data_3txj_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3txj _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 78.9 tttt . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 119.815 -0.136 . . . . 37.34 110.792 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 82.4 t -88.81 89.12 3.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 123.509 0.505 . . . . 33.04 110.804 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -48.51 152.49 0.92 Allowed 'General case' 0 C--O 1.24 0.572 0 N-CA-C 113.633 0.975 . . . . 32.21 113.633 177.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.94 154.33 21.53 Favored Glycine 0 C--O 1.247 0.928 0 N-CA-C 107.746 -2.141 . . . . 32.55 107.746 166.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 26.4 ttp85 -49.67 -63.17 1.19 Allowed 'General case' 0 C--O 1.231 0.103 0 O-C-N 124.034 0.49 . . . . 38.92 112.119 -174.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.8 m -69.8 -26.37 64.23 Favored 'General case' 0 C--O 1.247 0.948 0 CA-C-O 121.425 0.631 . . . . 35.54 112.096 -173.586 -74.992 -53.039 -88.128 102.205 2.028 106.629 -27.497 -70.627 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -59.2 -54.36 47.84 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-N 115.255 -0.884 . . . . 32.13 109.475 172.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.5 tp -60.88 -39.43 89.18 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 124.322 1.014 . . . . 30.81 112.578 -177.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.8 -53.93 51.38 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 115.839 -0.619 . . . . 31.74 109.544 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -46.06 -41.13 11.71 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.101 1.149 . . . . 32.16 114.101 171.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.24 -29.56 28.37 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.282 -0.417 . . . . 33.27 111.581 -171.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 38.2 mtt -73.91 -46.72 42.69 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 120.716 -0.394 . . . . 36.57 110.177 172.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -55.29 -40.11 70.68 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 123.778 0.674 . . . . 38.73 110.556 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -65.62 -41.48 92.65 Favored 'General case' 0 C--O 1.241 0.626 0 O-C-N 123.656 0.597 . . . . 46.05 111.941 178.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -77.44 12.82 1.4 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 113.593 0.96 . . . . 40.09 113.593 177.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.97 27.84 44.01 Favored Glycine 0 CA--C 1.507 -0.416 0 CA-C-N 115.825 -0.625 . . . . 41.23 112.8 168.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.7 tp -84.44 -50.34 7.86 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.525 0.935 . . . . 42.36 113.525 -174.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -44.92 129.77 7.33 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.889 -0.412 . . . . 47.84 109.889 -179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 55.68 27.12 10.15 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 116.828 2.159 . . . . 44.12 116.828 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -74.29 126.0 29.69 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.761 -1.2 . . . . 50.23 107.761 167.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 52.69 23.81 2.87 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 114.063 1.134 . . . . 50.86 114.063 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.72 9.12 57.8 Favored Glycine 0 CA--C 1.516 0.112 0 CA-C-N 115.8 -0.636 . . . . 39.8 114.157 174.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -105.65 97.09 6.97 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.436 0.532 . . . . 35.55 112.436 -173.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -54.57 168.82 0.24 Allowed 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.257 -0.645 . . . . 32.08 109.257 -177.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.4 tp -63.73 -36.11 82.79 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 114.676 1.362 . . . . 31.39 114.676 -171.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -53.78 -28.73 39.77 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 115.822 1.089 . . . . 31.53 115.822 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 46.0 m-20 -60.77 -72.78 0.1 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 109.129 -0.693 . . . . 33.67 109.129 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -44.97 -42.73 8.49 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.022 -0.536 . . . . 29.3 112.387 -177.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.59 -34.76 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 112.682 0.623 . . . . 28.3 112.682 -177.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.9 t -65.01 -53.81 40.27 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.84 -0.8 . . . . 30.43 108.84 173.288 -168.634 -97.467 -92.084 103.851 1.996 104.764 -92.2 -57.589 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -48.28 -51.7 24.66 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.949 0.9 . . . . 27.26 111.761 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.18 -54.32 41.38 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.443 -1.253 . . . . 25.14 108.709 177.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.5 tptt -46.78 -54.57 9.5 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.604 -0.725 . . . . 34.03 109.498 -177.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -79.27 -39.14 33.72 Favored 'General case' 0 C--O 1.258 1.505 0 N-CA-C 115.678 1.733 . . . . 27.33 115.678 -170.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -62.69 -51.26 67.89 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.101 -1.074 . . . . 24.14 108.101 173.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 14.1 p -131.17 -13.18 3.53 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 119.702 3.223 . . . . 27.62 119.702 -164.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 76.31 22.77 1.26 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.395 0.543 . . . . 28.6 112.376 178.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 69.13 17.99 8.33 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.129 -0.942 . . . . 31.41 112.999 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 62.2 t-20 -96.61 123.0 40.15 Favored 'General case' 0 CA--C 1.487 -1.456 0 N-CA-C 107.269 -1.382 . . . . 28.07 107.269 -178.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.1 p -75.45 -14.17 60.42 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 118.33 -1.348 . . . . 26.24 112.923 -177.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -99.07 2.45 46.13 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 114.757 1.392 . . . . 27.66 114.757 -174.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.32 130.74 45.0 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 115.041 1.497 . . . . 24.69 115.041 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 37.5 p -124.49 153.24 42.32 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.129 0.418 . . . . 26.56 112.129 168.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -139.07 135.59 34.34 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.401 0.519 . . . . 32.48 112.401 162.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -79.32 133.5 36.62 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 109.793 -0.447 . . . . 44.0 109.793 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . 0.53 ' N ' ' O ' ' A' ' 50' ' ' SER . 35.6 m120 -92.38 151.7 20.12 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 118.679 -1.208 . . . . 31.23 109.755 173.557 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -52.84 -28.01 20.92 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 114.575 1.324 . . . . 32.5 114.575 -179.142 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -85.39 -3.85 58.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 112.346 0.498 . . . . 31.52 112.346 -174.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.74 -23.83 12.79 Favored Glycine 0 C--O 1.222 -0.619 0 N-CA-C 114.37 0.508 . . . . 29.09 114.37 -179.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . 0.53 ' O ' ' N ' ' A' ' 46' ' ' ASN . 7.7 p -67.63 158.25 32.6 Favored 'General case' 0 C--O 1.257 1.472 0 CA-C-O 122.396 1.093 . . . . 27.2 113.501 179.442 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.2 m -128.67 136.75 51.05 Favored 'General case' 0 CA--C 1.497 -1.07 0 CA-C-N 114.784 -1.098 . . . . 26.57 108.278 176.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . 0.578 ' OD2' ' O6 ' ' A' ' 130' ' ' NAG . 13.9 m-20 -93.57 138.6 31.66 Favored 'General case' 0 C--O 1.239 0.549 0 O-C-N 123.919 0.762 . . . . 31.49 109.046 176.321 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TYR . . . . . 0.561 ' N ' ' O ' ' A' ' 58' ' ' ILE . 90.8 m-85 -123.66 126.62 46.91 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 118.386 2.736 . . . . 27.27 118.386 -175.861 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.88 -165.15 33.05 Favored Glycine 0 N--CA 1.466 0.698 0 N-CA-C 117.166 1.626 . . . . 27.14 117.166 162.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.4 tp -48.22 -37.04 6.85 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.382 0 C-N-CA 125.179 1.392 . . . . 30.52 114.196 -174.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 24.0 mt -115.55 14.46 16.58 Favored 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.74 -0.6 . . . . 22.93 110.264 -179.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 48.03 54.75 9.64 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-O 121.954 0.883 . . . . 22.03 112.906 178.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . 0.561 ' O ' ' N ' ' A' ' 53' ' ' TYR . 60.5 mt -72.54 143.84 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 N-CA-C 108.313 -0.995 . . . . 24.06 108.313 176.571 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -107.1 138.37 43.4 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.362 1.865 . . . . 26.2 112.878 -160.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.6 p -81.41 -13.41 58.3 Favored 'General case' 0 C--O 1.248 1.024 0 C-N-CA 123.307 0.643 . . . . 26.63 111.524 -165.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -55.62 -53.34 57.7 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 113.473 -1.694 . . . . 40.87 108.872 179.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -110.87 -33.3 6.56 Favored 'General case' 0 C--O 1.253 1.257 0 O-C-N 123.781 0.676 . . . . 42.42 111.854 -173.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -103.21 -30.47 10.65 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 118.997 2.962 . . . . 29.79 118.997 -154.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 28.0 p -142.42 176.27 9.13 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.668 -0.413 . . . . 29.17 110.222 -177.998 60.666 84.789 97.011 101.924 1.996 104.075 -66.89 -62.407 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -119.53 116.5 26.21 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 120.918 0.389 . . . . 33.29 111.296 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 42.3 p30 -112.48 -3.46 14.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.426 -0.806 . . . . 32.79 110.176 170.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 64.23 28.4 72.91 Favored Glycine 0 C--O 1.243 0.673 0 N-CA-C 115.278 0.871 . . . . 34.92 115.278 174.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.5 ptt-85 -143.96 22.74 1.74 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.645 0.778 . . . . 61.11 112.099 167.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . 0.413 ' O ' ' OG ' ' A' ' 72' ' ' SER . 1.7 m -115.05 89.32 19.55 Favored Pre-proline 0 C--O 1.241 0.645 0 N-CA-C 107.203 -1.406 . . . . 36.41 107.203 173.509 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -58.85 139.9 92.84 Favored 'Trans proline' 0 CA--C 1.503 -1.051 0 C-N-CA 122.152 1.902 . . . . 36.98 112.082 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 74.58 12.51 82.47 Favored Glycine 0 CA--C 1.503 -0.707 0 O-C-N 124.061 0.851 . . . . 37.24 112.63 172.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 69' ' ' THR . 96.2 p -98.66 166.1 11.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.444 0.64 . . . . 37.79 112.409 -174.768 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.5 mmm-85 -101.84 179.05 4.44 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 115.081 -0.963 . . . . 46.21 110.148 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -149.32 76.44 1.32 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 103.211 -2.885 . . . . 40.76 103.211 175.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 95.0 mt -83.54 -11.65 57.15 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.404 0.89 . . . . 37.84 113.404 -171.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 7.6 m -95.15 -9.26 34.0 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 120.466 -0.494 . . . . 38.2 110.348 178.546 -84.577 169.518 102.07 102.943 2.039 104.578 36.843 -160.322 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 63.96 45.2 4.36 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 112.782 0.66 . . . . 43.07 112.782 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 pt -141.44 154.9 67.42 Favored Pre-proline 0 N--CA 1.465 0.292 0 CA-C-N 116.045 -0.525 . . . . 37.2 111.631 176.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.0 156.93 55.52 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 N-CA-C 108.339 -1.447 . . . . 34.12 108.339 165.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 71.0 m -76.66 -24.06 53.26 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.887 0.699 . . . . 32.05 112.887 -173.058 -62.407 -66.89 97.011 104.075 1.996 101.924 84.789 60.666 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 81.0 p -63.24 -16.35 59.95 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 114.715 1.376 . . . . 31.27 114.715 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.88 -10.01 59.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 109.879 -0.415 . . . . 30.67 109.879 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.5 mt -92.42 -13.23 30.35 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.004 -0.998 . . . . 29.72 111.712 -179.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mt -90.35 -9.53 47.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.102 0.477 . . . . 30.29 110.892 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.9 t -58.08 148.69 25.63 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 113.168 0.803 . . . . 30.98 113.168 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 94.5 p -68.89 -34.01 74.7 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.636 -0.876 . . . . 30.86 108.636 178.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . 0.572 ' OD1' ' OG1' ' A' ' 89' ' ' THR . 33.7 t0 -69.08 137.5 53.55 Favored 'General case' 0 C--N 1.281 -2.393 0 O-C-N 118.43 -2.669 . . . . 36.63 107.666 164.689 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 7.2 pt -108.72 8.3 9.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 O-C-N 119.514 -1.991 . . . . 31.87 114.015 -173.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . 0.572 ' OG1' ' OD1' ' A' ' 87' ' ' ASP . 2.0 m -53.95 -57.89 9.31 Favored 'General case' 0 C--N 1.252 -3.657 0 O-C-N 124.537 1.148 . . . . 33.17 112.136 -173.346 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -49.29 -51.72 32.14 Favored 'General case' 1 C--N 1.449 4.915 0 C-N-CA 125.167 1.387 . . . . 32.71 109.62 177.926 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.02 -53.72 18.87 Favored 'General case' 0 CA--C 1.507 -0.703 0 O-C-N 124.466 1.104 . . . . 31.96 108.933 177.602 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 32.0 t -65.15 -49.0 81.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.689 -0.687 . . . . 32.98 111.221 -176.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 64.8 m-20 -57.71 -34.07 69.07 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 120.013 -0.675 . . . . 37.21 112.535 -179.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.7 t -68.7 -49.5 58.38 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 123.242 0.339 . . . . 38.0 110.346 176.352 -160.322 36.843 102.07 104.578 2.039 102.943 169.518 -84.577 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -43.06 -41.1 3.4 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.769 -0.196 . . . . 35.94 111.46 174.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 38.4 mttt -63.85 -33.19 75.12 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 113.222 0.823 . . . . 38.05 113.222 -173.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -83.39 -24.27 32.04 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.071 0.948 . . . . 39.29 110.973 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 71.1 mt -86.27 -46.45 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.804 0 N-CA-C 107.314 -1.365 . . . . 34.57 107.314 -178.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.52 -38.1 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 C-N-CA 119.146 -1.022 . . . . 33.32 108.76 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 56.3 m -71.2 -3.71 21.66 Favored 'General case' 0 C--O 1.211 -0.96 0 N-CA-C 115.458 1.651 . . . . 34.87 115.458 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -71.63 -10.59 60.0 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 117.534 2.42 . . . . 38.64 117.534 -173.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.32 -2.0 43.39 Favored Glycine 0 N--CA 1.468 0.823 0 N-CA-C 115.607 1.003 . . . . 34.46 115.607 175.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -106.35 1.43 25.77 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.212 -0.595 . . . . 37.84 111.489 164.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 64.74 -138.63 40.18 Favored Glycine 0 CA--C 1.502 -0.763 0 N-CA-C 108.465 -1.854 . . . . 29.79 108.465 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 61.8 mtp -90.61 4.99 49.8 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 119.581 -0.848 . . . . 26.37 110.847 -178.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.5 m-80 -59.66 -19.54 50.14 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.142 0.496 . . . . 26.0 110.086 167.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.46 -29.93 62.28 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.786 -0.643 . . . . 21.53 110.024 177.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 25.7 m-90 -94.76 112.37 24.1 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 111.864 0.32 . . . . 19.62 111.864 177.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . 0.476 ' CG2' ' O4 ' ' A' ' 130' ' ' NAG . 4.8 t -55.54 -53.81 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 119.582 -0.847 . . . . 20.49 109.464 -174.012 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -45.61 -44.73 13.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 O-C-N 124.034 0.834 . . . . 22.77 111.25 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 89.4 t90 -64.49 -55.84 18.02 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-O 121.347 0.594 . . . . 25.02 111.303 -172.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -55.51 -46.07 77.04 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 107.369 -1.345 . . . . 38.34 107.369 -175.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -79.91 -24.42 41.1 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 114.82 1.415 . . . . 31.56 114.82 -172.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -127.27 -17.75 4.67 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.672 2.101 . . . . 31.04 116.672 -168.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 65.1 m -117.78 -41.21 2.93 Favored 'General case' 0 CA--C 1.504 -0.809 0 O-C-N 123.332 0.395 . . . . 29.33 111.616 179.887 -57.589 -92.2 -92.084 104.764 1.996 103.851 -97.467 -168.634 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -43.39 130.54 4.96 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.532 -0.467 . . . . 29.79 111.146 -178.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 70.12 15.59 72.25 Favored Glycine 0 C--O 1.223 -0.544 0 N-CA-C 116.245 1.258 . . . . 30.76 116.245 173.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 62.6 p -108.99 175.76 5.34 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 117.556 0.678 . . . . 33.11 109.425 174.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -80.2 90.77 5.51 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 108.213 -1.032 . . . . 43.4 108.213 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 29.3 m -76.78 -18.81 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.111 0 CA-C-N 114.838 -1.074 . . . . 38.91 112.921 -173.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . 0.46 ' O ' ' N ' ' A' ' 124' ' ' ILE . 4.1 tp60 -60.85 -42.27 97.48 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.676 0.391 . . . . 48.97 110.546 178.178 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -36.0 -31.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.786 1.032 . . . . 38.55 113.786 174.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -78.73 -14.02 59.5 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.639 0.607 . . . . 38.19 112.639 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ILE . . . . . 0.46 ' N ' ' O ' ' A' ' 121' ' ' GLN . 22.9 pt -116.34 -4.04 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 116.469 -0.332 . . . . 41.48 111.458 179.127 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.2 ttm180 -50.91 133.02 27.21 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 124.124 0.97 . . . . 43.2 108.61 170.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 83.4 13.41 76.45 Favored Glycine 0 N--CA 1.473 1.148 0 N-CA-C 116.54 1.376 . . . . 43.57 116.54 176.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 84.9 m -103.97 129.75 51.57 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.196 1.554 . . . . 44.45 115.196 -168.893 -70.627 -27.497 -88.128 106.629 2.028 102.205 -53.039 -74.992 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ARG . . . . . 0.405 ' N ' ' O ' ' A' 2139 ' ' HOH . 24.5 tpt85 -74.47 89.53 2.16 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 106.393 -1.706 . . . . 53.02 106.393 177.889 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.6 mt . . . . . 0 C--O 1.234 0.259 0 CA-C-N 114.324 -1.307 . . . . 48.59 112.389 -170.643 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1130 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1131 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1132 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1133 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1134 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1135 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1136 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1137 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1138 ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' NAG . . . . . 0.578 ' O6 ' ' OD2' ' A' ' 52' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2081 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2099 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2124 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2127 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2128 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2129 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2131 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2139 ' ' HOH . . . . . 0.405 ' O ' ' N ' ' A' ' 128' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 78.9 tttt . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 119.815 -0.136 . . . . 37.340000000000003 110.792 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 82.4 t -88.81 89.12 3.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 123.509 0.505 . . . . 33.039999999999999 110.804 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -48.51 152.49 0.92 Allowed 'General case' 0 C--O 1.24 0.572 0 N-CA-C 113.633 0.975 . . . . 32.210000000000001 113.633 177.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.94 154.33 21.53 Favored Glycine 0 C--O 1.247 0.928 0 N-CA-C 107.746 -2.141 . . . . 32.549999999999997 107.746 166.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 26.4 ttp85 -49.67 -63.17 1.19 Allowed 'General case' 0 C--O 1.231 0.103 0 O-C-N 124.034 0.49 . . . . 38.920000000000002 112.119 -174.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.8 m -69.8 -26.37 64.23 Favored 'General case' 0 C--O 1.247 0.948 0 CA-C-O 121.425 0.631 . . . . 35.539999999999999 112.096 -173.586 -74.992 -53.039 -88.128 102.205 2.028 106.629 -27.497 -70.627 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -59.2 -54.36 47.84 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-N 115.255 -0.884 . . . . 32.130000000000003 109.475 172.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.5 tp -60.88 -39.43 89.18 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 124.322 1.014 . . . . 30.809999999999999 112.578 -177.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.8 -53.93 51.38 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 115.839 -0.619 . . . . 31.739999999999998 109.544 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -46.06 -41.13 11.71 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.101 1.149 . . . . 32.159999999999997 114.101 171.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.24 -29.56 28.37 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.282 -0.417 . . . . 33.270000000000003 111.581 -171.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 38.2 mtt -73.91 -46.72 42.69 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 120.716 -0.394 . . . . 36.57 110.177 172.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . 0.585 ' HD2' HD22 ' A' ' 129' ' ' LEU . 16.5 tttt -55.29 -40.11 70.68 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 123.778 0.674 . . . . 38.729999999999997 110.556 178.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -65.62 -41.48 92.65 Favored 'General case' 0 C--O 1.241 0.626 0 O-C-N 123.656 0.597 . . . . 46.049999999999997 111.941 178.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . 0.597 ' HB3' HG11 ' A' ' 92' ' ' VAL . 40.2 m80 -77.44 12.82 1.4 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 113.593 0.96 . . . . 40.090000000000003 113.593 177.386 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.97 27.84 44.01 Favored Glycine 0 CA--C 1.507 -0.416 0 CA-C-N 115.825 -0.625 . . . . 41.229999999999997 112.8 168.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . 0.464 HD13 HG13 ' A' ' 92' ' ' VAL . 4.7 tp -84.44 -50.34 7.86 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.525 0.935 . . . . 42.359999999999999 113.525 -174.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -44.92 129.77 7.33 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.889 -0.412 . . . . 47.840000000000003 109.889 -179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 55.68 27.12 10.15 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 116.828 2.159 . . . . 44.119999999999997 116.828 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -74.29 126.0 29.69 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.761 -1.2 . . . . 50.229999999999997 107.761 167.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 52.69 23.81 2.87 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 114.063 1.134 . . . . 50.859999999999999 114.063 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.72 9.12 57.8 Favored Glycine 0 CA--C 1.516 0.112 0 CA-C-N 115.8 -0.636 . . . . 39.799999999999997 114.157 174.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -105.65 97.09 6.97 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.436 0.532 . . . . 35.549999999999997 112.436 -173.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -54.57 168.82 0.24 Allowed 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.257 -0.645 . . . . 32.079999999999998 109.257 -177.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . 0.462 HD23 HD11 ' A' ' 129' ' ' LEU . 11.4 tp -63.73 -36.11 82.79 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 114.676 1.362 . . . . 31.390000000000001 114.676 -171.33 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -53.78 -28.73 39.77 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 115.822 1.089 . . . . 31.530000000000001 115.822 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 46.0 m-20 -60.77 -72.78 0.1 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 109.129 -0.693 . . . . 33.670000000000002 109.129 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -44.97 -42.73 8.49 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.022 -0.536 . . . . 29.300000000000001 112.387 -177.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.59 -34.76 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 112.682 0.623 . . . . 28.300000000000001 112.682 -177.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.9 t -65.01 -53.81 40.27 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.84 -0.8 . . . . 30.43 108.84 173.288 -168.634 -97.467 -92.084 103.851 1.996 104.764 -92.2 -57.589 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -48.28 -51.7 24.66 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.949 0.9 . . . . 27.260000000000002 111.761 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.18 -54.32 41.38 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.443 -1.253 . . . . 25.140000000000001 108.709 177.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . 0.836 ' HD2' ' CE2' ' A' ' 38' ' ' PHE . 5.5 tptt -46.78 -54.57 9.5 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.604 -0.725 . . . . 34.030000000000001 109.498 -177.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -79.27 -39.14 33.72 Favored 'General case' 0 C--O 1.258 1.505 0 N-CA-C 115.678 1.733 . . . . 27.329999999999998 115.678 -170.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -62.69 -51.26 67.89 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.101 -1.074 . . . . 24.140000000000001 108.101 173.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 14.1 p -131.17 -13.18 3.53 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 119.702 3.223 . . . . 27.620000000000001 119.702 -164.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 76.31 22.77 1.26 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.395 0.543 . . . . 28.600000000000001 112.376 178.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . 0.836 ' CE2' ' HD2' ' A' ' 33' ' ' LYS . 55.5 m-85 69.13 17.99 8.33 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.129 -0.942 . . . . 31.41 112.999 -179.938 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 62.2 t-20 -96.61 123.0 40.15 Favored 'General case' 0 CA--C 1.487 -1.456 0 N-CA-C 107.269 -1.382 . . . . 28.07 107.269 -178.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.623 ' O ' ' HA ' ' A' ' 84' ' ' LEU . 19.1 p -75.45 -14.17 60.42 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 118.33 -1.348 . . . . 26.239999999999998 112.923 -177.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -99.07 2.45 46.13 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 114.757 1.392 . . . . 27.66 114.757 -174.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.32 130.74 45.0 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 115.041 1.497 . . . . 24.690000000000001 115.041 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 37.5 p -124.49 153.24 42.32 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.129 0.418 . . . . 26.559999999999999 112.129 168.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -139.07 135.59 34.34 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.401 0.519 . . . . 32.479999999999997 112.401 162.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -79.32 133.5 36.62 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 109.793 -0.447 . . . . 44.0 109.793 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -92.38 151.7 20.12 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 118.679 -1.208 . . . . 31.23 109.755 173.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -52.84 -28.01 20.92 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 114.575 1.324 . . . . 32.5 114.575 -179.142 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -85.39 -3.85 58.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 112.346 0.498 . . . . 31.52 112.346 -174.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.74 -23.83 12.79 Favored Glycine 0 C--O 1.222 -0.619 0 N-CA-C 114.37 0.508 . . . . 29.09 114.37 -179.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.7 p -67.63 158.25 32.6 Favored 'General case' 0 C--O 1.257 1.472 0 CA-C-O 122.396 1.093 . . . . 27.199999999999999 113.501 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.2 m -128.67 136.75 51.05 Favored 'General case' 0 CA--C 1.497 -1.07 0 CA-C-N 114.784 -1.098 . . . . 26.57 108.278 176.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . 0.577 ' OD2' ' O6 ' ' A' ' 130' ' ' NAG . 13.9 m-20 -93.57 138.6 31.66 Favored 'General case' 0 C--O 1.239 0.549 0 O-C-N 123.919 0.762 . . . . 31.489999999999998 109.046 176.321 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TYR . . . . . 0.417 ' CD1' ' HB3' ' A' ' 80' ' ' CYS . 90.8 m-85 -123.66 126.62 46.91 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 118.386 2.736 . . . . 27.27 118.386 -175.861 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.88 -165.15 33.05 Favored Glycine 0 N--CA 1.466 0.698 0 N-CA-C 117.166 1.626 . . . . 27.140000000000001 117.166 162.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.4 tp -48.22 -37.04 6.85 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.382 0 C-N-CA 125.179 1.392 . . . . 30.52 114.196 -174.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 24.0 mt -115.55 14.46 16.58 Favored 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.74 -0.6 . . . . 22.93 110.264 -179.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 48.03 54.75 9.64 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-O 121.954 0.883 . . . . 22.030000000000001 112.906 178.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 60.5 mt -72.54 143.84 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 N-CA-C 108.313 -0.995 . . . . 24.059999999999999 108.313 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -107.1 138.37 43.4 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.362 1.865 . . . . 26.199999999999999 112.878 -160.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.6 p -81.41 -13.41 58.3 Favored 'General case' 0 C--O 1.248 1.024 0 C-N-CA 123.307 0.643 . . . . 26.629999999999999 111.524 -165.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . 0.729 ' O ' ' HB2' ' A' ' 72' ' ' SER . 3.5 tpt180 -55.62 -53.34 57.7 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 113.473 -1.694 . . . . 40.869999999999997 108.872 179.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -110.87 -33.3 6.56 Favored 'General case' 0 C--O 1.253 1.257 0 O-C-N 123.781 0.676 . . . . 42.420000000000002 111.854 -173.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -103.21 -30.47 10.65 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 118.997 2.962 . . . . 29.789999999999999 118.997 -154.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 28.0 p -142.42 176.27 9.13 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.668 -0.413 . . . . 29.170000000000002 110.222 -177.998 60.666 84.789 97.011 101.924 1.996 104.075 -66.89 -62.407 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -119.53 116.5 26.21 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 120.918 0.389 . . . . 33.289999999999999 111.296 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 42.3 p30 -112.48 -3.46 14.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.426 -0.806 . . . . 32.789999999999999 110.176 170.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 64.23 28.4 72.91 Favored Glycine 0 C--O 1.243 0.673 0 N-CA-C 115.278 0.871 . . . . 34.920000000000002 115.278 174.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . 0.459 ' HG2' ' NH1' ' A' ' 68' ' ' ARG . 1.5 ptt-85 -143.96 22.74 1.74 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.645 0.778 . . . . 61.109999999999999 112.099 167.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.7 m -115.05 89.32 19.55 Favored Pre-proline 0 C--O 1.241 0.645 0 N-CA-C 107.203 -1.406 . . . . 36.409999999999997 107.203 173.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -58.85 139.9 92.84 Favored 'Trans proline' 0 CA--C 1.503 -1.051 0 C-N-CA 122.152 1.902 . . . . 36.979999999999997 112.082 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 74.58 12.51 82.47 Favored Glycine 0 CA--C 1.503 -0.707 0 O-C-N 124.061 0.851 . . . . 37.240000000000002 112.63 172.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . 0.729 ' HB2' ' O ' ' A' ' 61' ' ' ARG . 96.2 p -98.66 166.1 11.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.444 0.64 . . . . 37.789999999999999 112.409 -174.768 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.5 mmm-85 -101.84 179.05 4.44 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 115.081 -0.963 . . . . 46.210000000000001 110.148 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -149.32 76.44 1.32 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 103.211 -2.885 . . . . 40.759999999999998 103.211 175.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 95.0 mt -83.54 -11.65 57.15 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.404 0.89 . . . . 37.840000000000003 113.404 -171.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 7.6 m -95.15 -9.26 34.0 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 120.466 -0.494 . . . . 38.200000000000003 110.348 178.546 -84.577 169.518 102.07 102.943 2.039 104.578 36.843 -160.322 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 63.96 45.2 4.36 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 112.782 0.66 . . . . 43.07 112.782 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . 0.461 HD11 HD21 ' A' ' 83' ' ' LEU . 18.9 pt -141.44 154.9 67.42 Favored Pre-proline 0 N--CA 1.465 0.292 0 CA-C-N 116.045 -0.525 . . . . 37.200000000000003 111.631 176.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.0 156.93 55.52 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 N-CA-C 108.339 -1.447 . . . . 34.119999999999997 108.339 165.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . 0.417 ' HB3' ' CD1' ' A' ' 53' ' ' TYR . 71.0 m -76.66 -24.06 53.26 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.887 0.699 . . . . 32.049999999999997 112.887 -173.058 -62.407 -66.89 97.011 104.075 1.996 101.924 84.789 60.666 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 81.0 p -63.24 -16.35 59.95 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 114.715 1.376 . . . . 31.27 114.715 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.88 -10.01 59.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 109.879 -0.415 . . . . 30.670000000000002 109.879 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . 0.461 HD21 HD11 ' A' ' 78' ' ' ILE . 64.5 mt -92.42 -13.23 30.35 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.004 -0.998 . . . . 29.719999999999999 111.712 -179.243 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . 0.623 ' HA ' ' O ' ' A' ' 40' ' ' THR . 8.5 mt -90.35 -9.53 47.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.102 0.477 . . . . 30.289999999999999 110.892 178.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.9 t -58.08 148.69 25.63 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 113.168 0.803 . . . . 30.98 113.168 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 94.5 p -68.89 -34.01 74.7 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.636 -0.876 . . . . 30.859999999999999 108.636 178.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . 0.572 ' OD1' ' OG1' ' A' ' 89' ' ' THR . 33.7 t0 -69.08 137.5 53.55 Favored 'General case' 0 C--N 1.281 -2.393 0 O-C-N 118.43 -2.669 . . . . 36.630000000000003 107.666 164.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 7.2 pt -108.72 8.3 9.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 O-C-N 119.514 -1.991 . . . . 31.870000000000001 114.015 -173.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . 0.572 ' OG1' ' OD1' ' A' ' 87' ' ' ASP . 2.0 m -53.95 -57.89 9.31 Favored 'General case' 0 C--N 1.252 -3.657 0 O-C-N 124.537 1.148 . . . . 33.170000000000002 112.136 -173.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -49.29 -51.72 32.14 Favored 'General case' 1 C--N 1.449 4.915 0 C-N-CA 125.167 1.387 . . . . 32.710000000000001 109.62 177.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.02 -53.72 18.87 Favored 'General case' 0 CA--C 1.507 -0.703 0 O-C-N 124.466 1.104 . . . . 31.960000000000001 108.933 177.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . 0.597 HG11 ' HB3' ' A' ' 15' ' ' HIS . 32.0 t -65.15 -49.0 81.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.689 -0.687 . . . . 32.979999999999997 111.221 -176.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 64.8 m-20 -57.71 -34.07 69.07 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 120.013 -0.675 . . . . 37.210000000000001 112.535 -179.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.7 t -68.7 -49.5 58.38 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 123.242 0.339 . . . . 38.0 110.346 176.352 -160.322 36.843 102.07 104.578 2.039 102.943 169.518 -84.577 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -43.06 -41.1 3.4 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.769 -0.196 . . . . 35.939999999999998 111.46 174.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 38.4 mttt -63.85 -33.19 75.12 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 113.222 0.823 . . . . 38.049999999999997 113.222 -173.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -83.39 -24.27 32.04 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.071 0.948 . . . . 39.289999999999999 110.973 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 71.1 mt -86.27 -46.45 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.804 0 N-CA-C 107.314 -1.365 . . . . 34.57 107.314 -178.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.52 -38.1 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 C-N-CA 119.146 -1.022 . . . . 33.32 108.76 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 56.3 m -71.2 -3.71 21.66 Favored 'General case' 0 C--O 1.211 -0.96 0 N-CA-C 115.458 1.651 . . . . 34.869999999999997 115.458 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -71.63 -10.59 60.0 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 117.534 2.42 . . . . 38.640000000000001 117.534 -173.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.32 -2.0 43.39 Favored Glycine 0 N--CA 1.468 0.823 0 N-CA-C 115.607 1.003 . . . . 34.460000000000001 115.607 175.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -106.35 1.43 25.77 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.212 -0.595 . . . . 37.840000000000003 111.489 164.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 64.74 -138.63 40.18 Favored Glycine 0 CA--C 1.502 -0.763 0 N-CA-C 108.465 -1.854 . . . . 29.789999999999999 108.465 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 61.8 mtp -90.61 4.99 49.8 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 119.581 -0.848 . . . . 26.370000000000001 110.847 -178.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.5 m-80 -59.66 -19.54 50.14 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.142 0.496 . . . . 26.0 110.086 167.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.46 -29.93 62.28 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.786 -0.643 . . . . 21.530000000000001 110.024 177.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 25.7 m-90 -94.76 112.37 24.1 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 111.864 0.32 . . . . 19.620000000000001 111.864 177.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . 0.585 ' CG2' ' H5 ' ' A' ' 130' ' ' NAG . 4.8 t -55.54 -53.81 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 119.582 -0.847 . . . . 20.489999999999998 109.464 -174.012 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -45.61 -44.73 13.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 O-C-N 124.034 0.834 . . . . 22.77 111.25 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 89.4 t90 -64.49 -55.84 18.02 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-O 121.347 0.594 . . . . 25.02 111.303 -172.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -55.51 -46.07 77.04 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 107.369 -1.345 . . . . 38.340000000000003 107.369 -175.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -79.91 -24.42 41.1 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 114.82 1.415 . . . . 31.559999999999999 114.82 -172.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -127.27 -17.75 4.67 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.672 2.101 . . . . 31.039999999999999 116.672 -168.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 65.1 m -117.78 -41.21 2.93 Favored 'General case' 0 CA--C 1.504 -0.809 0 O-C-N 123.332 0.395 . . . . 29.329999999999998 111.616 179.887 -57.589 -92.2 -92.084 104.764 1.996 103.851 -97.467 -168.634 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -43.39 130.54 4.96 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.532 -0.467 . . . . 29.789999999999999 111.146 -178.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 70.12 15.59 72.25 Favored Glycine 0 C--O 1.223 -0.544 0 N-CA-C 116.245 1.258 . . . . 30.760000000000002 116.245 173.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 62.6 p -108.99 175.76 5.34 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 117.556 0.678 . . . . 33.109999999999999 109.425 174.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -80.2 90.77 5.51 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 108.213 -1.032 . . . . 43.399999999999999 108.213 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 29.3 m -76.78 -18.81 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.111 0 CA-C-N 114.838 -1.074 . . . . 38.909999999999997 112.921 -173.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -60.85 -42.27 97.48 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.676 0.391 . . . . 48.969999999999999 110.546 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -36.0 -31.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.786 1.032 . . . . 38.549999999999997 113.786 174.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -78.73 -14.02 59.5 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.639 0.607 . . . . 38.189999999999998 112.639 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 22.9 pt -116.34 -4.04 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 116.469 -0.332 . . . . 41.479999999999997 111.458 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.2 ttm180 -50.91 133.02 27.21 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 124.124 0.97 . . . . 43.200000000000003 108.61 170.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 83.4 13.41 76.45 Favored Glycine 0 N--CA 1.473 1.148 0 N-CA-C 116.54 1.376 . . . . 43.57 116.54 176.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 84.9 m -103.97 129.75 51.57 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.196 1.554 . . . . 44.450000000000003 115.196 -168.893 -70.627 -27.497 -88.128 106.629 2.028 102.205 -53.039 -74.992 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 24.5 tpt85 -74.47 89.53 2.16 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 106.393 -1.706 . . . . 53.020000000000003 106.393 177.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . 0.585 HD22 ' HD2' ' A' ' 13' ' ' LYS . 3.6 mt . . . . . 0 C--O 1.234 0.259 0 CA-C-N 114.324 -1.307 . . . . 48.590000000000003 112.389 -170.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1130 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1131 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1132 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1133 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1134 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1135 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1136 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1137 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1138 ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' NAG . . . . . 0.585 ' H5 ' ' CG2' ' A' ' 109' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2081 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2099 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2124 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2127 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2128 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2129 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2131 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2139 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 78.9 tttt . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 119.815 -0.136 . . . . 37.340000000000003 110.792 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 82.4 t -88.81 89.12 3.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 123.509 0.505 . . . . 33.039999999999999 110.804 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -48.51 152.49 0.92 Allowed 'General case' 0 C--O 1.24 0.572 0 N-CA-C 113.633 0.975 . . . . 32.210000000000001 113.633 177.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.94 154.33 21.53 Favored Glycine 0 C--O 1.247 0.928 0 N-CA-C 107.746 -2.141 . . . . 32.549999999999997 107.746 166.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 26.4 ttp85 -49.67 -63.17 1.19 Allowed 'General case' 0 C--O 1.231 0.103 0 O-C-N 124.034 0.49 . . . . 38.920000000000002 112.119 -174.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.8 m -69.8 -26.37 64.23 Favored 'General case' 0 C--O 1.247 0.948 0 CA-C-O 121.425 0.631 . . . . 35.539999999999999 112.096 -173.586 -74.992 -53.039 -88.128 102.205 2.028 106.629 -27.497 -70.627 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -59.2 -54.36 47.84 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-N 115.255 -0.884 . . . . 32.130000000000003 109.475 172.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.5 tp -60.88 -39.43 89.18 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 124.322 1.014 . . . . 30.809999999999999 112.578 -177.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.8 -53.93 51.38 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 115.839 -0.619 . . . . 31.739999999999998 109.544 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -46.06 -41.13 11.71 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.101 1.149 . . . . 32.159999999999997 114.101 171.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.24 -29.56 28.37 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.282 -0.417 . . . . 33.270000000000003 111.581 -171.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 38.2 mtt -73.91 -46.72 42.69 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 120.716 -0.394 . . . . 36.57 110.177 172.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.585 ' HD2' HD22 ' A' ' 129' ' ' LEU . 16.5 tttt -55.29 -40.11 70.68 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 123.778 0.674 . . . . 38.729999999999997 110.556 178.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -65.62 -41.48 92.65 Favored 'General case' 0 C--O 1.241 0.626 0 O-C-N 123.656 0.597 . . . . 46.049999999999997 111.941 178.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.597 ' HB3' HG11 ' A' ' 92' ' ' VAL . 40.2 m80 -77.44 12.82 1.4 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 113.593 0.96 . . . . 40.090000000000003 113.593 177.386 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.97 27.84 44.01 Favored Glycine 0 CA--C 1.507 -0.416 0 CA-C-N 115.825 -0.625 . . . . 41.229999999999997 112.8 168.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.464 HD13 HG13 ' A' ' 92' ' ' VAL . 4.7 tp -84.44 -50.34 7.86 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.525 0.935 . . . . 42.359999999999999 113.525 -174.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -44.92 129.77 7.33 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.889 -0.412 . . . . 47.840000000000003 109.889 -179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 55.68 27.12 10.15 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 116.828 2.159 . . . . 44.119999999999997 116.828 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -74.29 126.0 29.69 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.761 -1.2 . . . . 50.229999999999997 107.761 167.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 52.69 23.81 2.87 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 114.063 1.134 . . . . 50.859999999999999 114.063 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.72 9.12 57.8 Favored Glycine 0 CA--C 1.516 0.112 0 CA-C-N 115.8 -0.636 . . . . 39.799999999999997 114.157 174.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -105.65 97.09 6.97 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.436 0.532 . . . . 35.549999999999997 112.436 -173.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -54.57 168.82 0.24 Allowed 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.257 -0.645 . . . . 32.079999999999998 109.257 -177.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.462 HD23 HD11 ' A' ' 129' ' ' LEU . 11.4 tp -63.73 -36.11 82.79 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 114.676 1.362 . . . . 31.390000000000001 114.676 -171.33 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -53.78 -28.73 39.77 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 115.822 1.089 . . . . 31.530000000000001 115.822 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 46.0 m-20 -60.77 -72.78 0.1 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 109.129 -0.693 . . . . 33.670000000000002 109.129 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -44.97 -42.73 8.49 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.022 -0.536 . . . . 29.300000000000001 112.387 -177.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.59 -34.76 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 112.682 0.623 . . . . 28.300000000000001 112.682 -177.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.9 t -65.01 -53.81 40.27 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.84 -0.8 . . . . 30.43 108.84 173.288 -168.634 -97.467 -92.084 103.851 1.996 104.764 -92.2 -57.589 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -48.28 -51.7 24.66 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.949 0.9 . . . . 27.260000000000002 111.761 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.18 -54.32 41.38 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.443 -1.253 . . . . 25.140000000000001 108.709 177.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.836 ' HD2' ' CE2' ' A' ' 38' ' ' PHE . 5.5 tptt -46.78 -54.57 9.5 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.604 -0.725 . . . . 34.030000000000001 109.498 -177.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -79.27 -39.14 33.72 Favored 'General case' 0 C--O 1.258 1.505 0 N-CA-C 115.678 1.733 . . . . 27.329999999999998 115.678 -170.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -62.69 -51.26 67.89 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.101 -1.074 . . . . 24.140000000000001 108.101 173.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 14.1 p -131.17 -13.18 3.53 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 119.702 3.223 . . . . 27.620000000000001 119.702 -164.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 76.31 22.77 1.26 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.395 0.543 . . . . 28.600000000000001 112.376 178.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.836 ' CE2' ' HD2' ' A' ' 33' ' ' LYS . 55.5 m-85 69.13 17.99 8.33 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.129 -0.942 . . . . 31.41 112.999 -179.938 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 62.2 t-20 -96.61 123.0 40.15 Favored 'General case' 0 CA--C 1.487 -1.456 0 N-CA-C 107.269 -1.382 . . . . 28.07 107.269 -178.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.623 ' O ' ' HA ' ' A' ' 84' ' ' LEU . 19.1 p -75.45 -14.17 60.42 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 118.33 -1.348 . . . . 26.239999999999998 112.923 -177.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -99.07 2.45 46.13 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 114.757 1.392 . . . . 27.66 114.757 -174.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.32 130.74 45.0 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 115.041 1.497 . . . . 24.690000000000001 115.041 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 37.5 p -124.49 153.24 42.32 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.129 0.418 . . . . 26.559999999999999 112.129 168.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -139.07 135.59 34.34 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.401 0.519 . . . . 32.479999999999997 112.401 162.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -79.32 133.5 36.62 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 109.793 -0.447 . . . . 44.0 109.793 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -92.38 151.7 20.12 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 118.679 -1.208 . . . . 31.23 109.755 173.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -52.84 -28.01 20.92 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 114.575 1.324 . . . . 32.5 114.575 -179.142 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -85.39 -3.85 58.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 112.346 0.498 . . . . 31.52 112.346 -174.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.74 -23.83 12.79 Favored Glycine 0 C--O 1.222 -0.619 0 N-CA-C 114.37 0.508 . . . . 29.09 114.37 -179.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.7 p -67.63 158.25 32.6 Favored 'General case' 0 C--O 1.257 1.472 0 CA-C-O 122.396 1.093 . . . . 27.199999999999999 113.501 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.2 m -128.67 136.75 51.05 Favored 'General case' 0 CA--C 1.497 -1.07 0 CA-C-N 114.784 -1.098 . . . . 26.57 108.278 176.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.577 ' OD2' ' O6 ' ' A' ' 130' ' ' NAG . 13.9 m-20 -93.57 138.6 31.66 Favored 'General case' 0 C--O 1.239 0.549 0 O-C-N 123.919 0.762 . . . . 31.489999999999998 109.046 176.321 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.417 ' CD1' ' HB3' ' A' ' 80' ' ' CYS . 90.8 m-85 -123.66 126.62 46.91 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 118.386 2.736 . . . . 27.27 118.386 -175.861 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.88 -165.15 33.05 Favored Glycine 0 N--CA 1.466 0.698 0 N-CA-C 117.166 1.626 . . . . 27.140000000000001 117.166 162.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.4 tp -48.22 -37.04 6.85 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.382 0 C-N-CA 125.179 1.392 . . . . 30.52 114.196 -174.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 24.0 mt -115.55 14.46 16.58 Favored 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.74 -0.6 . . . . 22.93 110.264 -179.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 48.03 54.75 9.64 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-O 121.954 0.883 . . . . 22.030000000000001 112.906 178.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 60.5 mt -72.54 143.84 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 N-CA-C 108.313 -0.995 . . . . 24.059999999999999 108.313 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -107.1 138.37 43.4 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.362 1.865 . . . . 26.199999999999999 112.878 -160.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.6 p -81.41 -13.41 58.3 Favored 'General case' 0 C--O 1.248 1.024 0 C-N-CA 123.307 0.643 . . . . 26.629999999999999 111.524 -165.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.729 ' O ' ' HB2' ' A' ' 72' ' ' SER . 3.5 tpt180 -55.62 -53.34 57.7 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-N 113.473 -1.694 . . . . 40.869999999999997 108.872 179.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -110.87 -33.3 6.56 Favored 'General case' 0 C--O 1.253 1.257 0 O-C-N 123.781 0.676 . . . . 42.420000000000002 111.854 -173.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -103.21 -30.47 10.65 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 118.997 2.962 . . . . 29.789999999999999 118.997 -154.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 28.0 p -142.42 176.27 9.13 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.668 -0.413 . . . . 29.170000000000002 110.222 -177.998 60.666 84.789 97.011 101.924 1.996 104.075 -66.89 -62.407 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -119.53 116.5 26.21 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 120.918 0.389 . . . . 33.289999999999999 111.296 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 42.3 p30 -112.48 -3.46 14.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.426 -0.806 . . . . 32.789999999999999 110.176 170.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 64.23 28.4 72.91 Favored Glycine 0 C--O 1.243 0.673 0 N-CA-C 115.278 0.871 . . . . 34.920000000000002 115.278 174.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.459 ' HG2' ' NH1' ' A' ' 68' ' ' ARG . 1.5 ptt-85 -143.96 22.74 1.74 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.645 0.778 . . . . 61.109999999999999 112.099 167.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.7 m -115.05 89.32 19.55 Favored Pre-proline 0 C--O 1.241 0.645 0 N-CA-C 107.203 -1.406 . . . . 36.409999999999997 107.203 173.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -58.85 139.9 92.84 Favored 'Trans proline' 0 CA--C 1.503 -1.051 0 C-N-CA 122.152 1.902 . . . . 36.979999999999997 112.082 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 74.58 12.51 82.47 Favored Glycine 0 CA--C 1.503 -0.707 0 O-C-N 124.061 0.851 . . . . 37.240000000000002 112.63 172.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . 0.729 ' HB2' ' O ' ' A' ' 61' ' ' ARG . 96.2 p -98.66 166.1 11.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.444 0.64 . . . . 37.789999999999999 112.409 -174.768 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.5 mmm-85 -101.84 179.05 4.44 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 115.081 -0.963 . . . . 46.210000000000001 110.148 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -149.32 76.44 1.32 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 103.211 -2.885 . . . . 40.759999999999998 103.211 175.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 95.0 mt -83.54 -11.65 57.15 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.404 0.89 . . . . 37.840000000000003 113.404 -171.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 7.6 m -95.15 -9.26 34.0 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 120.466 -0.494 . . . . 38.200000000000003 110.348 178.546 -84.577 169.518 102.07 102.943 2.039 104.578 36.843 -160.322 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 63.96 45.2 4.36 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 112.782 0.66 . . . . 43.07 112.782 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.461 HD11 HD21 ' A' ' 83' ' ' LEU . 18.9 pt -141.44 154.9 67.42 Favored Pre-proline 0 N--CA 1.465 0.292 0 CA-C-N 116.045 -0.525 . . . . 37.200000000000003 111.631 176.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.0 156.93 55.52 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 N-CA-C 108.339 -1.447 . . . . 34.119999999999997 108.339 165.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.417 ' HB3' ' CD1' ' A' ' 53' ' ' TYR . 71.0 m -76.66 -24.06 53.26 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.887 0.699 . . . . 32.049999999999997 112.887 -173.058 -62.407 -66.89 97.011 104.075 1.996 101.924 84.789 60.666 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 81.0 p -63.24 -16.35 59.95 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 114.715 1.376 . . . . 31.27 114.715 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.88 -10.01 59.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 109.879 -0.415 . . . . 30.670000000000002 109.879 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.461 HD21 HD11 ' A' ' 78' ' ' ILE . 64.5 mt -92.42 -13.23 30.35 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.004 -0.998 . . . . 29.719999999999999 111.712 -179.243 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.623 ' HA ' ' O ' ' A' ' 40' ' ' THR . 8.5 mt -90.35 -9.53 47.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.102 0.477 . . . . 30.289999999999999 110.892 178.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.9 t -58.08 148.69 25.63 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 113.168 0.803 . . . . 30.98 113.168 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 94.5 p -68.89 -34.01 74.7 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.636 -0.876 . . . . 30.859999999999999 108.636 178.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.572 ' OD1' ' OG1' ' A' ' 89' ' ' THR . 33.7 t0 -69.08 137.5 53.55 Favored 'General case' 0 C--N 1.281 -2.393 0 O-C-N 118.43 -2.669 . . . . 36.630000000000003 107.666 164.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 7.2 pt -108.72 8.3 9.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 O-C-N 119.514 -1.991 . . . . 31.870000000000001 114.015 -173.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . 0.572 ' OG1' ' OD1' ' A' ' 87' ' ' ASP . 2.0 m -53.95 -57.89 9.31 Favored 'General case' 0 C--N 1.252 -3.657 0 O-C-N 124.537 1.148 . . . . 33.170000000000002 112.136 -173.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -49.29 -51.72 32.14 Favored 'General case' 1 C--N 1.449 4.915 0 C-N-CA 125.167 1.387 . . . . 32.710000000000001 109.62 177.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.02 -53.72 18.87 Favored 'General case' 0 CA--C 1.507 -0.703 0 O-C-N 124.466 1.104 . . . . 31.960000000000001 108.933 177.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.597 HG11 ' HB3' ' A' ' 15' ' ' HIS . 32.0 t -65.15 -49.0 81.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.689 -0.687 . . . . 32.979999999999997 111.221 -176.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 64.8 m-20 -57.71 -34.07 69.07 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 120.013 -0.675 . . . . 37.210000000000001 112.535 -179.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.7 t -68.7 -49.5 58.38 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 123.242 0.339 . . . . 38.0 110.346 176.352 -160.322 36.843 102.07 104.578 2.039 102.943 169.518 -84.577 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -43.06 -41.1 3.4 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 116.769 -0.196 . . . . 35.939999999999998 111.46 174.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 38.4 mttt -63.85 -33.19 75.12 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 113.222 0.823 . . . . 38.049999999999997 113.222 -173.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -83.39 -24.27 32.04 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.071 0.948 . . . . 39.289999999999999 110.973 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 71.1 mt -86.27 -46.45 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.804 0 N-CA-C 107.314 -1.365 . . . . 34.57 107.314 -178.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.52 -38.1 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 C-N-CA 119.146 -1.022 . . . . 33.32 108.76 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 56.3 m -71.2 -3.71 21.66 Favored 'General case' 0 C--O 1.211 -0.96 0 N-CA-C 115.458 1.651 . . . . 34.869999999999997 115.458 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -71.63 -10.59 60.0 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 117.534 2.42 . . . . 38.640000000000001 117.534 -173.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.32 -2.0 43.39 Favored Glycine 0 N--CA 1.468 0.823 0 N-CA-C 115.607 1.003 . . . . 34.460000000000001 115.607 175.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -106.35 1.43 25.77 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.212 -0.595 . . . . 37.840000000000003 111.489 164.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 64.74 -138.63 40.18 Favored Glycine 0 CA--C 1.502 -0.763 0 N-CA-C 108.465 -1.854 . . . . 29.789999999999999 108.465 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 61.8 mtp -90.61 4.99 49.8 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 119.581 -0.848 . . . . 26.370000000000001 110.847 -178.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.5 m-80 -59.66 -19.54 50.14 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.142 0.496 . . . . 26.0 110.086 167.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.46 -29.93 62.28 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.786 -0.643 . . . . 21.530000000000001 110.024 177.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 25.7 m-90 -94.76 112.37 24.1 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 111.864 0.32 . . . . 19.620000000000001 111.864 177.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.585 ' CG2' ' H5 ' ' A' ' 130' ' ' NAG . 4.8 t -55.54 -53.81 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 119.582 -0.847 . . . . 20.489999999999998 109.464 -174.012 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -45.61 -44.73 13.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 O-C-N 124.034 0.834 . . . . 22.77 111.25 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 89.4 t90 -64.49 -55.84 18.02 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-O 121.347 0.594 . . . . 25.02 111.303 -172.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -55.51 -46.07 77.04 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 107.369 -1.345 . . . . 38.340000000000003 107.369 -175.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -79.91 -24.42 41.1 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 114.82 1.415 . . . . 31.559999999999999 114.82 -172.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -127.27 -17.75 4.67 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.672 2.101 . . . . 31.039999999999999 116.672 -168.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 65.1 m -117.78 -41.21 2.93 Favored 'General case' 0 CA--C 1.504 -0.809 0 O-C-N 123.332 0.395 . . . . 29.329999999999998 111.616 179.887 -57.589 -92.2 -92.084 104.764 1.996 103.851 -97.467 -168.634 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -43.39 130.54 4.96 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.532 -0.467 . . . . 29.789999999999999 111.146 -178.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 70.12 15.59 72.25 Favored Glycine 0 C--O 1.223 -0.544 0 N-CA-C 116.245 1.258 . . . . 30.760000000000002 116.245 173.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 62.6 p -108.99 175.76 5.34 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 117.556 0.678 . . . . 33.109999999999999 109.425 174.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -80.2 90.77 5.51 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 108.213 -1.032 . . . . 43.399999999999999 108.213 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 29.3 m -76.78 -18.81 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.111 0 CA-C-N 114.838 -1.074 . . . . 38.909999999999997 112.921 -173.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -60.85 -42.27 97.48 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.676 0.391 . . . . 48.969999999999999 110.546 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -36.0 -31.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.786 1.032 . . . . 38.549999999999997 113.786 174.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -78.73 -14.02 59.5 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.639 0.607 . . . . 38.189999999999998 112.639 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 22.9 pt -116.34 -4.04 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 116.469 -0.332 . . . . 41.479999999999997 111.458 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.2 ttm180 -50.91 133.02 27.21 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 124.124 0.97 . . . . 43.200000000000003 108.61 170.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 83.4 13.41 76.45 Favored Glycine 0 N--CA 1.473 1.148 0 N-CA-C 116.54 1.376 . . . . 43.57 116.54 176.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 84.9 m -103.97 129.75 51.57 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.196 1.554 . . . . 44.450000000000003 115.196 -168.893 -70.627 -27.497 -88.128 106.629 2.028 102.205 -53.039 -74.992 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 24.5 tpt85 -74.47 89.53 2.16 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 106.393 -1.706 . . . . 53.020000000000003 106.393 177.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.585 HD22 ' HD2' ' A' ' 13' ' ' LYS . 3.6 mt . . . . . 0 C--O 1.234 0.259 0 CA-C-N 114.324 -1.307 . . . . 48.590000000000003 112.389 -170.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1130 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1131 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1132 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1133 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1134 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1135 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1136 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1137 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1138 ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' NAG . . . . . 0.585 ' H5 ' ' CG2' ' A' ' 109' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2081 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2099 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2124 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2127 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2128 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2129 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2131 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2139 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_