37 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 117.058 2.244 . . . . 59.59 117.058 -170.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.615 ' O ' ' C ' ' A' ' 57' ' ' GLN . 25.5 mt -65.72 -42.1 91.5 Favored 'General case' 0 C--O 1.196 -1.715 0 O-C-N 124.769 1.293 . . . . 61.92 108.264 174.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.615 ' C ' ' O ' ' A' ' 56' ' ' LEU . 51.4 tp60 -52.57 126.71 20.46 Favored 'General case' 0 N--CA 1.41 -2.433 0 N-CA-C 104.147 -2.538 . . . . 67.84 104.147 -173.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 61.45 20.74 11.44 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 114.823 1.416 . . . . 64.34 114.823 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -86.63 139.1 33.36 Favored Pre-proline 0 C--N 1.311 -1.104 0 N-CA-C 109.328 -0.619 . . . . 56.38 109.328 171.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -43.01 -51.71 5.31 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.62 1.546 . . . . 52.93 114.796 175.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HA ' HG11 ' B' ' 88' ' ' VAL . 43.6 mttp -56.69 -38.53 72.4 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.849 0.833 . . . . 50.43 110.37 179.663 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' MET . . . . . 0.543 ' HG3' ' HG2' ' A' ' 27' ' ' GLN . 1.2 tpt -75.64 -42.96 50.07 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 107.783 -1.191 . . . . 57.84 107.783 -174.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -60.96 -42.52 98.45 Favored 'General case' 0 C--O 1.241 0.644 0 O-C-N 124.251 0.969 . . . . 57.85 110.418 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.14 -69.08 0.12 Allowed 'General case' 0 N--CA 1.424 -1.74 0 N-CA-C 105.595 -2.002 . . . . 46.0 105.595 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.435 ' O ' ' HB ' ' A' ' 68' ' ' VAL . 36.4 tp60 -41.39 -50.14 3.82 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 114.716 1.376 . . . . 52.62 114.716 -179.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . 0.473 ' OG ' ' HA3' ' A' ' 26' ' ' GLY . 2.1 t -61.63 -36.82 81.84 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.013 0.375 . . . . 42.59 112.013 -177.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.414 HD21 ' HB2' ' B' ' 75' ' ' SER . 44.7 tp -67.94 -47.91 67.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.683 0.754 . . . . 39.82 110.664 178.667 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.506 HG21 ' HE2' ' B' ' 92' ' ' LYS . 17.6 t -42.79 -63.43 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.988 0 CA-C-N 115.137 -0.938 . . . . 39.93 110.819 168.126 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -56.3 -38.56 71.42 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.5 -0.773 . . . . 41.35 109.512 -178.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.7 m -63.67 -39.93 95.57 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 113.203 0.816 . . . . 45.23 113.203 178.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.403 ' O ' ' C ' ' A' ' 72' ' ' GLY . 90.6 m-20 -61.57 -56.48 19.53 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 109.126 -0.694 . . . . 47.95 109.126 173.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.403 ' C ' ' O ' ' A' ' 71' ' ' ASN . . . -31.96 -68.02 0.15 Allowed Glycine 0 CA--C 1.511 -0.17 0 CA-C-N 114.996 -1.002 . . . . 43.47 112.73 174.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' MET . . . . . 0.503 ' HB2' ' CZ2' ' A' ' 15' ' ' TRP . 11.6 mmm -58.64 -48.76 79.94 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 113.756 1.021 . . . . 51.01 113.756 -178.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.8 m -51.93 -47.8 64.52 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 106.472 -1.677 . . . . 42.93 106.472 -174.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.2 p -54.68 -50.58 67.9 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.712 -0.676 . . . . 43.22 110.554 -177.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -52.77 -59.35 4.6 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.508 -0.553 . . . . 43.1 109.508 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 74.6 t -52.09 -38.06 23.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.924 -0.58 . . . . 43.16 112.158 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -72.49 -6.9 46.97 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 115.389 1.626 . . . . 51.75 115.389 -177.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -129.63 34.89 4.26 Favored 'General case' 0 CA--C 1.481 -1.694 0 N-CA-C 108.502 -0.925 . . . . 44.4 108.502 -172.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.5 mt -61.05 -33.06 72.71 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 113.921 -1.491 . . . . 40.86 108.895 171.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -98.49 7.59 45.96 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 114.524 1.305 . . . . 42.07 114.524 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASP . . . . . 1.019 ' OD2' ' HE3' ' A' ' 85' ' ' MET . 34.4 t0 -130.19 66.14 1.5 Allowed 'General case' 0 C--O 1.219 -0.501 0 O-C-N 124.265 0.978 . . . . 52.5 108.878 177.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.698 ' O ' HG23 ' A' ' 87' ' ' VAL . 4.7 m-20 -57.71 -35.42 70.64 Favored 'General case' 0 N--CA 1.413 -2.318 0 C-N-CA 118.675 -1.21 . . . . 53.04 111.715 -176.978 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.5 ' C ' ' O ' ' A' ' 83' ' ' ASN . 65.2 m-20 -56.43 -47.93 78.05 Favored 'General case' 0 N--CA 1.412 -2.328 0 C-N-CA 114.792 -2.763 . . . . 46.48 105.861 -173.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' MET . . . . . 1.019 ' HE3' ' OD2' ' A' ' 82' ' ' ASP . 8.2 ttm -69.17 -44.65 71.79 Favored 'General case' 0 C--O 1.18 -2.564 0 C-N-CA 119.413 -0.915 . . . . 56.87 109.442 179.42 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.601 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 37.6 tp -49.54 -57.73 6.53 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.494 -0.882 . . . . 43.39 110.42 179.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.698 HG23 ' O ' ' A' ' 83' ' ' ASN . 2.9 t -55.74 -40.98 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.847 0 C-N-CA 119.938 -0.705 . . . . 41.12 111.345 -176.459 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 91.6 t -58.38 -51.95 65.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 C-N-CA 119.26 -0.976 . . . . 42.57 109.817 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.34 -51.02 58.2 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.376 0.51 . . . . 43.72 112.376 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 84.8 mt -53.28 -57.13 5.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.266 0 N-CA-C 109.755 -0.461 . . . . 46.6 109.755 173.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -54.46 -47.26 73.14 Favored 'General case' 0 CA--C 1.5 -0.949 0 C-N-CA 120.71 -0.396 . . . . 58.82 110.232 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -52.48 -53.24 48.39 Favored 'General case' 0 CA--C 1.519 -0.242 0 O-C-N 124.856 1.347 . . . . 54.98 110.051 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' MET . . . . . 0.534 ' HG2' ' CE1' ' A' ' 97' ' ' HIS . 1.6 ttp -51.62 -53.69 35.77 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.869 -1.059 . . . . 62.44 109.924 170.092 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.611 ' HB2' HD23 ' A' ' 143' ' ' LEU . . . -52.47 -38.3 59.06 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 114.532 1.308 . . . . 59.57 114.532 -176.401 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -58.58 -45.49 88.93 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 122.825 0.45 . . . . 67.39 111.558 176.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.509 HD13 ' CBA' ' A' ' 500' ' ' HEM . 2.7 mt -72.52 -49.56 32.0 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.283 -0.567 . . . . 67.33 110.031 -172.655 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.534 ' CE1' ' HG2' ' A' ' 93' ' ' MET . 66.1 m80 -62.83 -18.85 63.43 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 120.349 -0.54 . . . . 68.15 111.037 177.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 94' ' ' ALA . 50.8 t30 -71.64 -48.91 44.7 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 120.393 -0.523 . . . . 72.56 112.053 177.613 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -54.9 -19.53 6.82 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 124.139 0.899 . . . . 73.98 112.925 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.566 ' HB2' HD12 ' A' ' 102' ' ' ILE . 7.5 mtp85 -103.45 10.01 37.44 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.34 0.591 . . . . 87.0 109.803 -179.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 73.96 6.87 74.64 Favored Glycine 0 C--O 1.239 0.452 0 N-CA-C 115.423 0.929 . . . . 75.47 115.423 172.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.566 HD12 ' HB2' ' A' ' 100' ' ' ARG . 2.8 mp -62.57 134.58 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 107.819 -1.178 . . . . 76.77 107.819 176.271 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.573 ' O ' ' HB2' ' A' ' 106' ' ' ASP . . . -86.02 157.36 20.11 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 110.36 -0.237 . . . . 76.73 110.36 178.505 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.72 -38.71 85.97 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 112.377 0.51 . . . . 77.21 112.377 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 89.7 p -79.61 -9.09 59.57 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.92 -0.582 . . . . 77.76 111.417 176.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.573 ' HB2' ' O ' ' A' ' 103' ' ' ARG . 2.4 m-20 -76.04 -21.4 56.86 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.382 -0.826 . . . . 78.97 109.877 168.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 11.7 mt -97.71 -35.97 10.39 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 109.159 -0.682 . . . . 73.84 109.159 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.422 ' HA ' ' SG ' ' A' ' 140' ' ' CYS . 29.8 tpt85 -45.72 -53.45 9.4 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.828 -0.804 . . . . 79.92 108.828 171.87 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 39.0 p -69.19 -34.04 74.28 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 119.677 -0.809 . . . . 68.96 111.28 -177.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.412 ' CB ' HMC2 ' A' ' 500' ' ' HEM . . . -53.78 -42.29 68.14 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.192 0.441 . . . . 63.8 112.192 173.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.409 ' CZ ' ' HAB' ' A' ' 500' ' ' HEM . 40.3 m-85 -72.52 -33.32 66.81 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 112.73 0.641 . . . . 61.65 112.73 174.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -60.47 -41.78 94.88 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 107.219 -1.4 . . . . 65.04 107.219 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.449 HD11 ' HE1' ' A' ' 37' ' ' HIS . 32.0 mm -68.61 -31.49 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-N 116.225 -0.443 . . . . 59.52 110.503 179.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.3 tp -70.72 -44.32 67.12 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 120.362 -0.535 . . . . 56.22 110.579 -178.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 59.1 mt -60.19 -49.56 83.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 108.114 -1.069 . . . . 57.32 108.114 177.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -60.03 -48.79 80.26 Favored 'General case' 0 CA--C 1.504 -0.815 0 C-N-CA 119.803 -0.759 . . . . 66.2 110.21 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -48.19 -53.74 15.87 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 123.691 0.619 . . . . 57.23 112.389 172.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 93.5 mtp -63.3 -36.0 82.24 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.629 0.974 . . . . 57.21 113.629 -179.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -63.74 -51.27 65.66 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 107.937 -1.134 . . . . 64.21 107.937 175.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -55.13 -31.52 61.35 Favored 'General case' 0 CA--C 1.489 -1.402 0 O-C-N 124.103 0.877 . . . . 66.07 111.885 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -100.73 14.09 32.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 124.164 0.915 . . . . 59.24 113.288 -177.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 54.29 53.13 11.37 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 122.033 0.92 . . . . 59.94 111.495 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -99.46 -33.43 10.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.115 -1.068 . . . . 57.68 108.115 173.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 5.8 mmt -55.96 112.99 1.33 Allowed 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.736 -0.666 . . . . 54.47 109.744 172.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 18.0 m -77.57 -177.97 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 N-CA-C 106.138 -1.801 . . . . 52.76 106.138 165.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -46.37 129.45 10.93 Favored Glycine 0 C--O 1.223 -0.581 0 N-CA-C 109.621 -1.392 . . . . 50.67 109.621 177.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 52.81 24.44 19.15 Favored Glycine 0 N--CA 1.47 0.945 0 N-CA-C 119.647 2.619 . . . . 48.23 119.647 173.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -83.25 -27.94 29.53 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.602 0.593 . . . . 45.54 112.602 168.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . . . -59.63 -37.84 79.72 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 118.274 -1.37 . . . . 45.73 109.815 175.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.41 ' O ' HG23 ' A' ' 134' ' ' VAL . 3.6 m-20 -67.07 -49.73 64.11 Favored 'General case' 0 CA--C 1.509 -0.633 0 O-C-N 123.941 0.776 . . . . 50.99 110.404 178.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -56.05 -54.77 40.93 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.414 -1.328 . . . . 43.52 107.414 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' TRP . . . . . 0.505 ' HE1' ' HG ' ' A' ' 14' ' ' SER . 35.1 m95 -55.9 -44.01 77.82 Favored 'General case' 0 CA--C 1.497 -1.072 0 C-N-CA 120.351 -0.54 . . . . 41.45 110.868 -177.384 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -46.1 -62.93 1.12 Allowed 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 123.648 0.592 . . . . 53.74 110.036 175.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 130' ' ' ASP . 48.1 t -56.58 -52.26 55.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-N 115.382 -0.826 . . . . 39.76 111.004 177.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' PHE . . . . . 0.445 ' O ' ' HB3' ' A' ' 138' ' ' PHE . 5.9 t80 -44.26 -60.08 2.08 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.08 -0.964 . . . . 40.89 109.943 177.152 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 2.8 m -67.46 -22.35 28.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 119.288 -0.965 . . . . 39.99 112.122 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -54.39 -65.15 3.69 Favored Glycine 0 CA--C 1.503 -0.689 1 N-CA-C 102.95 -4.06 . . . . 41.84 102.95 173.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.445 ' HB3' ' O ' ' A' ' 135' ' ' PHE . 87.2 t80 -45.0 -54.58 6.41 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 113.003 -1.599 . . . . 46.67 114.176 178.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 6.9 mt -52.03 -43.52 37.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.705 0.764 . . . . 45.99 111.76 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' CYS . . . . . 0.545 ' HA ' HD12 ' A' ' 143' ' ' LEU . 88.8 m -74.12 -39.77 63.11 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 119.948 -0.701 . . . . 53.03 111.846 -175.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . . . -55.54 -54.37 44.85 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 108.15 -1.055 . . . . 55.29 108.15 172.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 91.4 m -53.45 -40.73 65.46 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-N 116.349 -0.387 . . . . 60.34 110.404 179.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.611 HD23 ' HB2' ' A' ' 94' ' ' ALA . 23.7 mt -63.62 -62.91 1.36 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.405 -1.331 . . . . 64.88 107.405 174.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -36.99 -67.37 0.43 Allowed Glycine 0 N--CA 1.475 1.267 0 C-N-CA 124.292 0.949 . . . . 69.57 111.583 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -49.5 -37.69 27.5 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.585 0.957 . . . . 74.1 113.585 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' TYR . . . . . 0.414 ' O ' ' HB3' ' A' ' 149' ' ' GLU . 76.0 t80 -81.19 -43.13 19.75 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.44 0.904 . . . . 80.42 113.44 -176.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 94.8 mtp -74.3 -33.63 63.27 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.788 -0.57 . . . . 83.43 109.989 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . . . -63.72 -19.85 65.27 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 120.496 -0.482 . . . . 87.16 109.885 168.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.414 ' HB3' ' O ' ' A' ' 146' ' ' TYR . 1.9 tp10 -81.7 2.6 28.98 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 122.403 0.281 . . . . 96.01 111.114 173.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.46 173.23 10.75 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 112.423 0.527 . . . . 93.51 112.423 177.006 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.36 0 N-CA-C 113.573 0.953 . . . . 94.64 113.573 -177.856 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 . . . . . . . . 82.32 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' THR . . . . . 0.454 ' H ' HD21 ' B' ' 83' ' ' ASN . 16.4 p -46.87 151.62 0.59 Allowed 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.954 0.902 . . . . 81.39 110.006 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 10.3 t 55.61 20.64 3.99 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 125.196 1.398 . . . . 78.3 114.676 173.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 15.5 tp -128.48 118.73 23.58 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.936 -1.505 . . . . 74.21 106.936 -169.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' THR . . . . . 0.476 ' O ' ' HG3' ' B' ' 8' ' ' LYS . 1.1 p -76.67 177.47 7.51 Favored 'General case' 0 C--O 1.221 -0.407 0 O-C-N 124.057 0.848 . . . . 71.68 111.69 -173.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -99.73 -16.21 0.19 Allowed Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 117.011 2.226 . . . . 74.49 117.011 -168.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -84.38 -18.42 4.93 Favored 'Trans proline' 0 CA--C 1.545 1.037 1 C-N-CA 110.676 -5.749 . . . . 67.9 109.419 158.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -67.99 -37.27 81.27 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 122.234 1.016 . . . . 67.1 110.084 173.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' B' ' 4' ' ' THR . 60.7 mttt -70.61 -37.94 73.9 Favored 'General case' 0 N--CA 1.439 -1.024 0 CA-C-N 115.012 -0.994 . . . . 61.93 109.103 177.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.83 -42.33 97.64 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.117 0.484 . . . . 56.3 110.024 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.63 -47.59 66.95 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 114.859 -1.064 . . . . 53.2 112.246 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -57.99 -63.78 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 O-C-N 123.776 0.673 . . . . 49.89 110.472 172.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 41.6 mtt85 -43.08 -50.29 6.12 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 119.959 -0.696 . . . . 59.79 112.045 175.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 9.8 m -47.09 -53.31 13.05 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.072 0.939 . . . . 51.84 112.484 175.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 89.1 p -77.17 -35.61 55.8 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 113.29 -1.777 . . . . 45.26 107.483 -168.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' TRP . . . . . 0.473 ' CZ2' ' HB3' ' B' ' 73' ' ' MET . 67.0 t-105 -72.49 -31.76 65.65 Favored 'General case' 0 N--CA 1.44 -0.953 0 C-N-CA 119.434 -0.906 . . . . 42.62 110.448 -178.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 2.0 t -51.66 -51.86 52.48 Favored 'General case' 0 C--O 1.216 -0.705 0 C-N-CA 120.386 -0.525 . . . . 43.61 111.728 170.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 11.7 mtpt -61.85 -43.89 97.94 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 108.877 -0.786 . . . . 55.45 108.877 -177.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' PHE . . . . . 0.471 ' CE1' ' HB3' ' B' ' 25' ' ' ASN . 29.3 t80 -52.74 -44.76 66.66 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 107.817 -1.179 . . . . 42.53 107.817 177.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' MET . . . . . 0.431 ' C ' ' N ' ' B' ' 21' ' ' ASN . 15.8 mmt -77.28 -34.39 55.65 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 113.47 0.915 . . . . 46.29 113.47 -172.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -39.26 -28.23 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.511 0.672 . . . . 45.18 109.305 171.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.431 ' N ' ' C ' ' B' ' 19' ' ' MET . 7.1 m-80 -124.63 -12.41 7.17 Favored 'General case' 0 C--O 1.189 -2.095 0 N-CA-C 113.898 1.073 . . . . 41.86 113.898 179.275 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 51.61 -118.32 6.86 Favored Glycine 0 C--O 1.182 -3.098 0 N-CA-C 120.701 3.04 . . . . 43.87 120.701 163.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.66 ' O ' ' C ' ' B' ' 24' ' ' SER 0.256 26.2 t -57.18 -45.83 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.544 0 CA-C-N 114.648 -0.776 . . . . 44.06 110.351 -174.144 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' SER . . . . . 0.66 ' C ' ' O ' ' B' ' 23' ' ' VAL . 35.9 t -38.39 -57.18 1.16 Allowed 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 117.36 -1.736 . . . . 45.16 107.941 170.401 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ASN . . . . . 0.471 ' HB3' ' CE1' ' B' ' 18' ' ' PHE . 21.4 m120 -68.04 -26.39 65.84 Favored 'General case' 0 C--O 1.214 -0.814 0 N-CA-C 115.509 1.67 . . . . 48.3 115.509 -177.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.7 -45.04 91.19 Favored Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 106.548 -2.621 . . . . 46.15 106.548 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' B' ' 31' ' ' MET . 30.5 mt-30 -61.19 -50.62 72.38 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 109.181 -0.674 . . . . 56.15 109.181 174.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' GLY . . . . . 0.441 ' HA3' ' CE1' ' B' ' 117' ' ' TYR . . . -43.62 -57.76 4.39 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 111.138 -0.785 . . . . 46.08 111.138 175.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' PHE . . . . . 0.462 ' O ' ' C ' ' B' ' 30' ' ' TYR . 42.5 t80 -53.93 -57.31 11.46 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 122.534 -0.391 . . . . 46.9 110.271 174.857 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' TYR . . . . . 0.462 ' C ' ' O ' ' B' ' 29' ' ' PHE . 2.5 m-85 -55.69 -39.79 71.46 Favored 'General case' 0 N--CA 1.42 -1.934 0 C-N-CA 117.508 -1.677 . . . . 51.68 108.486 -174.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 4.9 mmt -60.93 -47.07 88.11 Favored 'General case' 0 C--O 1.198 -1.655 0 C-N-CA 116.36 -2.136 . . . . 60.64 111.503 -179.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -60.43 -38.08 82.96 Favored 'General case' 0 CA--C 1.46 -2.485 0 N-CA-C 106.175 -1.787 . . . . 61.25 106.175 -175.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 63.9 tp -62.52 -54.95 32.22 Favored 'General case' 0 C--N 1.298 -1.668 0 C-N-CA 117.932 -1.507 . . . . 61.56 111.007 -178.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -58.81 -24.77 62.42 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.153 0.501 . . . . 65.61 111.871 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -78.81 -66.13 0.9 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.301 -1.37 . . . . 79.92 107.301 178.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.46 -46.39 76.81 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 113.68 0.993 . . . . 66.8 113.68 179.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.471 ' HD2' HD11 ' B' ' 113' ' ' ILE . 94.4 m-70 -135.8 87.75 24.67 Favored Pre-proline 0 C--O 1.218 -0.561 0 C-N-CA 119.619 -0.833 . . . . 70.21 111.104 179.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -60.54 -27.95 85.77 Favored 'Trans proline' 0 C--N 1.345 0.392 1 C-N-CA 126.144 4.563 . . . . 67.98 115.076 -172.672 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . . . -50.24 -27.04 5.36 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.564 1.146 . . . . 70.51 111.408 176.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 43.6 p -67.44 -20.76 65.54 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 114.496 1.295 . . . . 71.41 114.496 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.422 ' O ' HD23 ' B' ' 41' ' ' LEU . 3.0 tt -73.23 -19.4 61.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.933 0.397 . . . . 74.01 110.865 178.423 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 45.5 m -57.74 -50.68 86.75 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 114.336 1.236 . . . . 74.91 114.336 -171.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.463 ' HG3' HBC1 ' B' ' 500' ' ' HEM . 48.3 Cg_endo -70.26 -21.02 31.73 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 118.038 -0.841 . . . . 75.38 111.872 -176.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' PHE . . . . . 0.49 ' O ' ' C ' ' B' ' 45' ' ' LYS . 48.3 m-85 -75.3 -20.57 59.03 Favored 'General case' 0 CA--C 1.514 -0.416 0 O-C-N 124.091 0.869 . . . . 76.92 112.991 177.175 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LYS . . . . . 0.49 ' C ' ' O ' ' B' ' 44' ' ' PHE . . . -30.43 -52.95 0.17 Allowed 'General case' 0 CA--C 1.543 0.698 0 O-C-N 123.066 0.229 . . . . 79.19 110.66 -179.626 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 8.9 p -70.09 -23.14 63.01 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 117.115 2.265 . . . . 80.79 117.115 -172.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' LEU . . . . . . . . . . . . . 37.9 tp -76.78 -51.68 10.93 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 119.577 -0.849 . . . . 81.05 110.221 171.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -80.11 27.65 0.31 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.769 1.026 . . . . 81.21 113.769 -176.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -69.04 131.52 25.4 Favored Glycine 0 N--CA 1.478 1.453 0 N-CA-C 114.731 0.653 . . . . 82.54 114.731 -171.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 61.09 37.17 93.47 Favored Glycine 0 N--CA 1.47 0.933 0 N-CA-C 110.858 -0.897 . . . . 82.2 110.858 -169.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.478 ' HA ' HE21 ' B' ' 55' ' ' GLN . 9.6 tp -142.01 118.55 10.96 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.203 0.525 . . . . 81.16 110.535 -176.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' THR . . . . . 0.996 ' H ' HE21 ' B' ' 55' ' ' GLN . 2.4 t -73.99 154.42 39.3 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.446 -0.797 . . . . 80.61 111.325 -178.985 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.566 ' H ' HD12 ' B' ' 53' ' ' LEU . 3.5 mp -60.16 -32.01 70.65 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.001 -0.999 . . . . 77.46 112.362 179.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.33 -39.53 85.84 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 115.842 -0.617 . . . . 75.09 110.804 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.996 HE21 ' H ' ' B' ' 52' ' ' THR . 19.4 pt20 -87.15 0.59 55.07 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 113.154 0.798 . . . . 72.64 113.154 -176.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' B' ' 53' ' ' LEU . 19.7 mt -60.04 -51.22 70.58 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.271 1.028 . . . . 70.22 113.528 174.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -59.18 124.53 20.29 Favored 'General case' 0 CA--C 1.507 -0.673 0 CA-C-O 121.501 0.667 . . . . 78.76 111.646 -175.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 67.63 -2.28 1.39 Allowed 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 113.167 -1.833 . . . . 68.99 113.599 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -64.82 137.78 97.26 Favored Pre-proline 0 N--CA 1.439 -1.021 0 N-CA-C 106.537 -1.653 . . . . 63.16 106.537 170.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -48.43 -51.49 10.13 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 121.581 1.521 . . . . 57.99 111.648 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 26.4 mttt -51.7 -28.7 15.64 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 119.484 -0.886 . . . . 61.81 112.915 -177.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' MET . . . . . . . . . . . . . 12.6 tpt -83.45 -52.02 6.87 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 110.388 -0.227 . . . . 60.5 110.388 174.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 33.0 mtpt -47.75 -50.65 24.81 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.944 -0.391 . . . . 51.62 109.944 174.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.59 -64.89 0.68 Allowed 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.921 0.391 . . . . 46.29 111.99 176.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -46.54 -44.78 18.18 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 112.443 0.535 . . . . 46.5 112.443 176.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 4.9 t -58.42 -45.39 88.55 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.729 -0.471 . . . . 41.27 109.729 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 36.4 tp -56.25 -55.06 37.87 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-N 115.67 -0.695 . . . . 39.34 110.925 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 66.3 t -45.12 -58.44 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 115.53 -0.759 . . . . 36.71 109.096 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' PHE . . . . . 1.084 ' HE1' HBB2 ' B' ' 500' ' ' HEM . 43.7 t80 -49.35 -52.05 30.63 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 113.285 0.846 . . . . 36.93 113.285 179.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' CYS . . . . . 0.428 ' HB3' ' HE3' ' B' ' 19' ' ' MET . 95.4 m -44.6 -56.88 4.0 Favored 'General case' 0 CA--C 1.521 -0.151 0 O-C-N 123.334 0.396 . . . . 37.85 111.57 173.682 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -50.61 -58.85 4.85 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-O 119.396 -0.335 . . . . 41.13 110.659 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . -42.74 -62.68 2.17 Favored Glycine 0 CA--C 1.522 0.478 0 N-CA-C 111.94 -0.464 . . . . 39.91 111.94 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' MET . . . . . 0.473 ' HB3' ' CZ2' ' B' ' 15' ' ' TRP . 18.6 mmm -52.01 -54.05 34.52 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 113.8 1.037 . . . . 46.39 113.8 177.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 5.6 m -53.12 -51.85 60.59 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 107.906 -1.146 . . . . 42.72 107.906 177.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' SER . . . . . 0.414 ' HB2' HD21 ' A' ' 67' ' ' LEU . 38.6 p -55.32 -14.81 2.02 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.649 -0.705 . . . . 43.94 111.907 -176.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 17.8 m-30 -91.03 -49.65 6.3 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 108.187 -1.042 . . . . 45.8 108.187 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 13.9 t -58.86 -29.19 39.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.019 -0.991 . . . . 50.23 112.161 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -83.48 -29.77 27.72 Favored 'General case' 0 N--CA 1.442 -0.866 0 C-N-CA 119.226 -0.99 . . . . 55.82 109.782 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -97.14 25.22 5.63 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 122.055 0.931 . . . . 60.74 111.77 -177.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 32.1 mt -58.37 -30.67 66.96 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-N 114.17 -1.377 . . . . 59.49 111.013 172.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -94.2 -39.01 10.77 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.53 0.937 . . . . 65.05 113.53 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -75.28 45.77 0.3 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.015 0.526 . . . . 72.36 111.977 -178.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ASN . . . . . 0.454 HD21 ' H ' ' B' ' 1' ' ' THR . 25.2 t-20 -41.98 -47.25 4.34 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 121.057 3.725 . . . . 69.66 121.057 -162.332 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ASP . . . . . 0.411 ' O ' HG23 ' B' ' 88' ' ' VAL . 3.5 t70 -56.69 -29.42 62.36 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.364 -0.976 . . . . 72.4 108.364 -175.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' MET . . . . . . . . . . . . . 16.8 ttt -82.68 -42.86 17.59 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 114.935 -1.03 . . . . 64.27 110.578 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.434 ' HA ' HD12 ' B' ' 89' ' ' LEU . 14.8 tp -40.42 -60.16 1.16 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 109.248 -0.649 . . . . 57.37 109.248 169.718 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 71.6 t -44.6 -42.6 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 N-CA-C 114.504 1.298 . . . . 53.08 114.504 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' VAL . . . . . 0.457 HG11 ' HA ' ' A' ' 61' ' ' LYS . 2.4 t -73.9 -43.78 52.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 116.434 -0.348 . . . . 51.98 110.603 -173.317 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' B' ' 86' ' ' LEU . 14.2 mt -55.5 -46.35 76.95 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 107.457 -1.312 . . . . 51.48 107.457 176.454 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.429 HG21 ' HB ' ' B' ' 142' ' ' THR . 91.1 mt -59.25 -50.5 79.59 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.728 0 N-CA-C 107.768 -1.197 . . . . 52.61 107.768 177.104 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -58.0 -42.24 84.74 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.235 -0.986 . . . . 63.24 112.407 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.506 ' HE2' HG21 ' A' ' 68' ' ' VAL . 25.2 mtpp -57.3 -48.02 80.0 Favored 'General case' 0 CA--C 1.504 -0.803 0 N-CA-C 109.845 -0.428 . . . . 63.76 109.845 174.744 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' MET . . . . . 0.581 ' HG3' ' HD1' ' B' ' 97' ' ' HIS . 3.2 ttp -58.21 -53.31 59.75 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 120.056 -0.658 . . . . 63.08 110.353 178.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.11 -45.23 64.8 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.838 -0.619 . . . . 66.93 112.614 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 33.2 tttt -58.13 -47.81 82.16 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 120.362 -0.535 . . . . 76.67 111.793 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.549 HD12 ' CBA' ' B' ' 500' ' ' HEM . 10.1 mt -62.63 -51.55 66.86 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 120.711 0.291 . . . . 75.49 110.436 -176.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' HIS . . . . . 0.581 ' HD1' ' HG3' ' B' ' 93' ' ' MET . 45.2 m80 -65.63 -15.29 62.61 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.707 -0.679 . . . . 76.51 112.824 179.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 22.0 t30 -73.66 -50.68 19.78 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.886 -0.508 . . . . 81.79 111.362 170.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -51.16 -52.57 42.86 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.672 -0.862 . . . . 85.2 108.672 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . . . -68.42 14.73 0.06 Allowed 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 114.359 1.244 . . . . 81.99 114.359 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 66.74 44.1 90.22 Favored Glycine 0 N--CA 1.467 0.737 0 N-CA-C 117.431 1.733 . . . . 81.29 117.431 171.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ILE . . . . . 0.58 HG12 ' CBC' ' B' ' 500' ' ' HEM . 2.7 mp -113.09 153.71 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 122.766 0.427 . . . . 80.35 111.838 -178.204 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.406 ' O ' ' HB2' ' B' ' 106' ' ' ASP . 4.6 mtt85 -107.41 153.72 22.37 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.8 0.334 . . . . 83.27 110.158 176.802 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.16 -34.28 56.18 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.461 0.912 . . . . 78.0 113.461 175.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 76.5 p -78.5 -25.79 45.74 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.987 -0.552 . . . . 75.66 111.708 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' B' ' 103' ' ' ARG . 27.5 m-20 -58.31 -43.21 88.02 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 106.973 -1.492 . . . . 73.15 106.973 169.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 8.0 mt -77.65 -41.29 38.81 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 119.762 -0.775 . . . . 68.9 112.119 -177.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ARG . . . . . 0.466 ' NH1' ' OD1' ' B' ' 112' ' ' ASP . 12.1 tpt85 -53.51 -37.69 63.01 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.153 0.433 . . . . 66.69 110.969 -179.112 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 75.0 p -79.04 -32.1 44.83 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.336 -0.847 . . . . 66.16 110.88 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.6 -28.91 70.22 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 121.156 0.503 . . . . 64.73 110.647 177.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' TYR . . . . . 0.535 ' O ' HD12 ' B' ' 115' ' ' ILE . 73.7 m-85 -76.84 -41.25 44.87 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.917 -0.713 . . . . 69.35 111.709 174.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.466 ' OD1' ' NH1' ' B' ' 108' ' ' ARG . 93.6 m-20 -54.83 -38.94 68.04 Favored 'General case' 0 CA--C 1.502 -0.904 0 N-CA-C 109.944 -0.391 . . . . 66.25 109.944 178.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ILE . . . . . 0.471 HD11 ' HD2' ' B' ' 37' ' ' HIS . 1.1 mp -67.85 -40.63 83.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 107.362 -1.347 . . . . 59.88 107.362 177.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.788 ' O ' ' HG3' ' B' ' 118' ' ' MET . 45.8 tp -54.64 -48.88 71.73 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 123.918 0.761 . . . . 56.95 109.226 176.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ILE . . . . . 0.659 HD11 HG21 ' B' ' 136' ' ' VAL . 2.4 mp -61.1 -47.49 93.31 Favored 'Isoleucine or valine' 0 C--O 1.245 0.828 0 N-CA-C 111.98 0.363 . . . . 56.05 111.98 178.589 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -56.33 -57.64 11.38 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.776 -0.824 . . . . 60.19 108.776 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' TYR . . . . . 0.441 ' CE1' ' HA3' ' B' ' 28' ' ' GLY . 52.7 t80 -43.45 -53.35 5.5 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 122.184 0.992 . . . . 57.17 112.604 174.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' MET . . . . . 0.788 ' HG3' ' O ' ' B' ' 114' ' ' LEU . 28.5 mtp -62.12 -47.05 86.3 Favored 'General case' 0 N--CA 1.426 -1.672 0 CA-C-N 114.86 -1.064 . . . . 58.04 108.629 -177.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -56.48 -48.27 77.48 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 118.787 -1.165 . . . . 68.73 112.821 175.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -54.68 -46.68 74.11 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 113.577 0.954 . . . . 66.73 113.577 -178.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -88.84 21.28 3.12 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 114.279 1.214 . . . . 60.61 114.279 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 57.03 34.36 24.8 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 113.637 0.977 . . . . 65.07 113.637 172.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HIS . . . . . . . . . . . . . 42.8 m170 -79.01 -33.87 44.55 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.304 -0.862 . . . . 58.84 108.692 171.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 12.3 mmt -62.76 138.08 58.43 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 114.95 -1.023 . . . . 62.48 111.752 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' VAL . . . . . 0.431 HG22 ' HB2' ' B' ' 128' ' ' ALA . 5.7 m -117.81 -178.59 1.33 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.003 0 CA-C-N 114.529 -1.214 . . . . 65.42 109.101 177.059 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -56.06 113.61 4.19 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-N 116.268 -0.424 . . . . 68.85 112.072 169.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 106.17 -30.18 10.02 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 123.67 0.652 . . . . 69.23 112.343 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ALA . . . . . 0.431 ' HB2' HG22 ' B' ' 125' ' ' VAL . . . -60.68 -49.75 76.27 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 117.09 2.255 . . . . 69.34 117.09 -164.535 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . . . -63.4 -44.61 94.16 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.234 -0.654 . . . . 69.2 109.234 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -52.48 -60.66 2.96 Favored 'General case' 0 C--O 1.248 1.003 0 N-CA-C 109.021 -0.733 . . . . 72.23 109.021 172.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' ALA . . . . . . . . . . . . . . . -47.71 -50.42 25.15 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.448 -1.251 . . . . 65.73 114.128 -178.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' TRP . . . . . . . . . . . . . 35.2 m95 -62.87 -37.43 86.83 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 113.022 0.749 . . . . 62.46 113.022 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -59.45 -50.98 71.86 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 108.418 -0.956 . . . . 72.09 108.418 -178.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . 41.3 t -56.37 -54.03 33.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 108.629 -0.878 . . . . 61.17 108.629 176.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -44.79 -59.53 2.48 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 124.15 0.907 . . . . 60.42 110.952 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' VAL . . . . . 0.659 HG21 HD11 ' B' ' 115' ' ' ILE . 49.0 t -55.37 -48.0 77.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.933 -0.576 . . . . 61.91 112.166 178.447 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' GLY . . . . . . . . . . . . . . . -51.59 -48.18 50.13 Favored Glycine 0 N--CA 1.464 0.564 0 N-CA-C 108.369 -1.892 . . . . 64.37 108.369 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -58.76 -57.11 14.49 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.576 -0.812 . . . . 71.66 112.679 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 15.5 mt -43.56 -49.35 1.59 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 N-CA-C 108.314 -0.995 . . . . 68.21 108.314 175.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' CYS . . . . . . . . . . . . . 61.7 m -76.96 -32.14 57.07 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 115.141 1.534 . . . . 72.28 115.141 -173.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . . . -50.59 -58.77 5.05 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 106.568 -1.641 . . . . 73.25 106.568 166.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' THR . . . . . 0.429 ' HB ' HG21 ' B' ' 90' ' ' ILE . 2.2 m -50.55 -54.0 25.89 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 115.339 1.607 . . . . 75.63 115.339 -176.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.977 ' O ' ' HG3' ' B' ' 147' ' ' MET . 4.5 pp -79.69 -23.44 42.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.602 0.593 . . . . 79.92 112.602 -172.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' GLY . . . . . 0.459 ' N ' HD12 ' B' ' 143' ' ' LEU . . . -68.68 -51.96 27.7 Favored Glycine 0 C--O 1.243 0.666 0 N-CA-C 107.451 -2.259 . . . . 82.14 107.451 176.066 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -59.28 -41.02 87.92 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 109.165 -0.68 . . . . 85.47 109.165 -178.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.472 ' C ' ' H ' ' B' ' 148' ' ' LYS . 20.0 t80 -65.03 -36.68 85.16 Favored 'General case' 0 C--O 1.201 -1.452 0 N-CA-C 113.686 0.995 . . . . 88.43 113.686 178.774 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' MET . . . . . 0.977 ' HG3' ' O ' ' B' ' 143' ' ' LEU . 70.2 mtp -71.66 5.35 2.51 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 122.017 0.913 . . . . 92.85 109.627 -171.625 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.472 ' H ' ' C ' ' B' ' 146' ' ' TYR . . . -62.26 -11.55 15.58 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 104.333 -2.469 . . . . 96.17 104.333 176.464 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' GLU . . . . . 0.467 ' N ' ' C ' ' B' ' 147' ' ' MET . . . -58.23 138.7 56.1 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.289 -1.374 . . . . 98.52 107.289 175.466 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' LEU . . . . . 1.053 ' N ' HD23 ' B' ' 150' ' ' LEU . 0.0 OUTLIER -67.5 158.51 31.74 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 120.289 3.441 . . . . 100.08 120.289 -169.494 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' SER . . . . . 0.434 ' O ' ' O ' ' B' ' 150' ' ' LEU . . . . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.952 -0.567 . . . . 100.17 109.557 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 500' ' ' HEM . . . . . 1.173 HBB2 ' HHC' ' A' ' 500' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 500' ' ' HEM . . . . . 1.084 HBB2 ' HE1' ' B' ' 69' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_