data_6sr2_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6sr2 _Structure_validation_residue.Date_analyzed 2020-04-17 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 303' ' ' HOH . 85.2 tttt . . . . . 0 N--CA 1.508 2.46 0 CA-C-O 117.88 -1.057 . . . . 25.579999999999998 110.191 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.0 t -96.8 116.81 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 N-CA-C 107.417 -1.327 . . . . 25.670000000000002 107.417 168.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -88.37 143.08 27.22 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.237 1.415 . . . . 25.32 109.905 -173.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.62 155.1 51.96 Favored Glycine 0 C--O 1.269 2.309 0 N-CA-C 109.879 -1.288 . . . . 26.48 109.879 162.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.9 ttp85 -54.14 -59.27 4.88 Favored 'General case' 0 C--O 1.264 1.865 0 C-N-CA 125.129 1.372 . . . . 27.559999999999999 110.543 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . 0.901 ' SG ' ' CB ' ' A' ' 6' ' ' CYS . 75.4 m -61.42 -44.46 97.1 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.008 0.923 . . . . 22.609999999999999 110.303 -179.592 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -58.02 -46.05 85.91 Favored 'General case' 0 C--O 1.266 1.972 0 O-C-N 124.671 1.232 . . . . 27.93 110.281 -178.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.5 tp -67.54 -43.25 81.21 Favored 'General case' 0 C--O 1.266 1.944 0 CA-C-O 117.2 -1.381 . . . . 21.859999999999999 109.442 -179.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.97 -49.51 75.49 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 124.395 1.059 . . . . 20.550000000000001 109.69 -177.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.97 -39.59 86.2 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 116.972 -1.49 . . . . 24.559999999999999 110.381 179.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.11 -47.08 60.09 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 125.637 1.575 . . . . 24.460000000000001 111.446 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 30.1 mtt -60.7 -43.17 98.11 Favored 'General case' 0 C--O 1.259 1.597 0 CA-C-O 118.514 -0.755 . . . . 23.399999999999999 109.287 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -64.38 -37.14 86.46 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 117.605 -1.188 . . . . 39.780000000000001 110.18 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . 0.427 ' NH1' ' O ' ' A' ' 305' ' ' HOH . 12.3 ttp-105 -74.27 -30.41 62.1 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 117.315 -1.326 . . . . 36.07 110.835 -179.821 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -86.56 14.43 6.89 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 117.343 -1.313 . . . . 28.719999999999999 111.699 174.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.01 11.88 80.52 Favored Glycine 0 N--CA 1.481 1.636 0 CA-C-O 117.968 -1.462 . . . . 27.489999999999998 114.029 165.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.71 -15.9 59.65 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 116.714 -1.612 . . . . 34.280000000000001 111.018 -168.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -73.73 110.61 8.15 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 126.338 1.855 . . . . 39.119999999999997 110.563 -171.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 34.3 m120 75.59 18.91 2.16 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 126.983 2.113 . . . . 50.289999999999999 111.605 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -66.43 119.87 12.37 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.673 -0.862 . . . . 31.879999999999999 108.673 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 60.43 29.66 19.18 Favored 'General case' 0 C--O 1.262 1.713 0 C-N-CA 125.609 1.564 . . . . 40.75 110.42 -176.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.68 4.53 90.24 Favored Glycine 0 C--O 1.257 1.538 0 CA-C-O 117.184 -1.898 . . . . 25.57 113.57 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . 0.853 ' C ' ' O ' ' A' ' 24' ' ' SER . 92.1 m-85 -90.06 105.96 18.16 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 119.747 1.773 . . . . 19.850000000000001 109.976 179.992 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . 1.17 ' O ' ' C ' ' A' ' 24' ' ' SER . 62.1 p -52.51 159.6 1.0 Allowed 'General case' 1 C--O 1.825 31.376 1 CA-C-O 97.463 -10.78 . . . . 19.829999999999998 109.781 177.924 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 20.7 tp -59.05 -33.55 70.9 Favored 'General case' 0 N--CA 1.492 1.668 1 O-C-N 139.974 10.796 . . . . 23.43 111.086 -176.732 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.68 -40.81 98.52 Favored Glycine 0 C--O 1.269 2.329 0 CA-C-O 118.52 -1.156 . . . . 20.77 113.789 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -53.44 -39.29 64.29 Favored 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 124.953 1.301 . . . . 22.050000000000001 111.771 175.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -77.07 -44.36 30.94 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 126.443 1.897 . . . . 21.93 111.555 -175.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 93.5 t -65.65 -46.56 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.049 0 N-CA-C 107.91 -1.144 . . . . 20.030000000000001 107.91 176.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' CYS . . . . . 0.945 ' SG ' ' CB ' ' A' ' 30' ' ' CYS . 1.7 t -42.0 -59.56 1.69 Allowed 'General case' 0 C--O 1.262 1.715 0 C-N-CA 125.433 1.493 . . . . 19.789999999999999 110.857 169.664 -149.069 -92.604 -89.706 75.078 2.985 75.324 -77.792 -38.668 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -57.94 -49.1 77.93 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 125.024 1.33 . . . . 18.920000000000002 111.47 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.42 -46.69 85.99 Favored 'General case' 0 C--O 1.27 2.169 0 C-N-CA 123.956 0.902 . . . . 20.579999999999998 111.011 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -50.78 -54.77 20.74 Favored 'General case' 0 C--O 1.262 1.76 0 CA-C-O 118.826 -0.607 . . . . 19.890000000000001 110.751 177.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -82.62 -22.76 34.62 Favored 'General case' 0 C--O 1.269 2.084 0 CA-C-O 117.384 -1.293 . . . . 23.359999999999999 110.888 -171.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -78.34 -44.5 25.0 Favored 'General case' 0 C--O 1.283 2.868 0 CA-C-N 120.103 1.319 . . . . 25.27 111.494 176.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 97.0 p -129.78 -10.97 4.4 Favored 'General case' 0 C--O 1.267 1.985 0 CA-C-O 116.934 -1.508 . . . . 23.84 113.699 -169.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 55.7 t30 58.66 40.77 23.04 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.467 1.031 . . . . 26.219999999999999 109.17 -166.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 66.02 21.1 11.29 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 125.738 1.615 . . . . 21.260000000000002 111.62 175.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -105.93 111.02 23.49 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 117.513 -1.232 . . . . 20.469999999999999 108.576 -173.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 43.3 p -59.3 -25.82 64.46 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 117.314 -1.327 . . . . 24.010000000000002 111.284 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -92.35 2.47 56.63 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 119.658 1.117 . . . . 24.239999999999998 111.716 -171.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.15 133.88 55.82 Favored 'General case' 0 C--O 1.263 1.793 0 CA-C-N 120.553 1.524 . . . . 20.329999999999998 110.517 -175.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.4 p -130.42 145.93 51.9 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.577 1.151 . . . . 19.199999999999999 109.385 170.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -145.58 119.95 9.63 Favored 'General case' 0 C--O 1.271 2.204 0 C-N-CA 125.465 1.506 . . . . 26.329999999999998 108.299 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.7 132.8 35.6 Favored 'General case' 0 C--O 1.269 2.11 0 O-C-N 125.476 1.735 . . . . 35.18 107.373 179.604 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -94.09 156.88 16.35 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 124.618 1.199 . . . . 27.57 108.926 171.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 45.8 p -63.03 -22.4 66.83 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 117.109 -1.424 . . . . 35.009999999999998 111.413 -176.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 50.8 p30 -83.27 -6.37 59.45 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 120.084 1.311 . . . . 32.469999999999999 111.631 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.24 -21.88 32.31 Favored Glycine 0 N--CA 1.481 1.673 0 CA-C-O 117.067 -1.963 . . . . 30.920000000000002 112.812 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.5 p -65.17 163.03 15.9 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 125.035 1.334 . . . . 25.640000000000001 109.643 171.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.4 m -133.3 143.41 49.02 Favored 'General case' 0 C--O 1.266 1.962 0 C-N-CA 126.279 1.832 . . . . 20.550000000000001 109.078 179.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -95.84 139.8 31.53 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 124.812 1.32 . . . . 24.469999999999999 109.274 171.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -128.46 135.96 50.18 Favored 'General case' 0 C--O 1.269 2.098 0 C-N-CA 125.07 1.348 . . . . 20.079999999999998 111.984 -170.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 73.72 -164.79 54.83 Favored Glycine 0 C--O 1.269 2.291 0 C-N-CA 125.043 1.306 . . . . 20.050000000000001 114.783 166.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.7 tt -64.89 -34.9 73.48 Favored 'Isoleucine or valine' 0 C--O 1.286 2.994 0 C-N-CA 124.771 1.229 . . . . 24.510000000000002 109.859 -162.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . 0.663 ' O ' ' CD1' ' A' ' 108' ' ' TRP . 67.2 mt -107.65 18.44 21.41 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 118.377 -0.821 . . . . 20.460000000000001 111.112 174.435 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 48.56 54.68 10.16 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 117.439 -1.267 . . . . 20.66 109.767 164.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 85.2 mt -78.63 130.49 36.09 Favored 'Isoleucine or valine' 0 C--O 1.272 2.287 0 C-N-CA 126.206 1.802 . . . . 22.59 109.798 -176.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -86.9 134.36 33.53 Favored 'General case' 0 C--O 1.263 1.805 0 O-C-N 124.484 1.115 . . . . 30.420000000000002 109.328 -162.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 60.3 p -68.34 -17.01 64.15 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 126.321 1.849 . . . . 22.170000000000002 112.023 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 21.0 tpp180 -61.23 -45.63 93.74 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-O 117.055 -1.45 . . . . 39.75 109.901 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -112.7 -36.04 5.31 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 116.802 -1.57 . . . . 27.25 112.741 -173.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -107.61 -27.96 10.04 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 117.12 -1.419 . . . . 23.309999999999999 114.039 -153.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' CYS . . . . . 0.957 ' SG ' ' CB ' ' A' ' 64' ' ' CYS . 13.4 p -150.1 173.67 13.62 Favored 'General case' 0 C--O 1.263 1.803 0 CA-C-N 120.532 1.515 . . . . 20.940000000000001 113.025 174.229 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -112.66 115.78 29.12 Favored 'General case' 0 C--O 1.269 2.116 0 C-N-CA 125.093 1.357 . . . . 22.02 110.526 -169.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.7 p30 -115.04 4.18 14.64 Favored 'General case' 0 C--O 1.27 2.172 0 C-N-CA 125.085 1.354 . . . . 20.77 110.94 175.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.81 17.0 76.49 Favored Glycine 0 C--O 1.258 1.64 0 C-N-CA 125.873 1.702 . . . . 23.510000000000002 113.559 171.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -146.94 22.62 1.23 Allowed 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 117.679 -1.153 . . . . 33.700000000000003 111.565 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . 0.522 ' N ' 'CL ' ' A' ' 208' ' ' ' CL' . 5.9 m -123.67 81.87 54.55 Favored Pre-proline 0 N--CA 1.487 1.419 0 N-CA-C 106.98 -1.489 . . . . 30.16 106.98 178.845 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.86 137.17 80.45 Favored 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 122.504 2.136 . . . . 40.68 114.99 -169.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 54.56 42.34 76.09 Favored Glycine 0 N--CA 1.476 1.314 0 CA-C-O 117.984 -1.453 . . . . 40.740000000000002 111.63 179.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 85.9 p -106.58 160.94 15.06 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.328 1.851 . . . . 41.149999999999999 109.654 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 49.4 mmm-85 -98.98 157.25 16.46 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 124.309 1.006 . . . . 47.32 109.17 -178.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -125.75 69.56 1.18 Allowed 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.394 -0.965 . . . . 32.380000000000003 108.394 173.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.6 mt -73.13 -13.61 61.22 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 117.124 -1.417 . . . . 30.809999999999999 111.978 -169.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' CYS . . . . . 0.923 ' SG ' ' SG ' ' A' ' 94' ' ' CYS . 59.4 m -86.55 -14.59 42.47 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 117.383 -1.294 . . . . 31.550000000000001 111.905 169.847 -74.223 167.199 83.482 91.661 2.664 87.935 44.246 -178.211 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 32.7 m120 53.08 54.1 10.92 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 126.161 1.784 . . . . 34.780000000000001 110.592 -173.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 10.6 pt -141.59 148.16 48.92 Favored Pre-proline 0 N--CA 1.5 2.051 0 C-N-CA 123.929 0.891 . . . . 25.850000000000001 110.361 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -62.44 141.5 87.09 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 N-CA-C 108.337 -1.447 . . . . 23.129999999999999 108.337 160.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . 1.15 ' CB ' ' SG ' ' A' ' 80' ' ' CYS . 39.0 m -58.39 -37.54 75.5 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 125.63 1.572 . . . . 20.190000000000001 110.625 176.227 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 53.1 p -49.53 -27.16 4.07 Favored 'General case' 0 C--O 1.261 1.71 0 CA-C-O 116.725 -1.607 . . . . 20.640000000000001 111.381 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.72 -24.83 59.96 Favored 'General case' 0 C--O 1.269 2.105 0 CA-C-N 119.918 1.235 . . . . 18.989999999999998 111.459 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.82 -2.83 31.86 Favored 'General case' 0 C--O 1.273 2.332 0 C-N-CA 126.489 1.916 . . . . 21.52 111.399 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 63.3 mt -102.95 0.15 31.84 Favored 'General case' 0 C--O 1.27 2.146 0 CA-C-O 118.121 -0.942 . . . . 27.210000000000001 110.731 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 40.9 t -68.44 153.65 43.36 Favored 'General case' 0 C--O 1.263 1.788 0 CA-C-O 118.349 -0.834 . . . . 27.760000000000002 109.563 -172.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.1 p -60.33 -21.93 62.61 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.606 1.162 . . . . 29.25 110.077 167.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -93.47 117.88 30.63 Favored 'General case' 0 C--O 1.265 1.912 0 C-N-CA 125.967 1.707 . . . . 29.050000000000001 109.49 175.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 28.7 pt -90.46 3.85 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 CA-C-O 116.89 -1.529 . . . . 24.32 110.163 -167.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 48.0 m -49.86 -57.47 7.35 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.427 1.491 . . . . 27.359999999999999 108.077 -177.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.9 -50.42 68.83 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.874 1.269 . . . . 26.780000000000001 109.377 -177.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 25.7 m -60.58 -40.05 90.28 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 125.098 1.359 . . . . 24.129999999999999 111.094 -177.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 85.7 t -69.57 -49.34 59.84 Favored 'Isoleucine or valine' 0 C--O 1.265 1.912 0 C-N-CA 124.864 1.266 . . . . 29.629999999999999 110.315 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -63.09 -39.78 95.73 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 124.39 1.076 . . . . 28.739999999999998 109.235 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . 0.923 ' SG ' ' SG ' ' A' ' 76' ' ' CYS . 51.3 t -64.65 -42.91 95.09 Favored 'General case' 0 C--O 1.266 1.964 0 C-N-CA 125.693 1.597 . . . . 26.010000000000002 110.347 177.63 -178.211 44.246 83.482 87.935 2.664 91.661 167.199 -74.223 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.5 -38.34 89.46 Favored 'General case' 0 C--O 1.254 1.337 0 C-N-CA 125.31 1.444 . . . . 22.379999999999999 110.645 178.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -56.41 -39.35 72.9 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 118.23 -0.89 . . . . 25.760000000000002 109.807 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 24.9 mtpt -70.02 -46.13 65.72 Favored 'General case' 0 C--O 1.254 1.312 0 O-C-N 124.524 1.14 . . . . 33.539999999999999 110.225 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.96 -51.97 67.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 CA-C-O 117.436 -1.268 . . . . 23.440000000000001 109.866 -176.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 5.8 p -70.48 -20.88 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 C-N-CA 125.121 1.368 . . . . 24.899999999999999 109.058 -171.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 58.7 m -81.64 -6.46 59.03 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 116.915 -1.517 . . . . 33.670000000000002 111.984 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -90.21 -4.35 57.27 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 117.319 -1.324 . . . . 34.479999999999997 113.054 -156.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 133.42 -34.19 2.46 Favored Glycine 0 N--CA 1.474 1.186 0 CA-C-O 117.272 -1.849 . . . . 34.799999999999997 112.522 174.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -100.8 1.2 39.96 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 117.172 -1.395 . . . . 43.409999999999997 112.643 -173.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 55.26 -134.55 48.45 Favored Glycine 0 C--O 1.262 1.891 0 CA-C-O 117.457 -1.746 . . . . 25.27 112.448 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 60.1 mtp -93.18 1.93 56.9 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 118.755 1.278 . . . . 20.190000000000001 110.688 -170.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 -64.47 -22.33 66.93 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 125.814 1.646 . . . . 18.370000000000001 110.006 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.45 -22.93 35.39 Favored 'General case' 0 C--O 1.271 2.209 0 C-N-CA 124.345 1.058 . . . . 19.510000000000002 109.785 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . 1.337 ' CD1' ' CE2' ' A' ' 108' ' ' TRP . 24.8 m-90 -100.48 106.38 17.93 Favored 'General case' 0 C--O 1.272 2.261 0 C-N-CA 125.114 1.366 . . . . 24.039999999999999 109.42 176.953 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 49.8 t -62.5 -35.13 68.49 Favored 'Isoleucine or valine' 0 C--O 1.279 2.643 0 C-N-CA 125.64 1.576 . . . . 21.719999999999999 110.945 -171.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -76.26 -30.29 57.79 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.544 1.537 . . . . 20.91 111.731 -179.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 85.2 t90 -65.64 -48.32 72.59 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 123.78 0.832 . . . . 24.75 109.502 170.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -57.52 -43.98 84.7 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-O 117.681 -1.152 . . . . 36.759999999999998 110.55 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -94.0 -17.83 22.51 Favored 'General case' 0 C--O 1.288 3.131 0 C-N-CA 124.787 1.235 . . . . 21.620000000000001 111.818 -167.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -131.02 -10.26 3.81 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 116.056 -1.926 . . . . 23.23 114.374 -171.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' CYS . . . . . 1.077 ' SG ' ' CB ' ' A' ' 115' ' ' CYS . 3.6 m -125.78 -48.76 1.64 Allowed 'General case' 0 C--O 1.264 1.845 0 CA-C-N 121.161 1.8 . . . . 21.390000000000001 112.128 -176.523 -38.668 -77.792 -89.706 75.324 2.985 75.078 -92.604 -149.069 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -44.85 124.48 4.41 Favored 'General case' 0 C--O 1.253 1.246 0 O-C-N 124.417 1.073 . . . . 24.989999999999998 108.434 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 80.9 5.17 90.28 Favored Glycine 0 N--CA 1.479 1.526 0 CA-C-O 117.091 -1.95 . . . . 26.440000000000001 114.198 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 26.2 p -103.14 168.88 8.89 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 119.225 1.512 . . . . 25.969999999999999 110.179 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -68.8 82.66 0.29 Allowed 'General case' 0 C--O 1.263 1.815 0 O-C-N 124.914 1.384 . . . . 30.219999999999999 108.654 170.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 10.8 m -70.77 -34.9 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 CA-C-O 117.972 -1.013 . . . . 23.600000000000001 110.652 -174.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 20.3 tm0? -51.92 -30.62 25.11 Favored 'General case' 0 C--O 1.268 2.052 0 C-N-CA 124.777 1.231 . . . . 26.379999999999999 111.231 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -46.02 -34.24 3.93 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 115.468 -2.206 . . . . 21.640000000000001 111.125 174.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . 0.444 ' NE1' ' SG ' ' A' ' 30' ' ' CYS . 92.8 m95 -72.43 -21.72 61.21 Favored 'General case' 0 N--CA 1.504 2.225 0 C-N-CA 126.864 2.066 . . . . 27.120000000000001 112.94 -173.131 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 30.0 pt -108.49 9.45 9.16 Favored 'Isoleucine or valine' 0 C--O 1.277 2.535 0 CA-C-O 117.815 -1.088 . . . . 30.300000000000001 110.24 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -71.53 127.65 33.26 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.767 -1.197 . . . . 35.259999999999998 107.767 -172.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 98.57 -22.51 40.58 Favored Glycine 0 C--O 1.267 2.165 0 CA-C-O 117.501 -1.721 . . . . 30.079999999999998 113.7 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' CYS . . . . . 1.142 ' CB ' ' SG ' ' A' ' 127' ' ' CYS . 1.9 m -68.87 145.88 53.31 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.921 1.288 . . . . 29.309999999999999 110.385 177.49 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 58.5 mtp85 . . . . . 0 N--CA 1.484 1.23 0 O-C-N 124.776 1.297 . . . . 39.299999999999997 109.057 176.92 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' GD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' GD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' DO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' DO3 . . . . . 0.408 ' C9 ' ' O ' ' A' ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' ' CL' . . . . . 0.522 'CL ' ' N ' ' A' ' 69' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . 0.482 ' O ' ' N ' ' A' ' 1' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . 0.427 ' O ' ' NH1' ' A' ' 14' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . 0.408 ' O ' ' C9 ' ' A' ' 204' ' ' DO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 85.2 tttt . . . . . 0 N--CA 1.508 2.46 0 CA-C-O 117.88 -1.057 . . . . 25.58 110.191 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.0 t -96.8 116.81 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 N-CA-C 107.417 -1.327 . . . . 25.67 107.417 168.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -88.37 143.08 27.22 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.237 1.415 . . . . 25.32 109.905 -173.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.62 155.1 51.96 Favored Glycine 0 C--O 1.269 2.309 0 N-CA-C 109.879 -1.288 . . . . 26.48 109.879 162.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.9 ttp85 -54.14 -59.27 4.88 Favored 'General case' 0 C--O 1.264 1.865 0 C-N-CA 125.129 1.372 . . . . 27.56 110.543 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . 0.901 ' SG ' ' CB ' ' A' ' 6' ' ' CYS . 75.4 m -61.42 -44.46 97.1 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.008 0.923 . . . . 22.61 110.303 -179.592 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -58.02 -46.05 85.91 Favored 'General case' 0 C--O 1.266 1.972 0 O-C-N 124.671 1.232 . . . . 27.93 110.281 -178.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.5 tp -67.54 -43.25 81.21 Favored 'General case' 0 C--O 1.266 1.944 0 CA-C-O 117.2 -1.381 . . . . 21.86 109.442 -179.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.97 -49.51 75.49 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 124.395 1.059 . . . . 20.55 109.69 -177.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.97 -39.59 86.2 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 116.972 -1.49 . . . . 24.56 110.381 179.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.11 -47.08 60.09 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 125.637 1.575 . . . . 24.46 111.446 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 30.1 mtt -60.7 -43.17 98.11 Favored 'General case' 0 C--O 1.259 1.597 0 CA-C-O 118.514 -0.755 . . . . 23.4 109.287 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -64.38 -37.14 86.46 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 117.605 -1.188 . . . . 39.78 110.18 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.3 ttp-105 -74.27 -30.41 62.1 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 117.315 -1.326 . . . . 36.07 110.835 -179.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . 0.442 ' HB3' HG11 ' A' ' 92' ' ' VAL . 45.2 m80 -86.56 14.43 6.89 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 117.343 -1.313 . . . . 28.72 111.699 174.676 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.01 11.88 80.52 Favored Glycine 0 N--CA 1.481 1.636 0 CA-C-O 117.968 -1.462 . . . . 27.49 114.029 165.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 17' ' ' LEU . 6.0 tp -76.71 -15.9 59.65 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 116.714 -1.612 . . . . 34.28 111.018 -168.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -73.73 110.61 8.15 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 126.338 1.855 . . . . 39.12 110.563 -171.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 34.3 m120 75.59 18.91 2.16 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 126.983 2.113 . . . . 50.29 111.605 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -66.43 119.87 12.37 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.673 -0.862 . . . . 31.88 108.673 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 60.43 29.66 19.18 Favored 'General case' 0 C--O 1.262 1.713 0 C-N-CA 125.609 1.564 . . . . 40.75 110.42 -176.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.68 4.53 90.24 Favored Glycine 0 C--O 1.257 1.538 0 CA-C-O 117.184 -1.898 . . . . 25.57 113.57 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . 0.853 ' C ' ' O ' ' A' ' 24' ' ' SER . 92.1 m-85 -90.06 105.96 18.16 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 119.747 1.773 . . . . 19.85 109.976 179.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . 1.17 ' C ' ' O ' ' A' ' 24' ' ' SER . 62.1 p -52.51 159.6 1.0 Allowed 'General case' 1 C--O 1.825 31.376 1 CA-C-O 97.463 -10.78 . . . . 19.83 109.781 177.924 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 20.7 tp -59.05 -33.55 70.9 Favored 'General case' 0 N--CA 1.492 1.668 1 O-C-N 139.974 10.796 . . . . 23.43 111.086 -176.732 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . 0.464 ' O ' ' HB2' ' A' ' 30' ' ' CYS . . . -60.68 -40.81 98.52 Favored Glycine 0 C--O 1.269 2.329 0 CA-C-O 118.52 -1.156 . . . . 20.77 113.789 179.015 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -53.44 -39.29 64.29 Favored 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 124.953 1.301 . . . . 22.05 111.771 175.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -77.07 -44.36 30.94 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 126.443 1.897 . . . . 21.93 111.555 -175.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 93.5 t -65.65 -46.56 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.049 0 N-CA-C 107.91 -1.144 . . . . 20.03 107.91 176.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' CYS . . . . . 0.945 ' CB ' ' SG ' ' A' ' 30' ' ' CYS . 1.7 t -42.0 -59.56 1.69 Allowed 'General case' 0 C--O 1.262 1.715 0 C-N-CA 125.433 1.493 . . . . 19.79 110.857 169.664 -149.069 -92.604 -89.706 75.078 2.985 75.324 -77.792 -38.668 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -57.94 -49.1 77.93 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 125.024 1.33 . . . . 18.92 111.47 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.42 -46.69 85.99 Favored 'General case' 0 C--O 1.27 2.169 0 C-N-CA 123.956 0.902 . . . . 20.58 111.011 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -50.78 -54.77 20.74 Favored 'General case' 0 C--O 1.262 1.76 0 CA-C-O 118.826 -0.607 . . . . 19.89 110.751 177.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -82.62 -22.76 34.62 Favored 'General case' 0 C--O 1.269 2.084 0 CA-C-O 117.384 -1.293 . . . . 23.36 110.888 -171.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -78.34 -44.5 25.0 Favored 'General case' 0 C--O 1.283 2.868 0 CA-C-N 120.103 1.319 . . . . 25.27 111.494 176.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 97.0 p -129.78 -10.97 4.4 Favored 'General case' 0 C--O 1.267 1.985 0 CA-C-O 116.934 -1.508 . . . . 23.84 113.699 -169.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 55.7 t30 58.66 40.77 23.04 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.467 1.031 . . . . 26.22 109.17 -166.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 66.02 21.1 11.29 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 125.738 1.615 . . . . 21.26 111.62 175.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -105.93 111.02 23.49 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 117.513 -1.232 . . . . 20.47 108.576 -173.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.505 ' O ' ' HA2' ' A' ' 54' ' ' GLY . 43.3 p -59.3 -25.82 64.46 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 117.314 -1.327 . . . . 24.01 111.284 -179.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -92.35 2.47 56.63 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 119.658 1.117 . . . . 24.24 111.716 -171.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.15 133.88 55.82 Favored 'General case' 0 C--O 1.263 1.793 0 CA-C-N 120.553 1.524 . . . . 20.33 110.517 -175.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.4 p -130.42 145.93 51.9 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.577 1.151 . . . . 19.2 109.385 170.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -145.58 119.95 9.63 Favored 'General case' 0 C--O 1.271 2.204 0 C-N-CA 125.465 1.506 . . . . 26.33 108.299 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.7 132.8 35.6 Favored 'General case' 0 C--O 1.269 2.11 0 O-C-N 125.476 1.735 . . . . 35.18 107.373 179.604 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -94.09 156.88 16.35 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 124.618 1.199 . . . . 27.57 108.926 171.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 45.8 p -63.03 -22.4 66.83 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 117.109 -1.424 . . . . 35.01 111.413 -176.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 50.8 p30 -83.27 -6.37 59.45 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 120.084 1.311 . . . . 32.47 111.631 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.24 -21.88 32.31 Favored Glycine 0 N--CA 1.481 1.673 0 CA-C-O 117.067 -1.963 . . . . 30.92 112.812 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.5 p -65.17 163.03 15.9 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 125.035 1.334 . . . . 25.64 109.643 171.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.4 m -133.3 143.41 49.02 Favored 'General case' 0 C--O 1.266 1.962 0 C-N-CA 126.279 1.832 . . . . 20.55 109.078 179.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -95.84 139.8 31.53 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 124.812 1.32 . . . . 24.47 109.274 171.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -128.46 135.96 50.18 Favored 'General case' 0 C--O 1.269 2.098 0 C-N-CA 125.07 1.348 . . . . 20.08 111.984 -170.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . 0.505 ' HA2' ' O ' ' A' ' 40' ' ' THR . . . 73.72 -164.79 54.83 Favored Glycine 0 C--O 1.269 2.291 0 C-N-CA 125.043 1.306 . . . . 20.05 114.783 166.395 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.7 tt -64.89 -34.9 73.48 Favored 'Isoleucine or valine' 0 C--O 1.286 2.994 0 C-N-CA 124.771 1.229 . . . . 24.51 109.859 -162.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . 0.663 ' O ' ' CD1' ' A' ' 108' ' ' TRP . 67.2 mt -107.65 18.44 21.41 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 118.377 -0.821 . . . . 20.46 111.112 174.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 48.56 54.68 10.16 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 117.439 -1.267 . . . . 20.66 109.767 164.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . 0.649 HG21 ' SG ' ' A' ' 94' ' ' CYS . 85.2 mt -78.63 130.49 36.09 Favored 'Isoleucine or valine' 0 C--O 1.272 2.287 0 C-N-CA 126.206 1.802 . . . . 22.59 109.798 -176.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -86.9 134.36 33.53 Favored 'General case' 0 C--O 1.263 1.805 0 O-C-N 124.484 1.115 . . . . 30.42 109.328 -162.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 60.3 p -68.34 -17.01 64.15 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 126.321 1.849 . . . . 22.17 112.023 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . 0.443 ' O ' ' HB2' ' A' ' 72' ' ' SER . 21.0 tpp180 -61.23 -45.63 93.74 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-O 117.055 -1.45 . . . . 39.75 109.901 -177.862 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -112.7 -36.04 5.31 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 116.802 -1.57 . . . . 27.25 112.741 -173.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TRP . . . . . 0.508 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 69.1 m95 -107.61 -27.96 10.04 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 117.12 -1.419 . . . . 23.31 114.039 -153.13 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' CYS . . . . . 0.957 ' SG ' ' CB ' ' A' ' 64' ' ' CYS . 13.4 p -150.1 173.67 13.62 Favored 'General case' 0 C--O 1.263 1.803 0 CA-C-N 120.532 1.515 . . . . 20.94 113.025 174.229 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -112.66 115.78 29.12 Favored 'General case' 0 C--O 1.269 2.116 0 C-N-CA 125.093 1.357 . . . . 22.02 110.526 -169.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . 0.465 ' HB3' ' SG ' ' A' ' 80' ' ' CYS . 38.7 p30 -115.04 4.18 14.64 Favored 'General case' 0 C--O 1.27 2.172 0 C-N-CA 125.085 1.354 . . . . 20.77 110.94 175.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.81 17.0 76.49 Favored Glycine 0 C--O 1.258 1.64 0 C-N-CA 125.873 1.702 . . . . 23.51 113.559 171.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -146.94 22.62 1.23 Allowed 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 117.679 -1.153 . . . . 33.7 111.565 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.9 m -123.67 81.87 54.55 Favored Pre-proline 0 N--CA 1.487 1.419 0 N-CA-C 106.98 -1.489 . . . . 30.16 106.98 178.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.86 137.17 80.45 Favored 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 122.504 2.136 . . . . 40.68 114.99 -169.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 54.56 42.34 76.09 Favored Glycine 0 N--CA 1.476 1.314 0 CA-C-O 117.984 -1.453 . . . . 40.74 111.63 179.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' ARG . 85.9 p -106.58 160.94 15.06 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.328 1.851 . . . . 41.15 109.654 179.284 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 49.4 mmm-85 -98.98 157.25 16.46 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 124.309 1.006 . . . . 47.32 109.17 -178.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . 0.567 ' OD1' ' HA ' ' A' ' 64' ' ' CYS . 32.8 t30 -125.75 69.56 1.18 Allowed 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.394 -0.965 . . . . 32.38 108.394 173.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.6 mt -73.13 -13.61 61.22 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 117.124 -1.417 . . . . 30.81 111.978 -169.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' CYS . . . . . 0.862 ' SG ' ' CB ' ' A' ' 76' ' ' CYS . 59.4 m -86.55 -14.59 42.47 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 117.383 -1.294 . . . . 31.55 111.905 169.847 -74.223 167.199 83.482 91.661 2.664 87.935 44.246 -178.211 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 32.7 m120 53.08 54.1 10.92 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 126.161 1.784 . . . . 34.78 110.592 -173.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 10.6 pt -141.59 148.16 48.92 Favored Pre-proline 0 N--CA 1.5 2.051 0 C-N-CA 123.929 0.891 . . . . 25.85 110.361 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -62.44 141.5 87.09 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 N-CA-C 108.337 -1.447 . . . . 23.13 108.337 160.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . 1.15 ' SG ' ' CB ' ' A' ' 80' ' ' CYS . 39.0 m -58.39 -37.54 75.5 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 125.63 1.572 . . . . 20.19 110.625 176.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 53.1 p -49.53 -27.16 4.07 Favored 'General case' 0 C--O 1.261 1.71 0 CA-C-O 116.725 -1.607 . . . . 20.64 111.381 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.72 -24.83 59.96 Favored 'General case' 0 C--O 1.269 2.105 0 CA-C-N 119.918 1.235 . . . . 18.99 111.459 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.82 -2.83 31.86 Favored 'General case' 0 C--O 1.273 2.332 0 C-N-CA 126.489 1.916 . . . . 21.52 111.399 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 63.3 mt -102.95 0.15 31.84 Favored 'General case' 0 C--O 1.27 2.146 0 CA-C-O 118.121 -0.942 . . . . 27.21 110.731 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 40.9 t -68.44 153.65 43.36 Favored 'General case' 0 C--O 1.263 1.788 0 CA-C-O 118.349 -0.834 . . . . 27.76 109.563 -172.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.1 p -60.33 -21.93 62.61 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.606 1.162 . . . . 29.25 110.077 167.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -93.47 117.88 30.63 Favored 'General case' 0 C--O 1.265 1.912 0 C-N-CA 125.967 1.707 . . . . 29.05 109.49 175.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . 0.467 ' O ' HG23 ' A' ' 92' ' ' VAL . 28.7 pt -90.46 3.85 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 CA-C-O 116.89 -1.529 . . . . 24.32 110.163 -167.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 48.0 m -49.86 -57.47 7.35 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.427 1.491 . . . . 27.36 108.077 -177.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.9 -50.42 68.83 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.874 1.269 . . . . 26.78 109.377 -177.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 25.7 m -60.58 -40.05 90.28 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 125.098 1.359 . . . . 24.13 111.094 -177.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 88' ' ' ILE . 85.7 t -69.57 -49.34 59.84 Favored 'Isoleucine or valine' 0 C--O 1.265 1.912 0 C-N-CA 124.864 1.266 . . . . 29.63 110.315 -178.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -63.09 -39.78 95.73 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 124.39 1.076 . . . . 28.74 109.235 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . 0.915 ' SG ' ' CB ' ' A' ' 94' ' ' CYS . 51.3 t -64.65 -42.91 95.09 Favored 'General case' 0 C--O 1.266 1.964 0 C-N-CA 125.693 1.597 . . . . 26.01 110.347 177.63 -178.211 44.246 83.482 87.935 2.664 91.661 167.199 -74.223 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.5 -38.34 89.46 Favored 'General case' 0 C--O 1.254 1.337 0 C-N-CA 125.31 1.444 . . . . 22.38 110.645 178.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -56.41 -39.35 72.9 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 118.23 -0.89 . . . . 25.76 109.807 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 24.9 mtpt -70.02 -46.13 65.72 Favored 'General case' 0 C--O 1.254 1.312 0 O-C-N 124.524 1.14 . . . . 33.54 110.225 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . 0.438 HG12 ' CE2' ' A' ' 63' ' ' TRP . 69.5 mt -60.96 -51.97 67.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 CA-C-O 117.436 -1.268 . . . . 23.44 109.866 -176.592 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 5.8 p -70.48 -20.88 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 C-N-CA 125.121 1.368 . . . . 24.9 109.058 -171.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 58.7 m -81.64 -6.46 59.03 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 116.915 -1.517 . . . . 33.67 111.984 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -90.21 -4.35 57.27 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 117.319 -1.324 . . . . 34.48 113.054 -156.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 133.42 -34.19 2.46 Favored Glycine 0 N--CA 1.474 1.186 0 CA-C-O 117.272 -1.849 . . . . 34.8 112.522 174.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -100.8 1.2 39.96 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 117.172 -1.395 . . . . 43.41 112.643 -173.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 55.26 -134.55 48.45 Favored Glycine 0 C--O 1.262 1.891 0 CA-C-O 117.457 -1.746 . . . . 25.27 112.448 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 60.1 mtp -93.18 1.93 56.9 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 118.755 1.278 . . . . 20.19 110.688 -170.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 -64.47 -22.33 66.93 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 125.814 1.646 . . . . 18.37 110.006 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.45 -22.93 35.39 Favored 'General case' 0 C--O 1.271 2.209 0 C-N-CA 124.345 1.058 . . . . 19.51 109.785 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . 1.337 ' CD1' ' CE2' ' A' ' 108' ' ' TRP . 24.8 m-90 -100.48 106.38 17.93 Favored 'General case' 0 C--O 1.272 2.261 0 C-N-CA 125.114 1.366 . . . . 24.04 109.42 176.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 49.8 t -62.5 -35.13 68.49 Favored 'Isoleucine or valine' 0 C--O 1.279 2.643 0 C-N-CA 125.64 1.576 . . . . 21.72 110.945 -171.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -76.26 -30.29 57.79 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.544 1.537 . . . . 20.91 111.731 -179.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TRP . . . . . 0.428 ' HA ' ' SG ' ' A' ' 115' ' ' CYS . 85.2 t90 -65.64 -48.32 72.59 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 123.78 0.832 . . . . 24.75 109.502 170.702 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -57.52 -43.98 84.7 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-O 117.681 -1.152 . . . . 36.76 110.55 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -94.0 -17.83 22.51 Favored 'General case' 0 C--O 1.288 3.131 0 C-N-CA 124.787 1.235 . . . . 21.62 111.818 -167.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -131.02 -10.26 3.81 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 116.056 -1.926 . . . . 23.23 114.374 -171.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' CYS . . . . . 1.077 ' SG ' ' CB ' ' A' ' 115' ' ' CYS . 3.6 m -125.78 -48.76 1.64 Allowed 'General case' 0 C--O 1.264 1.845 0 CA-C-N 121.161 1.8 . . . . 21.39 112.128 -176.523 -38.668 -77.792 -89.706 75.324 2.985 75.078 -92.604 -149.069 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -44.85 124.48 4.41 Favored 'General case' 0 C--O 1.253 1.246 0 O-C-N 124.417 1.073 . . . . 24.99 108.434 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 80.9 5.17 90.28 Favored Glycine 0 N--CA 1.479 1.526 0 CA-C-O 117.091 -1.95 . . . . 26.44 114.198 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 26.2 p -103.14 168.88 8.89 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 119.225 1.512 . . . . 25.97 110.179 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -68.8 82.66 0.29 Allowed 'General case' 0 C--O 1.263 1.815 0 O-C-N 124.914 1.384 . . . . 30.22 108.654 170.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 10.8 m -70.77 -34.9 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 CA-C-O 117.972 -1.013 . . . . 23.6 110.652 -174.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 20.3 tm0? -51.92 -30.62 25.11 Favored 'General case' 0 C--O 1.268 2.052 0 C-N-CA 124.777 1.231 . . . . 26.38 111.231 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -46.02 -34.24 3.93 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 115.468 -2.206 . . . . 21.64 111.125 174.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . 0.435 ' NE1' ' SG ' ' A' ' 30' ' ' CYS . 92.8 m95 -72.43 -21.72 61.21 Favored 'General case' 0 N--CA 1.504 2.225 0 C-N-CA 126.864 2.066 . . . . 27.12 112.94 -173.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 30.0 pt -108.49 9.45 9.16 Favored 'Isoleucine or valine' 0 C--O 1.277 2.535 0 CA-C-O 117.815 -1.088 . . . . 30.3 110.24 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -71.53 127.65 33.26 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.767 -1.197 . . . . 35.26 107.767 -172.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 98.57 -22.51 40.58 Favored Glycine 0 C--O 1.267 2.165 0 CA-C-O 117.501 -1.721 . . . . 30.08 113.7 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' CYS . . . . . 1.142 ' SG ' ' CB ' ' A' ' 127' ' ' CYS . 1.9 m -68.87 145.88 53.31 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.921 1.288 . . . . 29.31 110.385 177.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 58.5 mtp85 . . . . . 0 N--CA 1.484 1.23 0 O-C-N 124.776 1.297 . . . . 39.3 109.057 176.92 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' GD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' GD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' DO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' DO3 . . . . . 0.475 ' O7 ' H101 ' A' ' 204' ' ' DO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . 0.408 ' O ' ' C9 ' ' A' ' 204' ' ' DO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 85.2 tttt . . . . . 0 N--CA 1.508 2.46 0 CA-C-O 117.88 -1.057 . . . . 25.58 110.191 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.0 t -96.8 116.81 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 N-CA-C 107.417 -1.327 . . . . 25.67 107.417 168.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -88.37 143.08 27.22 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.237 1.415 . . . . 25.32 109.905 -173.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.62 155.1 51.96 Favored Glycine 0 C--O 1.269 2.309 0 N-CA-C 109.879 -1.288 . . . . 26.48 109.879 162.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.9 ttp85 -54.14 -59.27 4.88 Favored 'General case' 0 C--O 1.264 1.865 0 C-N-CA 125.129 1.372 . . . . 27.56 110.543 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.901 ' SG ' ' CB ' ' A' ' 6' ' ' CYS . 75.4 m -61.42 -44.46 97.1 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.008 0.923 . . . . 22.61 110.303 -179.592 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -58.02 -46.05 85.91 Favored 'General case' 0 C--O 1.266 1.972 0 O-C-N 124.671 1.232 . . . . 27.93 110.281 -178.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.5 tp -67.54 -43.25 81.21 Favored 'General case' 0 C--O 1.266 1.944 0 CA-C-O 117.2 -1.381 . . . . 21.86 109.442 -179.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.97 -49.51 75.49 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 124.395 1.059 . . . . 20.55 109.69 -177.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.97 -39.59 86.2 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 116.972 -1.49 . . . . 24.56 110.381 179.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.11 -47.08 60.09 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 125.637 1.575 . . . . 24.46 111.446 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 30.1 mtt -60.7 -43.17 98.11 Favored 'General case' 0 C--O 1.259 1.597 0 CA-C-O 118.514 -0.755 . . . . 23.4 109.287 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -64.38 -37.14 86.46 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 117.605 -1.188 . . . . 39.78 110.18 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.3 ttp-105 -74.27 -30.41 62.1 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 117.315 -1.326 . . . . 36.07 110.835 -179.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.442 ' HB3' HG11 ' A' ' 92' ' ' VAL . 86.1 m-70 -86.56 14.43 6.89 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 117.343 -1.313 . . . . 28.72 111.699 174.676 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.01 11.88 80.52 Favored Glycine 0 N--CA 1.481 1.636 0 CA-C-O 117.968 -1.462 . . . . 27.49 114.029 165.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 17' ' ' LEU . 6.0 tp -76.71 -15.9 59.65 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 116.714 -1.612 . . . . 34.28 111.018 -168.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -73.73 110.61 8.15 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 126.338 1.855 . . . . 39.12 110.563 -171.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 34.3 m120 75.59 18.91 2.16 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 126.983 2.113 . . . . 50.29 111.605 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -66.43 119.87 12.37 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.673 -0.862 . . . . 31.88 108.673 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 60.43 29.66 19.18 Favored 'General case' 0 C--O 1.262 1.713 0 C-N-CA 125.609 1.564 . . . . 40.75 110.42 -176.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.68 4.53 90.24 Favored Glycine 0 C--O 1.257 1.538 0 CA-C-O 117.184 -1.898 . . . . 25.57 113.57 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.853 ' C ' ' O ' ' A' ' 24' ' ' SER . 92.1 m-85 -90.06 105.96 18.16 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 119.747 1.773 . . . . 19.85 109.976 179.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . 1.17 ' C ' ' O ' ' A' ' 24' ' ' SER . 62.1 p -52.51 159.6 1.0 Allowed 'General case' 1 C--O 1.825 31.376 1 CA-C-O 97.463 -10.78 . . . . 19.83 109.781 177.924 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 20.7 tp -59.05 -33.55 70.9 Favored 'General case' 0 N--CA 1.492 1.668 1 O-C-N 139.974 10.796 . . . . 23.43 111.086 -176.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.464 ' O ' ' HB2' ' A' ' 30' ' ' CYS . . . -60.68 -40.81 98.52 Favored Glycine 0 C--O 1.269 2.329 0 CA-C-O 118.52 -1.156 . . . . 20.77 113.789 179.015 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -53.44 -39.29 64.29 Favored 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 124.953 1.301 . . . . 22.05 111.771 175.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -77.07 -44.36 30.94 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 126.443 1.897 . . . . 21.93 111.555 -175.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 93.5 t -65.65 -46.56 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.049 0 N-CA-C 107.91 -1.144 . . . . 20.03 107.91 176.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.945 ' CB ' ' SG ' ' A' ' 30' ' ' CYS . 1.7 t -42.0 -59.56 1.69 Allowed 'General case' 0 C--O 1.262 1.715 0 C-N-CA 125.433 1.493 . . . . 19.79 110.857 169.664 -149.069 -92.604 -89.706 75.078 2.985 75.324 -77.792 -38.668 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -57.94 -49.1 77.93 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 125.024 1.33 . . . . 18.92 111.47 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.42 -46.69 85.99 Favored 'General case' 0 C--O 1.27 2.169 0 C-N-CA 123.956 0.902 . . . . 20.58 111.011 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -50.78 -54.77 20.74 Favored 'General case' 0 C--O 1.262 1.76 0 CA-C-O 118.826 -0.607 . . . . 19.89 110.751 177.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -82.62 -22.76 34.62 Favored 'General case' 0 C--O 1.269 2.084 0 CA-C-O 117.384 -1.293 . . . . 23.36 110.888 -171.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -78.34 -44.5 25.0 Favored 'General case' 0 C--O 1.283 2.868 0 CA-C-N 120.103 1.319 . . . . 25.27 111.494 176.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 97.0 p -129.78 -10.97 4.4 Favored 'General case' 0 C--O 1.267 1.985 0 CA-C-O 116.934 -1.508 . . . . 23.84 113.699 -169.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 55.7 t30 58.66 40.77 23.04 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.467 1.031 . . . . 26.22 109.17 -166.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 66.02 21.1 11.29 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 125.738 1.615 . . . . 21.26 111.62 175.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -105.93 111.02 23.49 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 117.513 -1.232 . . . . 20.47 108.576 -173.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.505 ' O ' ' HA2' ' A' ' 54' ' ' GLY . 43.3 p -59.3 -25.82 64.46 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 117.314 -1.327 . . . . 24.01 111.284 -179.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -92.35 2.47 56.63 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 119.658 1.117 . . . . 24.24 111.716 -171.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.15 133.88 55.82 Favored 'General case' 0 C--O 1.263 1.793 0 CA-C-N 120.553 1.524 . . . . 20.33 110.517 -175.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.4 p -130.42 145.93 51.9 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.577 1.151 . . . . 19.2 109.385 170.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -145.58 119.95 9.63 Favored 'General case' 0 C--O 1.271 2.204 0 C-N-CA 125.465 1.506 . . . . 26.33 108.299 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.7 132.8 35.6 Favored 'General case' 0 C--O 1.269 2.11 0 O-C-N 125.476 1.735 . . . . 35.18 107.373 179.604 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -94.09 156.88 16.35 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 124.618 1.199 . . . . 27.57 108.926 171.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 45.8 p -63.03 -22.4 66.83 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 117.109 -1.424 . . . . 35.01 111.413 -176.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 50.8 p30 -83.27 -6.37 59.45 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 120.084 1.311 . . . . 32.47 111.631 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.24 -21.88 32.31 Favored Glycine 0 N--CA 1.481 1.673 0 CA-C-O 117.067 -1.963 . . . . 30.92 112.812 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.5 p -65.17 163.03 15.9 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 125.035 1.334 . . . . 25.64 109.643 171.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.4 m -133.3 143.41 49.02 Favored 'General case' 0 C--O 1.266 1.962 0 C-N-CA 126.279 1.832 . . . . 20.55 109.078 179.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -95.84 139.8 31.53 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 124.812 1.32 . . . . 24.47 109.274 171.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -128.46 135.96 50.18 Favored 'General case' 0 C--O 1.269 2.098 0 C-N-CA 125.07 1.348 . . . . 20.08 111.984 -170.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.505 ' HA2' ' O ' ' A' ' 40' ' ' THR . . . 73.72 -164.79 54.83 Favored Glycine 0 C--O 1.269 2.291 0 C-N-CA 125.043 1.306 . . . . 20.05 114.783 166.395 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.7 tt -64.89 -34.9 73.48 Favored 'Isoleucine or valine' 0 C--O 1.286 2.994 0 C-N-CA 124.771 1.229 . . . . 24.51 109.859 -162.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.663 ' O ' ' CD1' ' A' ' 108' ' ' TRP . 67.2 mt -107.65 18.44 21.41 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 118.377 -0.821 . . . . 20.46 111.112 174.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 48.56 54.68 10.16 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 117.439 -1.267 . . . . 20.66 109.767 164.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.649 HG21 ' SG ' ' A' ' 94' ' ' CYS . 85.2 mt -78.63 130.49 36.09 Favored 'Isoleucine or valine' 0 C--O 1.272 2.287 0 C-N-CA 126.206 1.802 . . . . 22.59 109.798 -176.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -86.9 134.36 33.53 Favored 'General case' 0 C--O 1.263 1.805 0 O-C-N 124.484 1.115 . . . . 30.42 109.328 -162.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 60.3 p -68.34 -17.01 64.15 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 126.321 1.849 . . . . 22.17 112.023 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.443 ' O ' ' HB2' ' A' ' 72' ' ' SER . 21.0 tpp180 -61.23 -45.63 93.74 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-O 117.055 -1.45 . . . . 39.75 109.901 -177.862 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -112.7 -36.04 5.31 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 116.802 -1.57 . . . . 27.25 112.741 -173.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TRP . . . . . 0.508 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 69.1 m95 -107.61 -27.96 10.04 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 117.12 -1.419 . . . . 23.31 114.039 -153.13 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.957 ' SG ' ' CB ' ' A' ' 64' ' ' CYS . 13.4 p -150.1 173.67 13.62 Favored 'General case' 0 C--O 1.263 1.803 0 CA-C-N 120.532 1.515 . . . . 20.94 113.025 174.229 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -112.66 115.78 29.12 Favored 'General case' 0 C--O 1.269 2.116 0 C-N-CA 125.093 1.357 . . . . 22.02 110.526 -169.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.465 ' HB3' ' SG ' ' A' ' 80' ' ' CYS . 38.7 p30 -115.04 4.18 14.64 Favored 'General case' 0 C--O 1.27 2.172 0 C-N-CA 125.085 1.354 . . . . 20.77 110.94 175.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.81 17.0 76.49 Favored Glycine 0 C--O 1.258 1.64 0 C-N-CA 125.873 1.702 . . . . 23.51 113.559 171.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -146.94 22.62 1.23 Allowed 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 117.679 -1.153 . . . . 33.7 111.565 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.9 m -123.67 81.87 54.55 Favored Pre-proline 0 N--CA 1.487 1.419 0 N-CA-C 106.98 -1.489 . . . . 30.16 106.98 178.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.86 137.17 80.45 Favored 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 122.504 2.136 . . . . 40.68 114.99 -169.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 54.56 42.34 76.09 Favored Glycine 0 N--CA 1.476 1.314 0 CA-C-O 117.984 -1.453 . . . . 40.74 111.63 179.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' ARG . 85.9 p -106.58 160.94 15.06 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.328 1.851 . . . . 41.15 109.654 179.284 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 49.4 mmm-85 -98.98 157.25 16.46 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 124.309 1.006 . . . . 47.32 109.17 -178.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.567 ' OD1' ' HA ' ' A' ' 64' ' ' CYS . 32.8 t30 -125.75 69.56 1.18 Allowed 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.394 -0.965 . . . . 32.38 108.394 173.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.6 mt -73.13 -13.61 61.22 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 117.124 -1.417 . . . . 30.81 111.978 -169.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.862 ' SG ' ' CB ' ' A' ' 76' ' ' CYS . 59.4 m -86.55 -14.59 42.47 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 117.383 -1.294 . . . . 31.55 111.905 169.847 -74.223 167.199 83.482 91.661 2.664 87.935 44.246 -178.211 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 32.7 m120 53.08 54.1 10.92 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 126.161 1.784 . . . . 34.78 110.592 -173.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 10.6 pt -141.59 148.16 48.92 Favored Pre-proline 0 N--CA 1.5 2.051 0 C-N-CA 123.929 0.891 . . . . 25.85 110.361 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -62.44 141.5 87.09 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 N-CA-C 108.337 -1.447 . . . . 23.13 108.337 160.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . 1.15 ' SG ' ' CB ' ' A' ' 80' ' ' CYS . 39.0 m -58.39 -37.54 75.5 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 125.63 1.572 . . . . 20.19 110.625 176.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 53.1 p -49.53 -27.16 4.07 Favored 'General case' 0 C--O 1.261 1.71 0 CA-C-O 116.725 -1.607 . . . . 20.64 111.381 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.72 -24.83 59.96 Favored 'General case' 0 C--O 1.269 2.105 0 CA-C-N 119.918 1.235 . . . . 18.99 111.459 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.82 -2.83 31.86 Favored 'General case' 0 C--O 1.273 2.332 0 C-N-CA 126.489 1.916 . . . . 21.52 111.399 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 63.3 mt -102.95 0.15 31.84 Favored 'General case' 0 C--O 1.27 2.146 0 CA-C-O 118.121 -0.942 . . . . 27.21 110.731 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 40.9 t -68.44 153.65 43.36 Favored 'General case' 0 C--O 1.263 1.788 0 CA-C-O 118.349 -0.834 . . . . 27.76 109.563 -172.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.1 p -60.33 -21.93 62.61 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.606 1.162 . . . . 29.25 110.077 167.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -93.47 117.88 30.63 Favored 'General case' 0 C--O 1.265 1.912 0 C-N-CA 125.967 1.707 . . . . 29.05 109.49 175.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.467 ' O ' HG23 ' A' ' 92' ' ' VAL . 28.7 pt -90.46 3.85 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 CA-C-O 116.89 -1.529 . . . . 24.32 110.163 -167.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 48.0 m -49.86 -57.47 7.35 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.427 1.491 . . . . 27.36 108.077 -177.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.9 -50.42 68.83 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.874 1.269 . . . . 26.78 109.377 -177.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 25.7 m -60.58 -40.05 90.28 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 125.098 1.359 . . . . 24.13 111.094 -177.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 88' ' ' ILE . 85.7 t -69.57 -49.34 59.84 Favored 'Isoleucine or valine' 0 C--O 1.265 1.912 0 C-N-CA 124.864 1.266 . . . . 29.63 110.315 -178.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -63.09 -39.78 95.73 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 124.39 1.076 . . . . 28.74 109.235 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.915 ' SG ' ' CB ' ' A' ' 94' ' ' CYS . 51.3 t -64.65 -42.91 95.09 Favored 'General case' 0 C--O 1.266 1.964 0 C-N-CA 125.693 1.597 . . . . 26.01 110.347 177.63 -178.211 44.246 83.482 87.935 2.664 91.661 167.199 -74.223 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.5 -38.34 89.46 Favored 'General case' 0 C--O 1.254 1.337 0 C-N-CA 125.31 1.444 . . . . 22.38 110.645 178.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -56.41 -39.35 72.9 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 118.23 -0.89 . . . . 25.76 109.807 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 24.9 mtpt -70.02 -46.13 65.72 Favored 'General case' 0 C--O 1.254 1.312 0 O-C-N 124.524 1.14 . . . . 33.54 110.225 177.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.438 HG12 ' CE2' ' A' ' 63' ' ' TRP . 69.5 mt -60.96 -51.97 67.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 CA-C-O 117.436 -1.268 . . . . 23.44 109.866 -176.592 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 5.8 p -70.48 -20.88 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 C-N-CA 125.121 1.368 . . . . 24.9 109.058 -171.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 58.7 m -81.64 -6.46 59.03 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 116.915 -1.517 . . . . 33.67 111.984 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -90.21 -4.35 57.27 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 117.319 -1.324 . . . . 34.48 113.054 -156.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 133.42 -34.19 2.46 Favored Glycine 0 N--CA 1.474 1.186 0 CA-C-O 117.272 -1.849 . . . . 34.8 112.522 174.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -100.8 1.2 39.96 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 117.172 -1.395 . . . . 43.41 112.643 -173.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 55.26 -134.55 48.45 Favored Glycine 0 C--O 1.262 1.891 0 CA-C-O 117.457 -1.746 . . . . 25.27 112.448 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 60.1 mtp -93.18 1.93 56.9 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 118.755 1.278 . . . . 20.19 110.688 -170.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 -64.47 -22.33 66.93 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 125.814 1.646 . . . . 18.37 110.006 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.45 -22.93 35.39 Favored 'General case' 0 C--O 1.271 2.209 0 C-N-CA 124.345 1.058 . . . . 19.51 109.785 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . 1.337 ' CD1' ' CE2' ' A' ' 108' ' ' TRP . 24.8 m-90 -100.48 106.38 17.93 Favored 'General case' 0 C--O 1.272 2.261 0 C-N-CA 125.114 1.366 . . . . 24.04 109.42 176.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 49.8 t -62.5 -35.13 68.49 Favored 'Isoleucine or valine' 0 C--O 1.279 2.643 0 C-N-CA 125.64 1.576 . . . . 21.72 110.945 -171.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -76.26 -30.29 57.79 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.544 1.537 . . . . 20.91 111.731 -179.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.428 ' HA ' ' SG ' ' A' ' 115' ' ' CYS . 85.2 t90 -65.64 -48.32 72.59 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 123.78 0.832 . . . . 24.75 109.502 170.702 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -57.52 -43.98 84.7 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-O 117.681 -1.152 . . . . 36.76 110.55 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -94.0 -17.83 22.51 Favored 'General case' 0 C--O 1.288 3.131 0 C-N-CA 124.787 1.235 . . . . 21.62 111.818 -167.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -131.02 -10.26 3.81 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 116.056 -1.926 . . . . 23.23 114.374 -171.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' CYS . . . . . 1.077 ' SG ' ' CB ' ' A' ' 115' ' ' CYS . 3.6 m -125.78 -48.76 1.64 Allowed 'General case' 0 C--O 1.264 1.845 0 CA-C-N 121.161 1.8 . . . . 21.39 112.128 -176.523 -38.668 -77.792 -89.706 75.324 2.985 75.078 -92.604 -149.069 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -44.85 124.48 4.41 Favored 'General case' 0 C--O 1.253 1.246 0 O-C-N 124.417 1.073 . . . . 24.99 108.434 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 80.9 5.17 90.28 Favored Glycine 0 N--CA 1.479 1.526 0 CA-C-O 117.091 -1.95 . . . . 26.44 114.198 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 26.2 p -103.14 168.88 8.89 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 119.225 1.512 . . . . 25.97 110.179 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -68.8 82.66 0.29 Allowed 'General case' 0 C--O 1.263 1.815 0 O-C-N 124.914 1.384 . . . . 30.22 108.654 170.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 10.8 m -70.77 -34.9 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 CA-C-O 117.972 -1.013 . . . . 23.6 110.652 -174.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 20.3 tm0? -51.92 -30.62 25.11 Favored 'General case' 0 C--O 1.268 2.052 0 C-N-CA 124.777 1.231 . . . . 26.38 111.231 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -46.02 -34.24 3.93 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 115.468 -2.206 . . . . 21.64 111.125 174.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . 0.435 ' NE1' ' SG ' ' A' ' 30' ' ' CYS . 92.8 m95 -72.43 -21.72 61.21 Favored 'General case' 0 N--CA 1.504 2.225 0 C-N-CA 126.864 2.066 . . . . 27.12 112.94 -173.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 30.0 pt -108.49 9.45 9.16 Favored 'Isoleucine or valine' 0 C--O 1.277 2.535 0 CA-C-O 117.815 -1.088 . . . . 30.3 110.24 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -71.53 127.65 33.26 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.767 -1.197 . . . . 35.26 107.767 -172.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 98.57 -22.51 40.58 Favored Glycine 0 C--O 1.267 2.165 0 CA-C-O 117.501 -1.721 . . . . 30.08 113.7 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' CYS . . . . . 1.142 ' SG ' ' CB ' ' A' ' 127' ' ' CYS . 1.9 m -68.87 145.88 53.31 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.921 1.288 . . . . 29.31 110.385 177.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 58.5 mtp85 . . . . . 0 N--CA 1.484 1.23 0 O-C-N 124.776 1.297 . . . . 39.3 109.057 176.92 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' GD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' GD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' DO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' DO3 . . . . . 0.475 ' O7 ' H101 ' A' ' 204' ' ' DO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . 0.408 ' O ' ' C9 ' ' A' ' 204' ' ' DO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_