data_3iqc_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 3iqc _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.376 0 N-CA-C 113.054 0.761 . . . . 102.23999999999999 113.054 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 178.74 122.25 0.05 OUTLIER 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 114.674 1.361 . . . . 99.140000000000001 114.674 -163.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -170.9 169.2 6.87 Favored 'General case' 0 N--CA 1.515 2.784 0 N-CA-C 114.178 1.177 . . . . 103.73 114.178 -179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 48.79 54.21 11.1 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 114.833 1.42 . . . . 98.590000000000003 114.833 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . 0.642 ' CD1' ' C ' ' A' ' 7' ' ' TYR . 3.8 p90 -157.85 158.68 35.59 Favored 'General case' 2 CA--C 1.632 4.12 0 N-CA-C 121.32 3.822 . . . . 92.75 121.32 -176.205 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -121.78 109.62 14.91 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 112.338 -2.21 . . . . 89.640000000000001 105.039 160.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -107.58 9.0 29.52 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.219 -0.901 . . . . 78.549999999999997 112.373 -171.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' TYR . . . . . 0.643 ' CD2' ' CD1' ' A' ' 24' ' ' ILE . 91.6 m-85 -124.67 164.08 20.65 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.073 0.949 . . . . 73.890000000000001 111.749 -178.318 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -110.03 147.38 33.65 Favored 'General case' 0 CA--C 1.576 1.95 0 C-N-CA 126.999 2.12 . . . . 88.549999999999997 115.206 -173.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.163 0 C-N-CA 124.892 1.277 . . . . 87.329999999999998 109.155 -179.047 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 . . . . . 0 N--CA 1.47 0.547 0 N-CA-C 112.09 0.404 . . . . 105.65000000000001 112.09 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . 0.446 ' O ' ' OG ' ' A' ' 19' ' ' SER . 0.3 OUTLIER -139.71 91.32 10.65 Favored Pre-proline 0 CA--C 1.557 1.232 0 N-CA-C 118.236 2.68 . . . . 97.310000000000002 118.236 -160.217 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.49 -30.02 71.84 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 N-CA-C 115.113 1.159 . . . . 89.609999999999999 115.113 -177.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.82 -41.6 99.38 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 116.089 1.885 . . . . 79.400000000000006 116.089 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -55.84 -34.67 65.64 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-O 122.031 0.92 . . . . 83.760000000000005 112.744 177.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.25 -42.15 99.15 Favored 'General case' 0 CA--C 1.472 -2.044 0 CA-C-N 115.727 -0.67 . . . . 66.670000000000002 111.655 179.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ILE . . . . . 0.643 ' CD1' ' CD2' ' A' ' 10' ' ' TYR . 38.0 mt -65.2 -44.75 95.19 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.401 0 C-N-CA 119.963 -0.695 . . . . 55.170000000000002 111.217 178.603 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -49.51 -48.53 48.04 Favored 'General case' 0 C--O 1.178 -2.703 0 C-N-CA 122.541 0.336 . . . . 67.030000000000001 110.594 174.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 42.0 mmm -59.39 -40.61 87.11 Favored 'General case' 0 C--O 1.188 -2.174 0 CA-C-O 121.507 0.67 . . . . 68.140000000000001 111.562 -178.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.1 mt -67.98 -51.45 47.19 Favored 'General case' 0 C--O 1.276 2.476 0 O-C-N 120.554 -1.341 . . . . 55.939999999999998 107.464 -176.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -56.11 -36.07 67.79 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 118.707 -0.664 . . . . 55.82 111.796 175.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -68.54 -49.73 57.34 Favored 'General case' 0 C--O 1.182 -2.482 0 CA-C-N 119.75 1.159 . . . . 78.530000000000001 110.264 177.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -43.36 -44.8 6.46 Favored Glycine 0 C--N 1.316 -0.558 0 O-C-N 121.688 -0.632 . . . . 56.060000000000002 114.005 168.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 94.6 mt -63.38 -51.35 71.9 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 C-N-CA 119.488 -0.885 . . . . 52.57 109.873 -178.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.1 mt -48.09 -57.11 6.27 Favored 'General case' 0 C--O 1.168 -3.187 0 C-N-CA 125.873 1.669 . . . . 55.490000000000002 111.714 173.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ARG . . . . . 0.707 ' NH1' ' O ' ' A' ' 128' ' ' HOH . 0.1 OUTLIER -58.07 -49.9 75.32 Favored 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 118.01 2.596 . . . . 64.939999999999998 118.01 -178.764 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -78.32 -27.11 47.12 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 108.085 -1.08 . . . . 64.829999999999998 108.085 -172.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.1 m -71.07 -44.85 64.9 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 105.825 -1.917 . . . . 60.969999999999999 105.825 -178.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.2 t -62.93 -40.28 97.15 Favored 'General case' 0 C--O 1.193 -1.916 0 CA-C-N 113.091 -1.868 . . . . 68.120000000000005 109.815 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -70.43 -39.65 74.26 Favored 'General case' 0 C--O 1.193 -1.875 0 CA-C-O 122.421 1.105 . . . . 78.909999999999997 109.687 177.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.33 82.44 Favored 'General case' 0 CA--C 1.561 1.4 0 N-CA-C 113.873 1.064 . . . . 69.010000000000005 113.873 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -58.23 -55.72 31.3 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.634 1.174 . . . . 84.840000000000003 110.095 175.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -38.83 -53.72 1.67 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 125.062 1.345 . . . . 96.760000000000005 110.224 169.35 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.1 m -65.29 -35.55 81.35 Favored 'General case' 0 CA--C 1.491 -1.308 0 N-CA-C 113.858 1.059 . . . . 80.400000000000006 113.858 -172.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.5 mt -63.14 -46.07 96.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 N-CA-C 112.63 0.604 . . . . 84.299999999999997 112.63 174.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -56.71 -53.29 59.44 Favored 'General case' 0 C--O 1.206 -1.224 0 O-C-N 125.239 1.587 . . . . 92.159999999999997 111.603 175.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -71.68 -4.18 25.94 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.918 1.451 . . . . 99.290000000000006 114.918 179.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 47.77 54.48 9.83 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 114.773 1.397 . . . . 109.06999999999999 114.773 -166.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -102.69 94.81 5.82 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 105.783 -1.932 . . . . 101.33 105.783 166.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 19.3 mm -66.33 -49.71 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 N-CA-C 113.462 0.912 . . . . 87.950000000000003 113.462 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.3 mp0 -49.85 -53.41 25.82 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.316 -0.624 . . . . 96.489999999999995 109.316 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -65.9 -28.03 68.64 Favored 'General case' 0 C--O 1.208 -1.107 0 CA-C-O 121.705 0.764 . . . . 102.16 109.824 -173.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -71.61 -49.95 35.37 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 113.482 0.919 . . . . 77.049999999999997 113.482 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.6 mt -53.32 -45.26 55.99 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.884 0 N-CA-C 106.715 -1.587 . . . . 67.450000000000003 106.715 174.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -51.71 -59.92 3.75 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 120.285 -1.509 . . . . 66.650000000000006 111.35 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -65.64 -40.14 92.17 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.311 -0.859 . . . . 70.219999999999999 109.613 -169.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 17.7 mt -60.77 -46.88 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.547 0 N-CA-C 115.417 1.636 . . . . 60.450000000000003 115.417 172.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -59.3 -29.88 67.92 Favored 'General case' 0 N--CA 1.423 -1.801 0 O-C-N 123.751 0.657 . . . . 65.030000000000001 111.21 -179.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -37.37 67.08 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-O 118.952 -0.547 . . . . 68.239999999999995 111.35 175.956 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.2 t -68.69 -41.74 82.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 105.771 -1.937 . . . . 55.259999999999998 105.771 -179.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 m -62.61 -50.3 71.79 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 123.595 0.758 . . . . 57.210000000000001 110.431 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -49.18 -30.3 6.68 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 114.885 1.439 . . . . 65.390000000000001 114.885 173.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 50.5 mt -76.16 -56.63 7.85 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.428 0 CA-C-O 120.816 0.341 . . . . 54.450000000000003 111.732 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -51.43 -37.87 50.73 Favored 'General case' 0 C--O 1.198 -1.642 0 C-N-CA 118.759 -1.177 . . . . 53.979999999999997 113.956 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.1 m -61.07 -38.19 85.33 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 123.508 0.505 . . . . 58.719999999999999 111.1 173.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -69.34 -41.9 76.01 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-O 121.69 0.757 . . . . 67.909999999999997 109.997 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 28.3 mt -62.32 -39.02 91.67 Favored 'General case' 0 C--O 1.202 -1.412 0 N-CA-C 106.957 -1.497 . . . . 56.619999999999997 106.957 -177.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.54 -36.14 83.24 Favored 'General case' 0 C--O 1.185 -2.311 0 O-C-N 120.294 -1.504 . . . . 62.469999999999999 111.635 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -77.57 -18.08 57.24 Favored 'General case' 0 C--O 1.194 -1.85 0 O-C-N 121.252 -0.905 . . . . 76.780000000000001 112.137 -171.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.8 pt -110.91 18.72 7.07 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.614 0 CA-C-N 119.294 0.952 . . . . 67.069999999999993 110.851 -175.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.9 mt -76.27 137.02 39.66 Favored 'General case' 0 CA--C 1.561 1.373 0 O-C-N 120.007 -1.683 . . . . 70.219999999999999 112.348 171.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -98.85 106.74 19.04 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.921 0.888 . . . . 83.379999999999995 111.842 175.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -73.45 -24.05 60.18 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 118.529 -0.748 . . . . 80.480000000000004 112.032 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -75.57 -57.88 3.62 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 121.544 0.688 . . . . 90.810000000000002 112.348 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -85.74 -16.17 39.8 Favored 'General case' 0 C--O 1.208 -1.08 0 N-CA-C 114.82 1.415 . . . . 83.609999999999999 114.82 -173.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -95.43 -14.75 46.49 Favored Glycine 0 C--O 1.248 1.03 0 N-CA-C 115.242 0.857 . . . . 73.370000000000005 115.242 -177.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 53.81 -138.34 38.21 Favored Glycine 0 N--CA 1.435 -1.372 0 CA-C-O 122.449 1.027 . . . . 72.609999999999999 112.586 169.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.39 -33.98 77.22 Favored 'General case' 0 C--O 1.199 -1.56 0 CA-C-O 123.552 1.644 . . . . 71.390000000000001 108.909 -168.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.2 t -71.37 -28.09 30.98 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.554 0 CA-C-N 114.96 -1.018 . . . . 67.400000000000006 111.392 179.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.64 72.86 Favored 'General case' 0 C--O 1.282 2.776 0 CA-C-N 120.458 1.481 . . . . 65.420000000000002 113.054 168.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 49.2 t -72.84 -44.95 57.55 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 N-CA-C 106.286 -1.746 . . . . 67.829999999999998 106.286 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -58.83 -48.54 80.98 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 112.589 0.588 . . . . 67.510000000000005 112.589 -179.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 49.2 mt -61.13 -35.61 77.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.462 1.652 . . . . 56.289999999999999 115.462 175.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.9 m -58.78 -38.39 78.43 Favored 'General case' 0 C--O 1.257 1.465 0 N-CA-C 105.18 -2.156 . . . . 56.469999999999999 105.18 176.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.82 -40.69 84.8 Favored Glycine 0 C--O 1.207 -1.562 0 C-N-CA 119.259 -1.448 . . . . 57.740000000000002 112.085 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.4 tp -66.47 -49.59 66.13 Favored 'General case' 0 CA--C 1.488 -1.432 0 CA-C-N 113.737 -1.232 . . . . 57.340000000000003 108.088 -175.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' TYR . . . . . 0.437 ' OH ' ' OH ' ' A' ' 10' ' ' TYR . 18.0 m-30 -67.94 -47.03 69.81 Favored 'General case' 0 N--CA 1.425 -1.707 0 N-CA-C 115.418 1.636 . . . . 59.119999999999997 115.418 -176.516 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 48.9 p -66.08 -35.94 81.86 Favored 'General case' 0 C--O 1.254 1.334 0 N-CA-C 107.918 -1.141 . . . . 66.030000000000001 107.918 -174.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -61.02 -51.92 67.19 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 113.525 0.935 . . . . 71.189999999999998 113.525 171.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -49.51 -37.13 25.48 Favored 'General case' 0 C--O 1.191 -1.989 0 CA-C-N 114.314 -1.312 . . . . 66.0 110.201 175.066 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 95.0 mt -70.17 -36.67 68.89 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.82 0 CA-C-N 120.464 1.484 . . . . 62.240000000000002 109.117 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.5 tttt -71.2 -45.13 64.05 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 122.342 1.068 . . . . 73.099999999999994 108.779 -174.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 20.0 t -55.58 -46.16 79.02 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.557 0 CA-C-N 112.629 -2.078 . . . . 66.519999999999996 110.98 174.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.6 mt -56.95 -49.46 75.61 Favored 'General case' 0 CA--C 1.557 1.215 0 O-C-N 121.905 -0.497 . . . . 66.980000000000004 111.932 174.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.2 m -58.01 -37.66 74.73 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 121.346 -0.847 . . . . 74.569999999999993 110.412 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -67.66 -43.22 80.76 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.613 1.197 . . . . 79.930000000000007 112.523 179.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.67 -36.07 81.68 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.266 -0.879 . . . . 81.140000000000001 109.135 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.8 t-20 -64.31 -66.2 0.57 Allowed 'General case' 0 CA--C 1.489 -1.376 0 C-N-CA 124.069 0.947 . . . . 86.040000000000006 109.219 175.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.0 t -58.75 -45.11 91.35 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 CA-C-N 116.145 -0.48 . . . . 92.420000000000002 110.634 -168.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . 0.609 ' OE2' ' NZ ' ' A' ' 102' ' ' LYS . 3.2 pt-20 -102.29 8.75 40.3 Favored 'General case' 0 C--O 1.257 1.497 0 N-CA-C 113.265 0.839 . . . . 94.989999999999995 113.265 -171.686 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 58.1 54.93 5.52 Favored 'General case' 0 CA--C 1.555 1.162 0 N-CA-C 114.648 1.351 . . . . 95.629999999999995 114.648 170.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -115.93 118.6 33.41 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 121.513 -0.742 . . . . 91.010000000000005 109.366 -173.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -81.81 -31.12 31.9 Favored 'General case' 0 C--O 1.198 -1.625 0 CA-C-O 118.62 -0.705 . . . . 86.109999999999999 112.772 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 99.5 p -56.14 -30.61 62.39 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 119.277 0.944 . . . . 84.819999999999993 110.378 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . 0.609 ' NZ ' ' OE2' ' A' ' 97' ' ' GLU . 34.9 mttt -71.97 -45.51 60.78 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 114.372 -1.286 . . . . 75.819999999999993 114.259 -178.924 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 24.5 mt -59.89 -36.98 69.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 C-N-CA 120.272 -0.571 . . . . 68.219999999999999 112.447 170.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -51.91 -37.41 52.4 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 114.511 1.3 . . . . 81.340000000000003 114.511 168.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.29 -44.23 88.6 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 119.901 -0.72 . . . . 74.150000000000006 109.239 -179.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 80.8 t -64.48 -50.13 77.51 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.17 0 N-CA-C 113.163 0.801 . . . . 64.189999999999998 113.163 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -46.69 -51.65 15.58 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 115.719 1.748 . . . . 64.019999999999996 115.719 167.012 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 34.6 m-20 -58.83 -30.14 67.43 Favored 'General case' 0 CA--C 1.478 -1.794 0 N-CA-C 106.682 -1.599 . . . . 75.969999999999999 106.682 176.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.38 -47.03 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 C-N-CA 117.008 -1.877 . . . . 61.549999999999997 110.354 -173.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.84 -29.39 69.29 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 120.427 -0.509 . . . . 59.920000000000002 111.098 -178.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 38.1 mtm180 -60.91 -48.07 83.5 Favored 'General case' 0 N--CA 1.419 -1.978 0 CA-C-N 119.021 0.828 . . . . 93.930000000000007 110.928 173.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -61.96 -39.39 97.49 Favored Glycine 0 C--O 1.184 -3.017 0 C-N-CA 118.808 -1.663 . . . . 62.770000000000003 112.355 -178.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 55.4 mt -65.17 -43.71 90.88 Favored 'General case' 0 CA--C 1.461 -2.449 0 O-C-N 120.962 -1.317 . . . . 60.670000000000002 108.709 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 51.7 tp -70.16 -41.3 73.99 Favored 'General case' 0 C--O 1.254 1.318 0 CA-C-O 121.948 0.88 . . . . 64.260000000000005 110.633 -173.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -60.17 -44.13 95.28 Favored 'General case' 0 C--O 1.2 -1.523 0 C-N-CA 119.089 -1.044 . . . . 75.640000000000001 110.393 176.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -64.38 -41.52 96.64 Favored 'General case' 0 C--O 1.197 -1.694 0 O-C-N 121.556 -0.715 . . . . 60.590000000000003 110.223 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' TRP . . . . . . . . . . . . . 72.2 t-105 -65.76 -44.27 86.39 Favored 'General case' 0 CA--C 1.483 -1.601 0 CA-C-O 118.508 -0.758 . . . . 61.979999999999997 110.113 -175.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 79.8 mtt180 -63.97 -40.02 95.45 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.07 1.507 . . . . 67.849999999999994 115.07 172.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -52.27 -45.35 65.4 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 113.953 1.094 . . . . 71.290000000000006 113.953 172.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 72.2 mt -72.4 -33.49 45.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 N-CA-C 114.374 1.249 . . . . 69.370000000000005 114.374 177.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 61.8 m80 -110.13 49.64 0.84 Allowed 'General case' 0 C--N 1.316 -0.859 0 O-C-N 121.547 -0.721 . . . . 71.950000000000003 112.025 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 48.2 t -56.71 -50.39 72.32 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.136 -1.393 . . . . 78.430000000000007 110.159 -168.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -71.54 -35.22 70.58 Favored 'General case' 0 CA--C 1.587 2.399 0 C-N-CA 118.86 -1.136 . . . . 87.650000000000006 113.794 -175.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -76.25 -34.66 59.18 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 126.346 1.858 . . . . 85.069999999999993 111.201 -169.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 19.8 mt -101.26 7.55 42.87 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 115.132 1.53 . . . . 74.629999999999995 115.132 -171.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.211 -0.97 0 C-N-CA 125.315 1.446 . . . . 80.840000000000003 111.557 172.957 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.49 1.291 0 N-CA-C 116.711 1.773 . . . . 114.59 116.711 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.58 -34.82 34.98 Favored 'General case' 0 C--N 1.308 -1.199 0 O-C-N 120.427 -1.421 . . . . 101.44 110.168 -175.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -60.13 -30.4 69.26 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.627 0.727 . . . . 114.67 110.373 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 29.6 tp -57.44 -53.63 55.91 Favored 'General case' 0 CA--C 1.485 -1.54 0 CA-C-N 115.622 -0.717 . . . . 81.819999999999993 111.336 173.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 12.4 mt -59.57 -45.4 94.08 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.437 0 O-C-N 124.469 1.105 . . . . 68.769999999999996 112.052 178.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -52.1 -49.41 63.67 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-O 122.274 1.035 . . . . 84.329999999999998 112.003 174.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -37.26 78.67 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 117.718 -1.593 . . . . 73.680000000000007 112.514 -179.493 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 76.0 mt -66.13 -43.65 86.51 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 124.14 0.9 . . . . 62.799999999999997 111.463 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -61.73 -38.2 87.05 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 115.302 -0.863 . . . . 68.870000000000005 112.518 173.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -68.9 -35.42 76.83 Favored 'General case' 0 C--O 1.195 -1.814 0 N-CA-C 114.24 1.2 . . . . 89.540000000000006 114.24 175.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.59 -46.51 94.27 Favored Glycine 0 C--O 1.21 -1.374 0 O-C-N 121.184 -0.948 . . . . 59.380000000000003 112.3 176.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ILE . . . . . . . . . . . . . 57.4 mt -57.68 -45.99 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.075 0 N-CA-C 107.555 -1.276 . . . . 54.009999999999998 107.555 174.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 7.9 mt -59.18 -38.17 79.15 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.02 -1.104 . . . . 64.049999999999997 108.02 -169.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 43.8 ttm-85 -85.12 -47.78 9.82 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-N 113.804 -1.544 . . . . 67.109999999999999 107.273 -164.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -70.37 -30.14 66.99 Favored 'General case' 0 CA--C 1.451 -2.836 0 CA-C-N 113.842 -1.527 . . . . 58.649999999999999 111.186 -176.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' SER . . . . . . . . . . . . . 17.5 m -70.43 -47.82 58.91 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 125.211 1.569 . . . . 59.359999999999999 107.138 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 21.6 t -58.87 -40.0 83.05 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 106.179 -1.786 . . . . 67.069999999999993 106.179 179.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -69.95 -46.35 65.46 Favored 'General case' 0 CA--C 1.577 1.986 0 C-N-CA 118.488 -1.285 . . . . 70.900000000000006 110.63 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -55.93 -39.77 72.18 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 119.369 0.986 . . . . 63.32 110.887 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -52.5 -61.96 1.95 Allowed 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 107.596 -1.261 . . . . 86.049999999999997 107.596 176.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -52.91 -36.57 59.71 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 115.121 -0.945 . . . . 86.290000000000006 111.751 -173.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' CYS . . . . . . . . . . . . . 99.2 m -68.79 -25.36 64.66 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.857 0.688 . . . . 70.129999999999995 112.857 -178.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 87.8 mt -74.28 -40.45 50.2 Favored 'Isoleucine or valine' 0 C--O 1.259 1.597 0 CA-C-O 120.823 0.344 . . . . 77.629999999999995 110.287 174.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -59.37 -42.92 92.75 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-N 115.512 -0.767 . . . . 83.469999999999999 108.976 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 61.8 m-20 -88.98 2.49 53.87 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 113.0 0.741 . . . . 91.640000000000001 113.0 -177.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 43.67 63.35 1.59 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 118.999 -0.524 . . . . 99.5 111.534 -170.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 -105.7 107.46 18.46 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 107.572 -1.27 . . . . 83.170000000000002 107.572 159.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 15.8 mm -80.21 -50.31 17.71 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.305 0 N-CA-C 105.897 -1.89 . . . . 75.069999999999993 105.897 -166.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -55.88 -42.28 75.7 Favored 'General case' 0 N--CA 1.414 -2.272 0 CA-C-N 114.227 -1.352 . . . . 79.010000000000005 111.016 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -68.27 -37.61 80.88 Favored 'General case' 0 CA--C 1.557 1.222 0 CA-C-O 122.417 1.103 . . . . 77.579999999999998 109.93 -176.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 ttpt -62.83 -49.41 75.02 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 115.106 1.521 . . . . 71.829999999999998 115.106 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ILE . . . . . . . . . . . . . 14.2 mt -54.4 -52.61 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.36 0 N-CA-C 107.536 -1.283 . . . . 56.979999999999997 107.536 174.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -42.88 -67.19 0.29 Allowed 'General case' 0 C--O 1.206 -1.22 0 CA-C-O 122.014 0.911 . . . . 55.25 109.385 173.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -62.03 -41.8 98.48 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.369 -1.457 . . . . 57.539999999999999 113.667 -171.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 6.0 mt -61.07 -41.38 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 C-N-CA 117.966 -1.493 . . . . 57.939999999999998 111.829 176.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -57.2 -28.91 63.26 Favored 'General case' 0 CA--C 1.481 -1.688 0 C-N-CA 118.016 -1.473 . . . . 58.140000000000001 110.675 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ARG . . . . . 0.546 ' NH1' ' OD2' ' B' ' 59' ' ' ASP . 0.0 OUTLIER -75.13 -39.71 60.3 Favored 'General case' 0 N--CA 1.426 -1.628 0 CA-C-N 114.249 -1.341 . . . . 59.619999999999997 108.494 -171.598 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' VAL . . . . . . . . . . . . . 4.8 t -70.06 -40.27 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.76 0 CA-C-N 115.318 -0.855 . . . . 56.899999999999999 109.77 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 7.4 m -58.62 -44.01 89.84 Favored 'General case' 0 C--O 1.179 -2.62 0 N-CA-C 108.044 -1.095 . . . . 59.259999999999998 108.044 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ASP . . . . . 0.546 ' OD2' ' NH1' ' B' ' 56' ' ' ARG . 48.0 m-20 -61.62 -25.92 67.66 Favored 'General case' 0 C--N 1.307 -1.274 0 O-C-N 121.149 -0.969 . . . . 63.18 110.747 -177.218 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ILE . . . . . . . . . . . . . 39.1 mt -80.09 -53.27 13.23 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.753 0 CA-C-N 115.344 -0.844 . . . . 58.859999999999999 108.871 -173.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -56.06 -26.89 51.2 Favored 'General case' 0 C--O 1.262 1.713 0 N-CA-C 115.538 1.681 . . . . 61.880000000000003 115.538 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' THR . . . . . . . . . . . . . 87.7 m -71.05 -49.01 49.44 Favored 'General case' 0 CA--C 1.496 -1.131 0 N-CA-C 107.301 -1.37 . . . . 66.150000000000006 107.301 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -49.63 -54.83 16.2 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 114.759 -1.109 . . . . 73.290000000000006 111.83 169.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 26.4 mt -50.83 -53.54 31.34 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.814 0.696 . . . . 68.450000000000003 110.555 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 23.7 mt -54.58 -38.6 66.91 Favored 'General case' 0 CA--C 1.552 1.035 0 N-CA-C 115.391 1.626 . . . . 76.670000000000002 115.391 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 -69.31 -12.23 61.49 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 117.904 2.557 . . . . 88.969999999999999 117.904 174.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . 0.263 39.2 pt -115.5 17.79 7.57 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.897 0 N-CA-C 115.472 1.656 . . . . 83.769999999999996 115.472 -178.001 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 21.2 mt -80.46 140.16 36.08 Favored 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 120.556 -1.34 . . . . 91.450000000000003 108.056 178.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -101.05 118.86 37.83 Favored 'General case' 0 CA--C 1.569 1.685 0 CA-C-N 115.068 -0.969 . . . . 113.0 110.886 173.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -84.99 -12.96 52.08 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 120.929 -1.107 . . . . 109.48999999999999 113.263 -174.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.33 -57.01 3.11 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 106.854 -1.536 . . . . 111.23999999999999 106.854 -174.383 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -80.08 -35.02 37.55 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 125.117 1.511 . . . . 106.06 111.145 -172.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLY . . . . . 0.456 ' O ' ' C ' ' B' ' 74' ' ' GLY . . . -80.77 2.57 79.01 Favored Glycine 0 CA--C 1.539 1.532 0 N-CA-C 116.876 1.51 . . . . 101.95999999999999 116.876 176.379 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLY . . . . . 0.456 ' C ' ' O ' ' B' ' 73' ' ' GLY . . . 24.01 -113.5 0.01 OUTLIER Glycine 0 C--N 1.339 0.749 0 CA-C-O 121.929 0.739 . . . . 104.56999999999999 114.354 -179.615 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -67.68 -37.95 83.03 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 115.011 1.485 . . . . 100.67 115.011 -172.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -79.04 -31.77 14.95 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.921 0 N-CA-C 108.164 -1.05 . . . . 96.260000000000005 108.164 -171.057 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -56.46 -49.37 74.81 Favored 'General case' 0 C--O 1.238 0.494 0 O-C-N 124.668 1.23 . . . . 90.010000000000005 108.797 169.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' VAL . . . . . . . . . . . . . 65.4 t -56.21 -54.41 27.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.027 0 C-N-CA 117.741 -1.584 . . . . 94.760000000000005 109.59 173.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -49.6 -36.92 25.81 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.436 0.902 . . . . 90.680000000000007 113.436 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 55.4 mt -77.33 -37.56 52.21 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 122.03 0.919 . . . . 76.5 112.171 -174.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 11.5 m -52.11 -52.05 53.91 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.01 -0.995 . . . . 74.310000000000002 109.106 167.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -57.59 -32.87 65.63 Favored Glycine 0 N--CA 1.429 -1.818 0 C-N-CA 120.645 -0.788 . . . . 76.519999999999996 114.057 176.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.0 tp -78.87 -48.16 15.2 Favored 'General case' 0 CA--C 1.474 -1.955 0 N-CA-C 108.949 -0.76 . . . . 75.420000000000002 108.949 -175.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 -69.49 -41.51 76.03 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 117.245 -1.359 . . . . 70.769999999999996 113.115 -178.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' THR . . . . . . . . . . . . . 76.8 p -65.17 -39.08 92.44 Favored 'General case' 0 C--O 1.279 2.637 0 N-CA-C 106.191 -1.781 . . . . 83.019999999999996 106.191 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -59.99 -43.88 94.86 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.534 -1.212 . . . . 91.700000000000003 111.353 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.94 -34.7 76.57 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.898 0.703 . . . . 78.019999999999996 112.898 -175.043 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 59.7 mt -70.3 -38.51 74.57 Favored 'Isoleucine or valine' 0 C--O 1.262 1.726 0 C-N-CA 125.313 1.445 . . . . 70.329999999999998 111.471 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -68.32 -48.38 65.03 Favored 'General case' 0 C--O 1.261 1.683 0 N-CA-C 108.31 -0.996 . . . . 91.349999999999994 108.31 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 15.9 t -54.36 -46.17 69.4 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.797 0 CA-C-N 114.894 -1.048 . . . . 78.689999999999998 110.407 173.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 18.3 mt -58.15 -54.59 45.3 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 113.457 0.91 . . . . 70.75 113.457 175.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 65.0 m -46.9 -39.17 11.66 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.77 0.828 . . . . 81.129999999999995 110.719 173.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -69.45 -50.82 42.09 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.514 -0.742 . . . . 93.909999999999997 110.191 -178.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.35 -42.61 70.46 Favored 'General case' 0 N--CA 1.444 -0.738 0 O-C-N 124.961 1.413 . . . . 83.409999999999997 110.256 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 63.2 t-20 -61.31 -57.83 10.72 Favored 'General case' 0 C--O 1.2 -1.535 0 N-CA-C 108.091 -1.077 . . . . 85.930000000000007 108.091 175.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 4.1 t -67.27 -43.46 88.11 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.652 0 N-CA-C 108.206 -1.035 . . . . 99.609999999999999 108.206 -163.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -108.02 14.94 24.77 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 123.69 0.619 . . . . 105.81 112.029 -170.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 51.99 47.54 24.55 Favored 'General case' 0 C--O 1.21 -1.016 0 N-CA-C 117.1 2.259 . . . . 96.189999999999998 117.1 171.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -110.67 118.72 36.95 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.408 1.083 . . . . 103.51000000000001 109.046 -175.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -81.06 -38.29 27.61 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.626 0.602 . . . . 91.620000000000005 112.626 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 22.4 p -47.51 -27.1 1.62 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.066 0.946 . . . . 97.549999999999997 110.946 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 39.8 mttt -75.98 -46.64 28.55 Favored 'General case' 0 C--O 1.259 1.57 0 CA-C-N 114.698 -1.137 . . . . 86.140000000000001 112.904 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 22.1 mt -55.58 -36.64 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 CA-C-O 119.146 -0.454 . . . . 75.719999999999999 110.037 171.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -55.87 -48.78 74.94 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 117.396 -1.721 . . . . 91.510000000000005 112.181 173.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 36.1 mt -52.38 -40.07 61.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 121.632 -0.668 . . . . 93.790000000000006 109.593 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 40.3 t -70.82 -51.93 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-O 121.232 0.539 . . . . 75.650000000000006 112.381 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -37.08 -52.66 0.99 Allowed 'General case' 0 CA--C 1.588 2.416 0 N-CA-C 114.427 1.269 . . . . 74.549999999999997 114.427 164.48 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -67.12 -24.65 65.94 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 121.257 0.551 . . . . 94.129999999999995 111.679 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 37.2 t -74.58 -60.87 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-O 118.314 -0.85 . . . . 76.329999999999998 111.847 177.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -51.83 -44.63 63.64 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 109.597 -0.52 . . . . 74.719999999999999 109.597 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' ARG . . . . . . . . . . . . . 27.4 mtm180 -49.57 -58.03 5.99 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 121.171 -0.212 . . . . 114.56 111.243 175.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . -57.14 -40.07 90.94 Favored Glycine 0 C--O 1.201 -1.937 0 O-C-N 124.808 1.318 . . . . 84.540000000000006 114.0 173.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 97.7 mt -66.36 -43.38 86.14 Favored 'General case' 0 C--O 1.247 0.93 0 CA-C-N 120.102 1.951 . . . . 81.260000000000005 109.876 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 62.6 tp -72.44 -35.42 68.28 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 112.912 0.708 . . . . 84.019999999999996 112.912 -171.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -63.43 -45.37 91.27 Favored 'General case' 0 CA--C 1.579 2.067 0 O-C-N 124.231 0.957 . . . . 109.04000000000001 110.324 173.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -53.85 -49.94 67.33 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.099 1.518 . . . . 88.420000000000002 115.099 168.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' TRP . . . . . . . . . . . . . 34.5 t-105 -55.79 -59.14 5.29 Favored 'General case' 0 N--CA 1.507 2.384 0 N-CA-C 114.853 1.427 . . . . 88.180000000000007 114.853 177.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 87.8 mtt180 -52.04 -49.16 63.98 Favored 'General case' 0 C--O 1.263 1.774 0 CA-C-N 115.709 -0.678 . . . . 98.189999999999998 112.38 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -48.11 -48.57 33.75 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-O 118.383 -0.818 . . . . 110.92 111.035 177.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 18.5 mt . . . . . 0 CA--C 1.553 1.066 0 CA-C-N 119.93 1.241 . . . . 102.55 108.868 168.314 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . 0.707 ' O ' ' NH1' ' A' ' 33' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.376 0 N-CA-C 113.054 0.761 . . . . 102.24 113.054 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 178.74 122.25 0.05 OUTLIER 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 114.674 1.361 . . . . 99.14 114.674 -163.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -170.9 169.2 6.87 Favored 'General case' 0 N--CA 1.515 2.784 0 N-CA-C 114.178 1.177 . . . . 103.73 114.178 -179.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 48.79 54.21 11.1 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 114.833 1.42 . . . . 98.59 114.833 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . 0.642 ' CD1' ' C ' ' A' ' 7' ' ' TYR . 3.8 p90 -157.85 158.68 35.59 Favored 'General case' 2 CA--C 1.632 4.12 0 N-CA-C 121.32 3.822 . . . . 92.75 121.32 -176.205 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -121.78 109.62 14.91 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 112.338 -2.21 . . . . 89.64 105.039 160.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -107.58 9.0 29.52 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.219 -0.901 . . . . 78.55 112.373 -171.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' TYR . . . . . 0.73 ' CD2' HD13 ' A' ' 24' ' ' ILE . 91.6 m-85 -124.67 164.08 20.65 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.073 0.949 . . . . 73.89 111.749 -178.318 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -110.03 147.38 33.65 Favored 'General case' 0 CA--C 1.576 1.95 0 C-N-CA 126.999 2.12 . . . . 88.55 115.206 -173.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.163 0 C-N-CA 124.892 1.277 . . . . 87.33 109.155 -179.047 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 . . . . . 0 N--CA 1.47 0.547 0 N-CA-C 112.09 0.404 . . . . 105.65 112.09 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . 0.47 ' HA ' ' HD2' ' A' ' 20' ' ' PRO . 0.3 OUTLIER -139.71 91.32 10.65 Favored Pre-proline 0 CA--C 1.557 1.232 0 N-CA-C 118.236 2.68 . . . . 97.31 118.236 -160.217 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PRO . . . . . 0.47 ' HD2' ' HA ' ' A' ' 19' ' ' SER . 9.5 Cg_endo -55.49 -30.02 71.84 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 N-CA-C 115.113 1.159 . . . . 89.61 115.113 -177.515 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.82 -41.6 99.38 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 116.089 1.885 . . . . 79.4 116.089 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . 0.451 ' HG2' ' CD2' ' A' ' 125' ' ' LEU . 55.7 mttt -55.84 -34.67 65.64 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-O 122.031 0.92 . . . . 83.76 112.744 177.201 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.25 -42.15 99.15 Favored 'General case' 0 CA--C 1.472 -2.044 0 CA-C-N 115.727 -0.67 . . . . 66.67 111.655 179.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ILE . . . . . 0.73 HD13 ' CD2' ' A' ' 10' ' ' TYR . 38.0 mt -65.2 -44.75 95.19 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.401 0 C-N-CA 119.963 -0.695 . . . . 55.17 111.217 178.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -49.51 -48.53 48.04 Favored 'General case' 0 C--O 1.178 -2.703 0 C-N-CA 122.541 0.336 . . . . 67.03 110.594 174.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 42.0 mmm -59.39 -40.61 87.11 Favored 'General case' 0 C--O 1.188 -2.174 0 CA-C-O 121.507 0.67 . . . . 68.14 111.562 -178.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.1 mt -67.98 -51.45 47.19 Favored 'General case' 0 C--O 1.276 2.476 0 O-C-N 120.554 -1.341 . . . . 55.94 107.464 -176.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . 0.401 ' CE2' HG22 ' A' ' 24' ' ' ILE . 21.4 m-85 -56.11 -36.07 67.79 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 118.707 -0.664 . . . . 55.82 111.796 175.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -68.54 -49.73 57.34 Favored 'General case' 0 C--O 1.182 -2.482 0 CA-C-N 119.75 1.159 . . . . 78.53 110.264 177.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -43.36 -44.8 6.46 Favored Glycine 0 C--N 1.316 -0.558 0 O-C-N 121.688 -0.632 . . . . 56.06 114.005 168.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 94.6 mt -63.38 -51.35 71.9 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 C-N-CA 119.488 -0.885 . . . . 52.57 109.873 -178.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . 0.563 HD21 ' HG3' ' A' ' 111' ' ' ARG . 14.1 mt -48.09 -57.11 6.27 Favored 'General case' 0 C--O 1.168 -3.187 0 C-N-CA 125.873 1.669 . . . . 55.49 111.714 173.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ARG . . . . . 0.786 ' HD3' ' O ' ' A' ' 128' ' ' HOH . 0.1 OUTLIER -58.07 -49.9 75.32 Favored 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 118.01 2.596 . . . . 64.94 118.01 -178.764 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . 0.443 ' HB2' HG22 ' A' ' 57' ' ' VAL . 19.8 m-85 -78.32 -27.11 47.12 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 108.085 -1.08 . . . . 64.83 108.085 -172.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . 0.435 ' CB ' HD13 ' A' ' 107' ' ' LEU . 35.1 m -71.07 -44.85 64.9 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 105.825 -1.917 . . . . 60.97 105.825 -178.011 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.2 t -62.93 -40.28 97.15 Favored 'General case' 0 C--O 1.193 -1.916 0 CA-C-N 113.091 -1.868 . . . . 68.12 109.815 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -70.43 -39.65 74.26 Favored 'General case' 0 C--O 1.193 -1.875 0 CA-C-O 122.421 1.105 . . . . 78.91 109.687 177.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.33 82.44 Favored 'General case' 0 CA--C 1.561 1.4 0 N-CA-C 113.873 1.064 . . . . 69.01 113.873 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -58.23 -55.72 31.3 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.634 1.174 . . . . 84.84 110.095 175.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -38.83 -53.72 1.67 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 125.062 1.345 . . . . 96.76 110.224 169.35 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.1 m -65.29 -35.55 81.35 Favored 'General case' 0 CA--C 1.491 -1.308 0 N-CA-C 113.858 1.059 . . . . 80.4 113.858 -172.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . 0.44 HD12 HD12 ' A' ' 103' ' ' ILE . 60.5 mt -63.14 -46.07 96.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 N-CA-C 112.63 0.604 . . . . 84.3 112.63 174.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -56.71 -53.29 59.44 Favored 'General case' 0 C--O 1.206 -1.224 0 O-C-N 125.239 1.587 . . . . 92.16 111.603 175.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -71.68 -4.18 25.94 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.918 1.451 . . . . 99.29 114.918 179.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 47.77 54.48 9.83 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 114.773 1.397 . . . . 109.07 114.773 -166.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -102.69 94.81 5.82 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 105.783 -1.932 . . . . 101.33 105.783 166.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 19.3 mm -66.33 -49.71 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 N-CA-C 113.462 0.912 . . . . 87.95 113.462 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.3 mp0 -49.85 -53.41 25.82 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.316 -0.624 . . . . 96.49 109.316 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . 0.494 ' HG2' ' SD ' ' B' ' 26' ' ' MET . 30.6 mttp -65.9 -28.03 68.64 Favored 'General case' 0 C--O 1.208 -1.107 0 CA-C-O 121.705 0.764 . . . . 102.16 109.824 -173.014 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -71.61 -49.95 35.37 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 113.482 0.919 . . . . 77.05 113.482 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.6 mt -53.32 -45.26 55.99 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.884 0 N-CA-C 106.715 -1.587 . . . . 67.45 106.715 174.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -51.71 -59.92 3.75 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 120.285 -1.509 . . . . 66.65 111.35 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -65.64 -40.14 92.17 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.311 -0.859 . . . . 70.22 109.613 -169.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 17.7 mt -60.77 -46.88 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.547 0 N-CA-C 115.417 1.636 . . . . 60.45 115.417 172.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -59.3 -29.88 67.92 Favored 'General case' 0 N--CA 1.423 -1.801 0 O-C-N 123.751 0.657 . . . . 65.03 111.21 -179.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -37.37 67.08 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-O 118.952 -0.547 . . . . 68.24 111.35 175.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . 0.443 HG22 ' HB2' ' A' ' 34' ' ' PHE . 59.2 t -68.69 -41.74 82.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 105.771 -1.937 . . . . 55.26 105.771 -179.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 m -62.61 -50.3 71.79 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 123.595 0.758 . . . . 57.21 110.431 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -49.18 -30.3 6.68 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 114.885 1.439 . . . . 65.39 114.885 173.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 50.5 mt -76.16 -56.63 7.85 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.428 0 CA-C-O 120.816 0.341 . . . . 54.45 111.732 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -51.43 -37.87 50.73 Favored 'General case' 0 C--O 1.198 -1.642 0 C-N-CA 118.759 -1.177 . . . . 53.98 113.956 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.1 m -61.07 -38.19 85.33 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 123.508 0.505 . . . . 58.72 111.1 173.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -69.34 -41.9 76.01 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-O 121.69 0.757 . . . . 67.91 109.997 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 28.3 mt -62.32 -39.02 91.67 Favored 'General case' 0 C--O 1.202 -1.412 0 N-CA-C 106.957 -1.497 . . . . 56.62 106.957 -177.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.54 -36.14 83.24 Favored 'General case' 0 C--O 1.185 -2.311 0 O-C-N 120.294 -1.504 . . . . 62.47 111.635 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -77.57 -18.08 57.24 Favored 'General case' 0 C--O 1.194 -1.85 0 O-C-N 121.252 -0.905 . . . . 76.78 112.137 -171.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.8 pt -110.91 18.72 7.07 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.614 0 CA-C-N 119.294 0.952 . . . . 67.07 110.851 -175.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.9 mt -76.27 137.02 39.66 Favored 'General case' 0 CA--C 1.561 1.373 0 O-C-N 120.007 -1.683 . . . . 70.22 112.348 171.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -98.85 106.74 19.04 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.921 0.888 . . . . 83.38 111.842 175.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -73.45 -24.05 60.18 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 118.529 -0.748 . . . . 80.48 112.032 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -75.57 -57.88 3.62 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 121.544 0.688 . . . . 90.81 112.348 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -85.74 -16.17 39.8 Favored 'General case' 0 C--O 1.208 -1.08 0 N-CA-C 114.82 1.415 . . . . 83.61 114.82 -173.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -95.43 -14.75 46.49 Favored Glycine 0 C--O 1.248 1.03 0 N-CA-C 115.242 0.857 . . . . 73.37 115.242 -177.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 53.81 -138.34 38.21 Favored Glycine 0 N--CA 1.435 -1.372 0 CA-C-O 122.449 1.027 . . . . 72.61 112.586 169.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.39 -33.98 77.22 Favored 'General case' 0 C--O 1.199 -1.56 0 CA-C-O 123.552 1.644 . . . . 71.39 108.909 -168.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.2 t -71.37 -28.09 30.98 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.554 0 CA-C-N 114.96 -1.018 . . . . 67.4 111.392 179.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.64 72.86 Favored 'General case' 0 C--O 1.282 2.776 0 CA-C-N 120.458 1.481 . . . . 65.42 113.054 168.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 49.2 t -72.84 -44.95 57.55 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 N-CA-C 106.286 -1.746 . . . . 67.83 106.286 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -58.83 -48.54 80.98 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 112.589 0.588 . . . . 67.51 112.589 -179.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 49.2 mt -61.13 -35.61 77.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.462 1.652 . . . . 56.29 115.462 175.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.9 m -58.78 -38.39 78.43 Favored 'General case' 0 C--O 1.257 1.465 0 N-CA-C 105.18 -2.156 . . . . 56.47 105.18 176.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.82 -40.69 84.8 Favored Glycine 0 C--O 1.207 -1.562 0 C-N-CA 119.259 -1.448 . . . . 57.74 112.085 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.4 tp -66.47 -49.59 66.13 Favored 'General case' 0 CA--C 1.488 -1.432 0 CA-C-N 113.737 -1.232 . . . . 57.34 108.088 -175.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 18.0 m-30 -67.94 -47.03 69.81 Favored 'General case' 0 N--CA 1.425 -1.707 0 N-CA-C 115.418 1.636 . . . . 59.12 115.418 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 48.9 p -66.08 -35.94 81.86 Favored 'General case' 0 C--O 1.254 1.334 0 N-CA-C 107.918 -1.141 . . . . 66.03 107.918 -174.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -61.02 -51.92 67.19 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 113.525 0.935 . . . . 71.19 113.525 171.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -49.51 -37.13 25.48 Favored 'General case' 0 C--O 1.191 -1.989 0 CA-C-N 114.314 -1.312 . . . . 66.0 110.201 175.066 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 95.0 mt -70.17 -36.67 68.89 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.82 0 CA-C-N 120.464 1.484 . . . . 62.24 109.117 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.5 tttt -71.2 -45.13 64.05 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 122.342 1.068 . . . . 73.1 108.779 -174.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 20.0 t -55.58 -46.16 79.02 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.557 0 CA-C-N 112.629 -2.078 . . . . 66.52 110.98 174.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.6 mt -56.95 -49.46 75.61 Favored 'General case' 0 CA--C 1.557 1.215 0 O-C-N 121.905 -0.497 . . . . 66.98 111.932 174.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.2 m -58.01 -37.66 74.73 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 121.346 -0.847 . . . . 74.57 110.412 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -67.66 -43.22 80.76 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.613 1.197 . . . . 79.93 112.523 179.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.67 -36.07 81.68 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.266 -0.879 . . . . 81.14 109.135 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.8 t-20 -64.31 -66.2 0.57 Allowed 'General case' 0 CA--C 1.489 -1.376 0 C-N-CA 124.069 0.947 . . . . 86.04 109.219 175.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.0 t -58.75 -45.11 91.35 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 CA-C-N 116.145 -0.48 . . . . 92.42 110.634 -168.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . 0.606 ' OE2' ' NZ ' ' A' ' 102' ' ' LYS . 3.2 pt-20 -102.29 8.75 40.3 Favored 'General case' 0 C--O 1.257 1.497 0 N-CA-C 113.265 0.839 . . . . 94.99 113.265 -171.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 58.1 54.93 5.52 Favored 'General case' 0 CA--C 1.555 1.162 0 N-CA-C 114.648 1.351 . . . . 95.63 114.648 170.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -115.93 118.6 33.41 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 121.513 -0.742 . . . . 91.01 109.366 -173.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -81.81 -31.12 31.9 Favored 'General case' 0 C--O 1.198 -1.625 0 CA-C-O 118.62 -0.705 . . . . 86.11 112.772 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 99.5 p -56.14 -30.61 62.39 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 119.277 0.944 . . . . 84.82 110.378 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . 0.606 ' NZ ' ' OE2' ' A' ' 97' ' ' GLU . 34.9 mttt -71.97 -45.51 60.78 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 114.372 -1.286 . . . . 75.82 114.259 -178.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ILE . . . . . 0.44 HD12 HD12 ' A' ' 42' ' ' ILE . 24.5 mt -59.89 -36.98 69.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 C-N-CA 120.272 -0.571 . . . . 68.22 112.447 170.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -51.91 -37.41 52.4 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 114.511 1.3 . . . . 81.34 114.511 168.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.29 -44.23 88.6 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 119.901 -0.72 . . . . 74.15 109.239 -179.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 80.8 t -64.48 -50.13 77.51 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.17 0 N-CA-C 113.163 0.801 . . . . 64.19 113.163 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . 0.435 HD13 ' CB ' ' A' ' 35' ' ' SER . 0.0 OUTLIER -46.69 -51.65 15.58 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 115.719 1.748 . . . . 64.02 115.719 167.012 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 34.6 m-20 -58.83 -30.14 67.43 Favored 'General case' 0 CA--C 1.478 -1.794 0 N-CA-C 106.682 -1.599 . . . . 75.97 106.682 176.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.38 -47.03 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 C-N-CA 117.008 -1.877 . . . . 61.55 110.354 -173.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.84 -29.39 69.29 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 120.427 -0.509 . . . . 59.92 111.098 -178.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ARG . . . . . 0.563 ' HG3' HD21 ' A' ' 32' ' ' LEU . 38.1 mtm180 -60.91 -48.07 83.5 Favored 'General case' 0 N--CA 1.419 -1.978 0 CA-C-N 119.021 0.828 . . . . 93.93 110.928 173.122 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -61.96 -39.39 97.49 Favored Glycine 0 C--O 1.184 -3.017 0 C-N-CA 118.808 -1.663 . . . . 62.77 112.355 -178.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 55.4 mt -65.17 -43.71 90.88 Favored 'General case' 0 CA--C 1.461 -2.449 0 O-C-N 120.962 -1.317 . . . . 60.67 108.709 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 51.7 tp -70.16 -41.3 73.99 Favored 'General case' 0 C--O 1.254 1.318 0 CA-C-O 121.948 0.88 . . . . 64.26 110.633 -173.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 200' ' ' HOH . 64.4 tt0 -60.17 -44.13 95.28 Favored 'General case' 0 C--O 1.2 -1.523 0 C-N-CA 119.089 -1.044 . . . . 75.64 110.393 176.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -64.38 -41.52 96.64 Favored 'General case' 0 C--O 1.197 -1.694 0 O-C-N 121.556 -0.715 . . . . 60.59 110.223 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' TRP . . . . . 0.52 ' CZ2' HD12 ' A' ' 24' ' ' ILE . 72.2 t-105 -65.76 -44.27 86.39 Favored 'General case' 0 CA--C 1.483 -1.601 0 CA-C-O 118.508 -0.758 . . . . 61.98 110.113 -175.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 79.8 mtt180 -63.97 -40.02 95.45 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.07 1.507 . . . . 67.85 115.07 172.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -52.27 -45.35 65.4 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 113.953 1.094 . . . . 71.29 113.953 172.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 72.2 mt -72.4 -33.49 45.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 N-CA-C 114.374 1.249 . . . . 69.37 114.374 177.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 61.8 m80 -110.13 49.64 0.84 Allowed 'General case' 0 C--N 1.316 -0.859 0 O-C-N 121.547 -0.721 . . . . 71.95 112.025 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 48.2 t -56.71 -50.39 72.32 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.136 -1.393 . . . . 78.43 110.159 -168.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -71.54 -35.22 70.58 Favored 'General case' 0 CA--C 1.587 2.399 0 C-N-CA 118.86 -1.136 . . . . 87.65 113.794 -175.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -76.25 -34.66 59.18 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 126.346 1.858 . . . . 85.07 111.201 -169.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . 0.451 ' CD2' ' HG2' ' A' ' 22' ' ' LYS . 19.8 mt -101.26 7.55 42.87 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 115.132 1.53 . . . . 74.63 115.132 -171.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.211 -0.97 0 C-N-CA 125.315 1.446 . . . . 80.84 111.557 172.957 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 20' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.49 1.291 0 N-CA-C 116.711 1.773 . . . . 114.59 116.711 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.58 -34.82 34.98 Favored 'General case' 0 C--N 1.308 -1.199 0 O-C-N 120.427 -1.421 . . . . 101.44 110.168 -175.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -60.13 -30.4 69.26 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.627 0.727 . . . . 114.67 110.373 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 29.6 tp -57.44 -53.63 55.91 Favored 'General case' 0 CA--C 1.485 -1.54 0 CA-C-N 115.622 -0.717 . . . . 81.82 111.336 173.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ILE . . . . . 0.46 HD13 ' CZ2' ' B' ' 117' ' ' TRP . 12.4 mt -59.57 -45.4 94.08 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.437 0 O-C-N 124.469 1.105 . . . . 68.77 112.052 178.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -52.1 -49.41 63.67 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-O 122.274 1.035 . . . . 84.33 112.003 174.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' MET . . . . . 0.494 ' SD ' ' HG2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -59.82 -37.26 78.67 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 117.718 -1.593 . . . . 73.68 112.514 -179.493 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 76.0 mt -66.13 -43.65 86.51 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 124.14 0.9 . . . . 62.8 111.463 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -61.73 -38.2 87.05 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 115.302 -0.863 . . . . 68.87 112.518 173.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -68.9 -35.42 76.83 Favored 'General case' 0 C--O 1.195 -1.814 0 N-CA-C 114.24 1.2 . . . . 89.54 114.24 175.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.59 -46.51 94.27 Favored Glycine 0 C--O 1.21 -1.374 0 O-C-N 121.184 -0.948 . . . . 59.38 112.3 176.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ILE . . . . . 0.454 HG13 HG21 ' B' ' 60' ' ' ILE . 57.4 mt -57.68 -45.99 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.075 0 N-CA-C 107.555 -1.276 . . . . 54.01 107.555 174.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LEU . . . . . 0.593 HD21 ' HG3' ' B' ' 111' ' ' ARG . 7.9 mt -59.18 -38.17 79.15 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.02 -1.104 . . . . 64.05 108.02 -169.229 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 43.8 ttm-85 -85.12 -47.78 9.82 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-N 113.804 -1.544 . . . . 67.11 107.273 -164.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -70.37 -30.14 66.99 Favored 'General case' 0 CA--C 1.451 -2.836 0 CA-C-N 113.842 -1.527 . . . . 58.65 111.186 -176.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' SER . . . . . 0.439 ' HB3' HD13 ' B' ' 107' ' ' LEU . 17.5 m -70.43 -47.82 58.91 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 125.211 1.569 . . . . 59.36 107.138 -179.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 21.6 t -58.87 -40.0 83.05 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 106.179 -1.786 . . . . 67.07 106.179 179.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -69.95 -46.35 65.46 Favored 'General case' 0 CA--C 1.577 1.986 0 C-N-CA 118.488 -1.285 . . . . 70.9 110.63 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -55.93 -39.77 72.18 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 119.369 0.986 . . . . 63.32 110.887 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -52.5 -61.96 1.95 Allowed 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 107.596 -1.261 . . . . 86.05 107.596 176.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -52.91 -36.57 59.71 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 115.121 -0.945 . . . . 86.29 111.751 -173.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' CYS . . . . . . . . . . . . . 99.2 m -68.79 -25.36 64.66 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.857 0.688 . . . . 70.13 112.857 -178.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 87.8 mt -74.28 -40.45 50.2 Favored 'Isoleucine or valine' 0 C--O 1.259 1.597 0 CA-C-O 120.823 0.344 . . . . 77.63 110.287 174.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -59.37 -42.92 92.75 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-N 115.512 -0.767 . . . . 83.47 108.976 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 61.8 m-20 -88.98 2.49 53.87 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 113.0 0.741 . . . . 91.64 113.0 -177.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 43.67 63.35 1.59 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 118.999 -0.524 . . . . 99.5 111.534 -170.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 -105.7 107.46 18.46 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 107.572 -1.27 . . . . 83.17 107.572 159.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 15.8 mm -80.21 -50.31 17.71 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.305 0 N-CA-C 105.897 -1.89 . . . . 75.07 105.897 -166.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -55.88 -42.28 75.7 Favored 'General case' 0 N--CA 1.414 -2.272 0 CA-C-N 114.227 -1.352 . . . . 79.01 111.016 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -68.27 -37.61 80.88 Favored 'General case' 0 CA--C 1.557 1.222 0 CA-C-O 122.417 1.103 . . . . 77.58 109.93 -176.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 ttpt -62.83 -49.41 75.02 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 115.106 1.521 . . . . 71.83 115.106 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ILE . . . . . . . . . . . . . 14.2 mt -54.4 -52.61 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.36 0 N-CA-C 107.536 -1.283 . . . . 56.98 107.536 174.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -42.88 -67.19 0.29 Allowed 'General case' 0 C--O 1.206 -1.22 0 CA-C-O 122.014 0.911 . . . . 55.25 109.385 173.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' TYR . . . . . 0.48 ' O ' HG23 ' B' ' 57' ' ' VAL . 48.5 m-85 -62.03 -41.8 98.48 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.369 -1.457 . . . . 57.54 113.667 -171.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 6.0 mt -61.07 -41.38 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 C-N-CA 117.966 -1.493 . . . . 57.94 111.829 176.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -57.2 -28.91 63.26 Favored 'General case' 0 CA--C 1.481 -1.688 0 C-N-CA 118.016 -1.473 . . . . 58.14 110.675 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ARG . . . . . 0.546 ' NH1' ' OD2' ' B' ' 59' ' ' ASP . 0.0 OUTLIER -75.13 -39.71 60.3 Favored 'General case' 0 N--CA 1.426 -1.628 0 CA-C-N 114.249 -1.341 . . . . 59.62 108.494 -171.598 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 57' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 53' ' ' TYR . 4.8 t -70.06 -40.27 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.76 0 CA-C-N 115.318 -0.855 . . . . 56.9 109.77 179.3 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 7.4 m -58.62 -44.01 89.84 Favored 'General case' 0 C--O 1.179 -2.62 0 N-CA-C 108.044 -1.095 . . . . 59.26 108.044 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ASP . . . . . 0.546 ' OD2' ' NH1' ' B' ' 56' ' ' ARG . 48.0 m-20 -61.62 -25.92 67.66 Favored 'General case' 0 C--N 1.307 -1.274 0 O-C-N 121.149 -0.969 . . . . 63.18 110.747 -177.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ILE . . . . . 0.454 HG21 HG13 ' B' ' 31' ' ' ILE . 39.1 mt -80.09 -53.27 13.23 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.753 0 CA-C-N 115.344 -0.844 . . . . 58.86 108.871 -173.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -56.06 -26.89 51.2 Favored 'General case' 0 C--O 1.262 1.713 0 N-CA-C 115.538 1.681 . . . . 61.88 115.538 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' THR . . . . . . . . . . . . . 87.7 m -71.05 -49.01 49.44 Favored 'General case' 0 CA--C 1.496 -1.131 0 N-CA-C 107.301 -1.37 . . . . 66.15 107.301 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -49.63 -54.83 16.2 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 114.759 -1.109 . . . . 73.29 111.83 169.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 26.4 mt -50.83 -53.54 31.34 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.814 0.696 . . . . 68.45 110.555 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 23.7 mt -54.58 -38.6 66.91 Favored 'General case' 0 CA--C 1.552 1.035 0 N-CA-C 115.391 1.626 . . . . 76.67 115.391 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 -69.31 -12.23 61.49 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 117.904 2.557 . . . . 88.97 117.904 174.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . 0.263 39.2 pt -115.5 17.79 7.57 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.897 0 N-CA-C 115.472 1.656 . . . . 83.77 115.472 -178.001 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 21.2 mt -80.46 140.16 36.08 Favored 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 120.556 -1.34 . . . . 91.45 108.056 178.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -101.05 118.86 37.83 Favored 'General case' 0 CA--C 1.569 1.685 0 CA-C-N 115.068 -0.969 . . . . 113.0 110.886 173.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -84.99 -12.96 52.08 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 120.929 -1.107 . . . . 109.49 113.263 -174.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.33 -57.01 3.11 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 106.854 -1.536 . . . . 111.24 106.854 -174.383 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -80.08 -35.02 37.55 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 125.117 1.511 . . . . 106.06 111.145 -172.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLY . . . . . 0.456 ' O ' ' C ' ' B' ' 74' ' ' GLY . . . -80.77 2.57 79.01 Favored Glycine 0 CA--C 1.539 1.532 0 N-CA-C 116.876 1.51 . . . . 101.96 116.876 176.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLY . . . . . 0.456 ' C ' ' O ' ' B' ' 73' ' ' GLY . . . 24.01 -113.5 0.01 OUTLIER Glycine 0 C--N 1.339 0.749 0 CA-C-O 121.929 0.739 . . . . 104.57 114.354 -179.615 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -67.68 -37.95 83.03 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 115.011 1.485 . . . . 100.67 115.011 -172.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -79.04 -31.77 14.95 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.921 0 N-CA-C 108.164 -1.05 . . . . 96.26 108.164 -171.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -56.46 -49.37 74.81 Favored 'General case' 0 C--O 1.238 0.494 0 O-C-N 124.668 1.23 . . . . 90.01 108.797 169.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' VAL . . . . . . . . . . . . . 65.4 t -56.21 -54.41 27.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.027 0 C-N-CA 117.741 -1.584 . . . . 94.76 109.59 173.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -49.6 -36.92 25.81 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.436 0.902 . . . . 90.68 113.436 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 55.4 mt -77.33 -37.56 52.21 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 122.03 0.919 . . . . 76.5 112.171 -174.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 11.5 m -52.11 -52.05 53.91 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.01 -0.995 . . . . 74.31 109.106 167.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -57.59 -32.87 65.63 Favored Glycine 0 N--CA 1.429 -1.818 0 C-N-CA 120.645 -0.788 . . . . 76.52 114.057 176.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.0 tp -78.87 -48.16 15.2 Favored 'General case' 0 CA--C 1.474 -1.955 0 N-CA-C 108.949 -0.76 . . . . 75.42 108.949 -175.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 -69.49 -41.51 76.03 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 117.245 -1.359 . . . . 70.77 113.115 -178.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' THR . . . . . . . . . . . . . 76.8 p -65.17 -39.08 92.44 Favored 'General case' 0 C--O 1.279 2.637 0 N-CA-C 106.191 -1.781 . . . . 83.02 106.191 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -59.99 -43.88 94.86 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.534 -1.212 . . . . 91.7 111.353 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.94 -34.7 76.57 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.898 0.703 . . . . 78.02 112.898 -175.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 59.7 mt -70.3 -38.51 74.57 Favored 'Isoleucine or valine' 0 C--O 1.262 1.726 0 C-N-CA 125.313 1.445 . . . . 70.33 111.471 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -68.32 -48.38 65.03 Favored 'General case' 0 C--O 1.261 1.683 0 N-CA-C 108.31 -0.996 . . . . 91.35 108.31 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 15.9 t -54.36 -46.17 69.4 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.797 0 CA-C-N 114.894 -1.048 . . . . 78.69 110.407 173.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 18.3 mt -58.15 -54.59 45.3 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 113.457 0.91 . . . . 70.75 113.457 175.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 65.0 m -46.9 -39.17 11.66 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.77 0.828 . . . . 81.13 110.719 173.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -69.45 -50.82 42.09 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.514 -0.742 . . . . 93.91 110.191 -178.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.35 -42.61 70.46 Favored 'General case' 0 N--CA 1.444 -0.738 0 O-C-N 124.961 1.413 . . . . 83.41 110.256 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 63.2 t-20 -61.31 -57.83 10.72 Favored 'General case' 0 C--O 1.2 -1.535 0 N-CA-C 108.091 -1.077 . . . . 85.93 108.091 175.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 4.1 t -67.27 -43.46 88.11 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.652 0 N-CA-C 108.206 -1.035 . . . . 99.61 108.206 -163.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -108.02 14.94 24.77 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 123.69 0.619 . . . . 105.81 112.029 -170.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 51.99 47.54 24.55 Favored 'General case' 0 C--O 1.21 -1.016 0 N-CA-C 117.1 2.259 . . . . 96.19 117.1 171.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -110.67 118.72 36.95 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.408 1.083 . . . . 103.51 109.046 -175.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -81.06 -38.29 27.61 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.626 0.602 . . . . 91.62 112.626 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 22.4 p -47.51 -27.1 1.62 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.066 0.946 . . . . 97.55 110.946 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 39.8 mttt -75.98 -46.64 28.55 Favored 'General case' 0 C--O 1.259 1.57 0 CA-C-N 114.698 -1.137 . . . . 86.14 112.904 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 22.1 mt -55.58 -36.64 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 CA-C-O 119.146 -0.454 . . . . 75.72 110.037 171.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -55.87 -48.78 74.94 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 117.396 -1.721 . . . . 91.51 112.181 173.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 36.1 mt -52.38 -40.07 61.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 121.632 -0.668 . . . . 93.79 109.593 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 40.3 t -70.82 -51.93 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-O 121.232 0.539 . . . . 75.65 112.381 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' LEU . . . . . 0.579 ' HB3' HH21 ' B' ' 111' ' ' ARG . 0.2 OUTLIER -37.08 -52.66 0.99 Allowed 'General case' 0 CA--C 1.588 2.416 0 N-CA-C 114.427 1.269 . . . . 74.55 114.427 164.48 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -67.12 -24.65 65.94 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 121.257 0.551 . . . . 94.13 111.679 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 37.2 t -74.58 -60.87 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-O 118.314 -0.85 . . . . 76.33 111.847 177.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -51.83 -44.63 63.64 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 109.597 -0.52 . . . . 74.72 109.597 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' ARG . . . . . 0.593 ' HG3' HD21 ' B' ' 32' ' ' LEU . 27.4 mtm180 -49.57 -58.03 5.99 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 121.171 -0.212 . . . . 114.56 111.243 175.815 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . -57.14 -40.07 90.94 Favored Glycine 0 C--O 1.201 -1.937 0 O-C-N 124.808 1.318 . . . . 84.54 114.0 173.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 97.7 mt -66.36 -43.38 86.14 Favored 'General case' 0 C--O 1.247 0.93 0 CA-C-N 120.102 1.951 . . . . 81.26 109.876 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LEU . . . . . 0.44 HD22 HD12 ' B' ' 32' ' ' LEU . 62.6 tp -72.44 -35.42 68.28 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 112.912 0.708 . . . . 84.02 112.912 -171.802 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -63.43 -45.37 91.27 Favored 'General case' 0 CA--C 1.579 2.067 0 O-C-N 124.231 0.957 . . . . 109.04 110.324 173.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -53.85 -49.94 67.33 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.099 1.518 . . . . 88.42 115.099 168.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' TRP . . . . . 0.46 ' CZ2' HD13 ' B' ' 24' ' ' ILE . 34.5 t-105 -55.79 -59.14 5.29 Favored 'General case' 0 N--CA 1.507 2.384 0 N-CA-C 114.853 1.427 . . . . 88.18 114.853 177.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 87.8 mtt180 -52.04 -49.16 63.98 Favored 'General case' 0 C--O 1.263 1.774 0 CA-C-N 115.709 -0.678 . . . . 98.19 112.38 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -48.11 -48.57 33.75 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-O 118.383 -0.818 . . . . 110.92 111.035 177.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 18.5 mt . . . . . 0 CA--C 1.553 1.066 0 CA-C-N 119.93 1.241 . . . . 102.55 108.868 168.314 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . 0.786 ' O ' ' HD3' ' A' ' 33' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' HOH . . . . . 0.507 ' O ' ' HG3' ' A' ' 115' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.376 0 N-CA-C 113.054 0.761 . . . . 102.23999999999999 113.054 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 178.74 122.25 0.05 OUTLIER 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 114.674 1.361 . . . . 99.140000000000001 114.674 -163.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -170.9 169.2 6.87 Favored 'General case' 0 N--CA 1.515 2.784 0 N-CA-C 114.178 1.177 . . . . 103.73 114.178 -179.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 48.79 54.21 11.1 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 114.833 1.42 . . . . 98.590000000000003 114.833 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.642 ' C ' ' CD1' ' A' ' 7' ' ' TYR . 3.8 p90 -157.85 158.68 35.59 Favored 'General case' 2 CA--C 1.632 4.12 0 N-CA-C 121.32 3.822 . . . . 92.75 121.32 -176.205 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -121.78 109.62 14.91 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 112.338 -2.21 . . . . 89.640000000000001 105.039 160.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -107.58 9.0 29.52 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.219 -0.901 . . . . 78.549999999999997 112.373 -171.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.73 ' CD2' HD13 ' A' ' 24' ' ' ILE . 91.6 m-85 -124.67 164.08 20.65 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.073 0.949 . . . . 73.890000000000001 111.749 -178.318 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -110.03 147.38 33.65 Favored 'General case' 0 CA--C 1.576 1.95 0 C-N-CA 126.999 2.12 . . . . 88.549999999999997 115.206 -173.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.163 0 C-N-CA 124.892 1.277 . . . . 87.329999999999998 109.155 -179.047 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 . . . . . 0 N--CA 1.47 0.547 0 N-CA-C 112.09 0.404 . . . . 105.65000000000001 112.09 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . 0.47 ' HA ' ' HD2' ' A' ' 20' ' ' PRO . 0.3 OUTLIER -139.71 91.32 10.65 Favored Pre-proline 0 CA--C 1.557 1.232 0 N-CA-C 118.236 2.68 . . . . 97.310000000000002 118.236 -160.217 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.47 ' HD2' ' HA ' ' A' ' 19' ' ' SER . 9.5 Cg_endo -55.49 -30.02 71.84 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 N-CA-C 115.113 1.159 . . . . 89.609999999999999 115.113 -177.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.82 -41.6 99.38 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 116.089 1.885 . . . . 79.400000000000006 116.089 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.451 ' HG2' ' CD2' ' A' ' 125' ' ' LEU . 55.7 mttt -55.84 -34.67 65.64 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-O 122.031 0.92 . . . . 83.760000000000005 112.744 177.201 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.25 -42.15 99.15 Favored 'General case' 0 CA--C 1.472 -2.044 0 CA-C-N 115.727 -0.67 . . . . 66.670000000000002 111.655 179.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.73 HD13 ' CD2' ' A' ' 10' ' ' TYR . 38.0 mt -65.2 -44.75 95.19 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.401 0 C-N-CA 119.963 -0.695 . . . . 55.170000000000002 111.217 178.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -49.51 -48.53 48.04 Favored 'General case' 0 C--O 1.178 -2.703 0 C-N-CA 122.541 0.336 . . . . 67.030000000000001 110.594 174.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 42.0 mmm -59.39 -40.61 87.11 Favored 'General case' 0 C--O 1.188 -2.174 0 CA-C-O 121.507 0.67 . . . . 68.140000000000001 111.562 -178.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.1 mt -67.98 -51.45 47.19 Favored 'General case' 0 C--O 1.276 2.476 0 O-C-N 120.554 -1.341 . . . . 55.939999999999998 107.464 -176.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.401 ' CE2' HG22 ' A' ' 24' ' ' ILE . 21.4 m-85 -56.11 -36.07 67.79 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 118.707 -0.664 . . . . 55.82 111.796 175.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -68.54 -49.73 57.34 Favored 'General case' 0 C--O 1.182 -2.482 0 CA-C-N 119.75 1.159 . . . . 78.530000000000001 110.264 177.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -43.36 -44.8 6.46 Favored Glycine 0 C--N 1.316 -0.558 0 O-C-N 121.688 -0.632 . . . . 56.060000000000002 114.005 168.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 94.6 mt -63.38 -51.35 71.9 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 C-N-CA 119.488 -0.885 . . . . 52.57 109.873 -178.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.563 HD21 ' HG3' ' A' ' 111' ' ' ARG . 14.1 mt -48.09 -57.11 6.27 Favored 'General case' 0 C--O 1.168 -3.187 0 C-N-CA 125.873 1.669 . . . . 55.490000000000002 111.714 173.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.786 ' HD3' ' O ' ' A' ' 128' ' ' HOH . 0.1 OUTLIER -58.07 -49.9 75.32 Favored 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 118.01 2.596 . . . . 64.939999999999998 118.01 -178.764 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.443 ' HB2' HG22 ' A' ' 57' ' ' VAL . 19.8 m-85 -78.32 -27.11 47.12 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 108.085 -1.08 . . . . 64.829999999999998 108.085 -172.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . 0.435 ' CB ' HD13 ' A' ' 107' ' ' LEU . 35.1 m -71.07 -44.85 64.9 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 105.825 -1.917 . . . . 60.969999999999999 105.825 -178.011 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.2 t -62.93 -40.28 97.15 Favored 'General case' 0 C--O 1.193 -1.916 0 CA-C-N 113.091 -1.868 . . . . 68.120000000000005 109.815 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -70.43 -39.65 74.26 Favored 'General case' 0 C--O 1.193 -1.875 0 CA-C-O 122.421 1.105 . . . . 78.909999999999997 109.687 177.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.33 82.44 Favored 'General case' 0 CA--C 1.561 1.4 0 N-CA-C 113.873 1.064 . . . . 69.010000000000005 113.873 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -58.23 -55.72 31.3 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.634 1.174 . . . . 84.840000000000003 110.095 175.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -38.83 -53.72 1.67 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 125.062 1.345 . . . . 96.760000000000005 110.224 169.35 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.1 m -65.29 -35.55 81.35 Favored 'General case' 0 CA--C 1.491 -1.308 0 N-CA-C 113.858 1.059 . . . . 80.400000000000006 113.858 -172.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.44 HD12 HD12 ' A' ' 103' ' ' ILE . 60.5 mt -63.14 -46.07 96.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 N-CA-C 112.63 0.604 . . . . 84.299999999999997 112.63 174.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -56.71 -53.29 59.44 Favored 'General case' 0 C--O 1.206 -1.224 0 O-C-N 125.239 1.587 . . . . 92.159999999999997 111.603 175.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -71.68 -4.18 25.94 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.918 1.451 . . . . 99.290000000000006 114.918 179.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 47.77 54.48 9.83 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 114.773 1.397 . . . . 109.06999999999999 114.773 -166.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -102.69 94.81 5.82 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 105.783 -1.932 . . . . 101.33 105.783 166.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 19.3 mm -66.33 -49.71 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 N-CA-C 113.462 0.912 . . . . 87.950000000000003 113.462 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.3 mp0 -49.85 -53.41 25.82 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.316 -0.624 . . . . 96.489999999999995 109.316 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.494 ' HG2' ' SD ' ' B' ' 26' ' ' MET . 30.6 mttp -65.9 -28.03 68.64 Favored 'General case' 0 C--O 1.208 -1.107 0 CA-C-O 121.705 0.764 . . . . 102.16 109.824 -173.014 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -71.61 -49.95 35.37 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 113.482 0.919 . . . . 77.049999999999997 113.482 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.6 mt -53.32 -45.26 55.99 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.884 0 N-CA-C 106.715 -1.587 . . . . 67.450000000000003 106.715 174.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -51.71 -59.92 3.75 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 120.285 -1.509 . . . . 66.650000000000006 111.35 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -65.64 -40.14 92.17 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.311 -0.859 . . . . 70.219999999999999 109.613 -169.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 17.7 mt -60.77 -46.88 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.547 0 N-CA-C 115.417 1.636 . . . . 60.450000000000003 115.417 172.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -59.3 -29.88 67.92 Favored 'General case' 0 N--CA 1.423 -1.801 0 O-C-N 123.751 0.657 . . . . 65.030000000000001 111.21 -179.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -37.37 67.08 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-O 118.952 -0.547 . . . . 68.239999999999995 111.35 175.956 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.443 HG22 ' HB2' ' A' ' 34' ' ' PHE . 59.2 t -68.69 -41.74 82.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 105.771 -1.937 . . . . 55.259999999999998 105.771 -179.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 m -62.61 -50.3 71.79 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 123.595 0.758 . . . . 57.210000000000001 110.431 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -49.18 -30.3 6.68 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 114.885 1.439 . . . . 65.390000000000001 114.885 173.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 50.5 mt -76.16 -56.63 7.85 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.428 0 CA-C-O 120.816 0.341 . . . . 54.450000000000003 111.732 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -51.43 -37.87 50.73 Favored 'General case' 0 C--O 1.198 -1.642 0 C-N-CA 118.759 -1.177 . . . . 53.979999999999997 113.956 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.1 m -61.07 -38.19 85.33 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 123.508 0.505 . . . . 58.719999999999999 111.1 173.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -69.34 -41.9 76.01 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-O 121.69 0.757 . . . . 67.909999999999997 109.997 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 28.3 mt -62.32 -39.02 91.67 Favored 'General case' 0 C--O 1.202 -1.412 0 N-CA-C 106.957 -1.497 . . . . 56.619999999999997 106.957 -177.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.54 -36.14 83.24 Favored 'General case' 0 C--O 1.185 -2.311 0 O-C-N 120.294 -1.504 . . . . 62.469999999999999 111.635 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -77.57 -18.08 57.24 Favored 'General case' 0 C--O 1.194 -1.85 0 O-C-N 121.252 -0.905 . . . . 76.780000000000001 112.137 -171.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.8 pt -110.91 18.72 7.07 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.614 0 CA-C-N 119.294 0.952 . . . . 67.069999999999993 110.851 -175.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.9 mt -76.27 137.02 39.66 Favored 'General case' 0 CA--C 1.561 1.373 0 O-C-N 120.007 -1.683 . . . . 70.219999999999999 112.348 171.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -98.85 106.74 19.04 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.921 0.888 . . . . 83.379999999999995 111.842 175.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -73.45 -24.05 60.18 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 118.529 -0.748 . . . . 80.480000000000004 112.032 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -75.57 -57.88 3.62 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 121.544 0.688 . . . . 90.810000000000002 112.348 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -85.74 -16.17 39.8 Favored 'General case' 0 C--O 1.208 -1.08 0 N-CA-C 114.82 1.415 . . . . 83.609999999999999 114.82 -173.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -95.43 -14.75 46.49 Favored Glycine 0 C--O 1.248 1.03 0 N-CA-C 115.242 0.857 . . . . 73.370000000000005 115.242 -177.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 53.81 -138.34 38.21 Favored Glycine 0 N--CA 1.435 -1.372 0 CA-C-O 122.449 1.027 . . . . 72.609999999999999 112.586 169.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.39 -33.98 77.22 Favored 'General case' 0 C--O 1.199 -1.56 0 CA-C-O 123.552 1.644 . . . . 71.390000000000001 108.909 -168.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.2 t -71.37 -28.09 30.98 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.554 0 CA-C-N 114.96 -1.018 . . . . 67.400000000000006 111.392 179.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.64 72.86 Favored 'General case' 0 C--O 1.282 2.776 0 CA-C-N 120.458 1.481 . . . . 65.420000000000002 113.054 168.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 49.2 t -72.84 -44.95 57.55 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 N-CA-C 106.286 -1.746 . . . . 67.829999999999998 106.286 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -58.83 -48.54 80.98 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 112.589 0.588 . . . . 67.510000000000005 112.589 -179.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 49.2 mt -61.13 -35.61 77.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.462 1.652 . . . . 56.289999999999999 115.462 175.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.9 m -58.78 -38.39 78.43 Favored 'General case' 0 C--O 1.257 1.465 0 N-CA-C 105.18 -2.156 . . . . 56.469999999999999 105.18 176.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.82 -40.69 84.8 Favored Glycine 0 C--O 1.207 -1.562 0 C-N-CA 119.259 -1.448 . . . . 57.740000000000002 112.085 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.4 tp -66.47 -49.59 66.13 Favored 'General case' 0 CA--C 1.488 -1.432 0 CA-C-N 113.737 -1.232 . . . . 57.340000000000003 108.088 -175.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 18.0 m-30 -67.94 -47.03 69.81 Favored 'General case' 0 N--CA 1.425 -1.707 0 N-CA-C 115.418 1.636 . . . . 59.119999999999997 115.418 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 48.9 p -66.08 -35.94 81.86 Favored 'General case' 0 C--O 1.254 1.334 0 N-CA-C 107.918 -1.141 . . . . 66.030000000000001 107.918 -174.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -61.02 -51.92 67.19 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 113.525 0.935 . . . . 71.189999999999998 113.525 171.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -49.51 -37.13 25.48 Favored 'General case' 0 C--O 1.191 -1.989 0 CA-C-N 114.314 -1.312 . . . . 66.0 110.201 175.066 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 95.0 mt -70.17 -36.67 68.89 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.82 0 CA-C-N 120.464 1.484 . . . . 62.240000000000002 109.117 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.5 tttt -71.2 -45.13 64.05 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 122.342 1.068 . . . . 73.099999999999994 108.779 -174.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 20.0 t -55.58 -46.16 79.02 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.557 0 CA-C-N 112.629 -2.078 . . . . 66.519999999999996 110.98 174.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.6 mt -56.95 -49.46 75.61 Favored 'General case' 0 CA--C 1.557 1.215 0 O-C-N 121.905 -0.497 . . . . 66.980000000000004 111.932 174.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.2 m -58.01 -37.66 74.73 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 121.346 -0.847 . . . . 74.569999999999993 110.412 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -67.66 -43.22 80.76 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.613 1.197 . . . . 79.930000000000007 112.523 179.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.67 -36.07 81.68 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.266 -0.879 . . . . 81.140000000000001 109.135 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.8 t-20 -64.31 -66.2 0.57 Allowed 'General case' 0 CA--C 1.489 -1.376 0 C-N-CA 124.069 0.947 . . . . 86.040000000000006 109.219 175.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.0 t -58.75 -45.11 91.35 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 CA-C-N 116.145 -0.48 . . . . 92.420000000000002 110.634 -168.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.606 ' OE2' ' NZ ' ' A' ' 102' ' ' LYS . 3.2 pt-20 -102.29 8.75 40.3 Favored 'General case' 0 C--O 1.257 1.497 0 N-CA-C 113.265 0.839 . . . . 94.989999999999995 113.265 -171.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 58.1 54.93 5.52 Favored 'General case' 0 CA--C 1.555 1.162 0 N-CA-C 114.648 1.351 . . . . 95.629999999999995 114.648 170.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -115.93 118.6 33.41 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 121.513 -0.742 . . . . 91.010000000000005 109.366 -173.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -81.81 -31.12 31.9 Favored 'General case' 0 C--O 1.198 -1.625 0 CA-C-O 118.62 -0.705 . . . . 86.109999999999999 112.772 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 99.5 p -56.14 -30.61 62.39 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 119.277 0.944 . . . . 84.819999999999993 110.378 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.606 ' NZ ' ' OE2' ' A' ' 97' ' ' GLU . 34.9 mttt -71.97 -45.51 60.78 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 114.372 -1.286 . . . . 75.819999999999993 114.259 -178.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.44 HD12 HD12 ' A' ' 42' ' ' ILE . 24.5 mt -59.89 -36.98 69.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 C-N-CA 120.272 -0.571 . . . . 68.219999999999999 112.447 170.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -51.91 -37.41 52.4 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 114.511 1.3 . . . . 81.340000000000003 114.511 168.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.29 -44.23 88.6 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 119.901 -0.72 . . . . 74.150000000000006 109.239 -179.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 80.8 t -64.48 -50.13 77.51 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.17 0 N-CA-C 113.163 0.801 . . . . 64.189999999999998 113.163 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.435 HD13 ' CB ' ' A' ' 35' ' ' SER . 0.0 OUTLIER -46.69 -51.65 15.58 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 115.719 1.748 . . . . 64.019999999999996 115.719 167.012 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 34.6 m-20 -58.83 -30.14 67.43 Favored 'General case' 0 CA--C 1.478 -1.794 0 N-CA-C 106.682 -1.599 . . . . 75.969999999999999 106.682 176.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.38 -47.03 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 C-N-CA 117.008 -1.877 . . . . 61.549999999999997 110.354 -173.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.84 -29.39 69.29 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 120.427 -0.509 . . . . 59.920000000000002 111.098 -178.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.563 ' HG3' HD21 ' A' ' 32' ' ' LEU . 38.1 mtm180 -60.91 -48.07 83.5 Favored 'General case' 0 N--CA 1.419 -1.978 0 CA-C-N 119.021 0.828 . . . . 93.930000000000007 110.928 173.122 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -61.96 -39.39 97.49 Favored Glycine 0 C--O 1.184 -3.017 0 C-N-CA 118.808 -1.663 . . . . 62.770000000000003 112.355 -178.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 55.4 mt -65.17 -43.71 90.88 Favored 'General case' 0 CA--C 1.461 -2.449 0 O-C-N 120.962 -1.317 . . . . 60.670000000000002 108.709 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 51.7 tp -70.16 -41.3 73.99 Favored 'General case' 0 C--O 1.254 1.318 0 CA-C-O 121.948 0.88 . . . . 64.260000000000005 110.633 -173.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 200' ' ' HOH . 64.4 tt0 -60.17 -44.13 95.28 Favored 'General case' 0 C--O 1.2 -1.523 0 C-N-CA 119.089 -1.044 . . . . 75.640000000000001 110.393 176.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -64.38 -41.52 96.64 Favored 'General case' 0 C--O 1.197 -1.694 0 O-C-N 121.556 -0.715 . . . . 60.590000000000003 110.223 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' TRP . . . . . 0.52 ' CZ2' HD12 ' A' ' 24' ' ' ILE . 72.2 t-105 -65.76 -44.27 86.39 Favored 'General case' 0 CA--C 1.483 -1.601 0 CA-C-O 118.508 -0.758 . . . . 61.979999999999997 110.113 -175.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 79.8 mtt180 -63.97 -40.02 95.45 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.07 1.507 . . . . 67.849999999999994 115.07 172.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -52.27 -45.35 65.4 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 113.953 1.094 . . . . 71.290000000000006 113.953 172.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 72.2 mt -72.4 -33.49 45.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 N-CA-C 114.374 1.249 . . . . 69.370000000000005 114.374 177.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 61.8 m80 -110.13 49.64 0.84 Allowed 'General case' 0 C--N 1.316 -0.859 0 O-C-N 121.547 -0.721 . . . . 71.950000000000003 112.025 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 48.2 t -56.71 -50.39 72.32 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.136 -1.393 . . . . 78.430000000000007 110.159 -168.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -71.54 -35.22 70.58 Favored 'General case' 0 CA--C 1.587 2.399 0 C-N-CA 118.86 -1.136 . . . . 87.650000000000006 113.794 -175.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -76.25 -34.66 59.18 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 126.346 1.858 . . . . 85.069999999999993 111.201 -169.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.451 ' CD2' ' HG2' ' A' ' 22' ' ' LYS . 19.8 mt -101.26 7.55 42.87 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 115.132 1.53 . . . . 74.629999999999995 115.132 -171.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.211 -0.97 0 C-N-CA 125.315 1.446 . . . . 80.840000000000003 111.557 172.957 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.49 1.291 0 N-CA-C 116.711 1.773 . . . . 114.59 116.711 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.58 -34.82 34.98 Favored 'General case' 0 C--N 1.308 -1.199 0 O-C-N 120.427 -1.421 . . . . 101.44 110.168 -175.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -60.13 -30.4 69.26 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.627 0.727 . . . . 114.67 110.373 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 29.6 tp -57.44 -53.63 55.91 Favored 'General case' 0 CA--C 1.485 -1.54 0 CA-C-N 115.622 -0.717 . . . . 81.819999999999993 111.336 173.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.46 HD13 ' CZ2' ' B' ' 117' ' ' TRP . 12.4 mt -59.57 -45.4 94.08 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.437 0 O-C-N 124.469 1.105 . . . . 68.769999999999996 112.052 178.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -52.1 -49.41 63.67 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-O 122.274 1.035 . . . . 84.329999999999998 112.003 174.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' MET . . . . . 0.494 ' SD ' ' HG2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -59.82 -37.26 78.67 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 117.718 -1.593 . . . . 73.680000000000007 112.514 -179.493 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 76.0 mt -66.13 -43.65 86.51 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 124.14 0.9 . . . . 62.799999999999997 111.463 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -61.73 -38.2 87.05 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 115.302 -0.863 . . . . 68.870000000000005 112.518 173.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -68.9 -35.42 76.83 Favored 'General case' 0 C--O 1.195 -1.814 0 N-CA-C 114.24 1.2 . . . . 89.540000000000006 114.24 175.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.59 -46.51 94.27 Favored Glycine 0 C--O 1.21 -1.374 0 O-C-N 121.184 -0.948 . . . . 59.380000000000003 112.3 176.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.454 HG13 HG21 ' B' ' 60' ' ' ILE . 57.4 mt -57.68 -45.99 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.075 0 N-CA-C 107.555 -1.276 . . . . 54.009999999999998 107.555 174.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.593 HD21 ' HG3' ' B' ' 111' ' ' ARG . 7.9 mt -59.18 -38.17 79.15 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.02 -1.104 . . . . 64.049999999999997 108.02 -169.229 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 43.8 ttm-85 -85.12 -47.78 9.82 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-N 113.804 -1.544 . . . . 67.109999999999999 107.273 -164.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -70.37 -30.14 66.99 Favored 'General case' 0 CA--C 1.451 -2.836 0 CA-C-N 113.842 -1.527 . . . . 58.649999999999999 111.186 -176.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' SER . . . . . 0.439 ' HB3' HD13 ' B' ' 107' ' ' LEU . 17.5 m -70.43 -47.82 58.91 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 125.211 1.569 . . . . 59.359999999999999 107.138 -179.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 21.6 t -58.87 -40.0 83.05 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 106.179 -1.786 . . . . 67.069999999999993 106.179 179.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -69.95 -46.35 65.46 Favored 'General case' 0 CA--C 1.577 1.986 0 C-N-CA 118.488 -1.285 . . . . 70.900000000000006 110.63 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -55.93 -39.77 72.18 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 119.369 0.986 . . . . 63.32 110.887 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -52.5 -61.96 1.95 Allowed 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 107.596 -1.261 . . . . 86.049999999999997 107.596 176.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -52.91 -36.57 59.71 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 115.121 -0.945 . . . . 86.290000000000006 111.751 -173.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' CYS . . . . . . . . . . . . . 99.2 m -68.79 -25.36 64.66 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.857 0.688 . . . . 70.129999999999995 112.857 -178.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 87.8 mt -74.28 -40.45 50.2 Favored 'Isoleucine or valine' 0 C--O 1.259 1.597 0 CA-C-O 120.823 0.344 . . . . 77.629999999999995 110.287 174.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -59.37 -42.92 92.75 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-N 115.512 -0.767 . . . . 83.469999999999999 108.976 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 61.8 m-20 -88.98 2.49 53.87 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 113.0 0.741 . . . . 91.640000000000001 113.0 -177.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 43.67 63.35 1.59 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 118.999 -0.524 . . . . 99.5 111.534 -170.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 -105.7 107.46 18.46 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 107.572 -1.27 . . . . 83.170000000000002 107.572 159.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 15.8 mm -80.21 -50.31 17.71 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.305 0 N-CA-C 105.897 -1.89 . . . . 75.069999999999993 105.897 -166.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -55.88 -42.28 75.7 Favored 'General case' 0 N--CA 1.414 -2.272 0 CA-C-N 114.227 -1.352 . . . . 79.010000000000005 111.016 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -68.27 -37.61 80.88 Favored 'General case' 0 CA--C 1.557 1.222 0 CA-C-O 122.417 1.103 . . . . 77.579999999999998 109.93 -176.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 ttpt -62.83 -49.41 75.02 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 115.106 1.521 . . . . 71.829999999999998 115.106 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ILE . . . . . . . . . . . . . 14.2 mt -54.4 -52.61 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.36 0 N-CA-C 107.536 -1.283 . . . . 56.979999999999997 107.536 174.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -42.88 -67.19 0.29 Allowed 'General case' 0 C--O 1.206 -1.22 0 CA-C-O 122.014 0.911 . . . . 55.25 109.385 173.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.48 ' O ' HG23 ' B' ' 57' ' ' VAL . 48.5 m-85 -62.03 -41.8 98.48 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.369 -1.457 . . . . 57.539999999999999 113.667 -171.55 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 6.0 mt -61.07 -41.38 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 C-N-CA 117.966 -1.493 . . . . 57.939999999999998 111.829 176.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -57.2 -28.91 63.26 Favored 'General case' 0 CA--C 1.481 -1.688 0 C-N-CA 118.016 -1.473 . . . . 58.140000000000001 110.675 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ARG . . . . . 0.546 ' NH1' ' OD2' ' B' ' 59' ' ' ASP . 0.0 OUTLIER -75.13 -39.71 60.3 Favored 'General case' 0 N--CA 1.426 -1.628 0 CA-C-N 114.249 -1.341 . . . . 59.619999999999997 108.494 -171.598 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 53' ' ' TYR . 4.8 t -70.06 -40.27 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.76 0 CA-C-N 115.318 -0.855 . . . . 56.899999999999999 109.77 179.3 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 7.4 m -58.62 -44.01 89.84 Favored 'General case' 0 C--O 1.179 -2.62 0 N-CA-C 108.044 -1.095 . . . . 59.259999999999998 108.044 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ASP . . . . . 0.546 ' OD2' ' NH1' ' B' ' 56' ' ' ARG . 48.0 m-20 -61.62 -25.92 67.66 Favored 'General case' 0 C--N 1.307 -1.274 0 O-C-N 121.149 -0.969 . . . . 63.18 110.747 -177.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ILE . . . . . 0.454 HG21 HG13 ' B' ' 31' ' ' ILE . 39.1 mt -80.09 -53.27 13.23 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.753 0 CA-C-N 115.344 -0.844 . . . . 58.859999999999999 108.871 -173.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -56.06 -26.89 51.2 Favored 'General case' 0 C--O 1.262 1.713 0 N-CA-C 115.538 1.681 . . . . 61.880000000000003 115.538 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' THR . . . . . . . . . . . . . 87.7 m -71.05 -49.01 49.44 Favored 'General case' 0 CA--C 1.496 -1.131 0 N-CA-C 107.301 -1.37 . . . . 66.150000000000006 107.301 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -49.63 -54.83 16.2 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 114.759 -1.109 . . . . 73.290000000000006 111.83 169.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 26.4 mt -50.83 -53.54 31.34 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.814 0.696 . . . . 68.450000000000003 110.555 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 23.7 mt -54.58 -38.6 66.91 Favored 'General case' 0 CA--C 1.552 1.035 0 N-CA-C 115.391 1.626 . . . . 76.670000000000002 115.391 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 -69.31 -12.23 61.49 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 117.904 2.557 . . . . 88.969999999999999 117.904 174.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . 0.263 39.2 pt -115.5 17.79 7.57 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.897 0 N-CA-C 115.472 1.656 . . . . 83.769999999999996 115.472 -178.001 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 21.2 mt -80.46 140.16 36.08 Favored 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 120.556 -1.34 . . . . 91.450000000000003 108.056 178.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -101.05 118.86 37.83 Favored 'General case' 0 CA--C 1.569 1.685 0 CA-C-N 115.068 -0.969 . . . . 113.0 110.886 173.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -84.99 -12.96 52.08 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 120.929 -1.107 . . . . 109.48999999999999 113.263 -174.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.33 -57.01 3.11 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 106.854 -1.536 . . . . 111.23999999999999 106.854 -174.383 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -80.08 -35.02 37.55 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 125.117 1.511 . . . . 106.06 111.145 -172.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLY . . . . . 0.456 ' O ' ' C ' ' B' ' 74' ' ' GLY . . . -80.77 2.57 79.01 Favored Glycine 0 CA--C 1.539 1.532 0 N-CA-C 116.876 1.51 . . . . 101.95999999999999 116.876 176.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLY . . . . . 0.456 ' C ' ' O ' ' B' ' 73' ' ' GLY . . . 24.01 -113.5 0.01 OUTLIER Glycine 0 C--N 1.339 0.749 0 CA-C-O 121.929 0.739 . . . . 104.56999999999999 114.354 -179.615 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -67.68 -37.95 83.03 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 115.011 1.485 . . . . 100.67 115.011 -172.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -79.04 -31.77 14.95 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.921 0 N-CA-C 108.164 -1.05 . . . . 96.260000000000005 108.164 -171.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -56.46 -49.37 74.81 Favored 'General case' 0 C--O 1.238 0.494 0 O-C-N 124.668 1.23 . . . . 90.010000000000005 108.797 169.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' VAL . . . . . . . . . . . . . 65.4 t -56.21 -54.41 27.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.027 0 C-N-CA 117.741 -1.584 . . . . 94.760000000000005 109.59 173.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -49.6 -36.92 25.81 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.436 0.902 . . . . 90.680000000000007 113.436 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 55.4 mt -77.33 -37.56 52.21 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 122.03 0.919 . . . . 76.5 112.171 -174.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 11.5 m -52.11 -52.05 53.91 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.01 -0.995 . . . . 74.310000000000002 109.106 167.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -57.59 -32.87 65.63 Favored Glycine 0 N--CA 1.429 -1.818 0 C-N-CA 120.645 -0.788 . . . . 76.519999999999996 114.057 176.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.0 tp -78.87 -48.16 15.2 Favored 'General case' 0 CA--C 1.474 -1.955 0 N-CA-C 108.949 -0.76 . . . . 75.420000000000002 108.949 -175.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 -69.49 -41.51 76.03 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 117.245 -1.359 . . . . 70.769999999999996 113.115 -178.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' THR . . . . . . . . . . . . . 76.8 p -65.17 -39.08 92.44 Favored 'General case' 0 C--O 1.279 2.637 0 N-CA-C 106.191 -1.781 . . . . 83.019999999999996 106.191 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -59.99 -43.88 94.86 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 114.534 -1.212 . . . . 91.700000000000003 111.353 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.94 -34.7 76.57 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.898 0.703 . . . . 78.019999999999996 112.898 -175.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 59.7 mt -70.3 -38.51 74.57 Favored 'Isoleucine or valine' 0 C--O 1.262 1.726 0 C-N-CA 125.313 1.445 . . . . 70.329999999999998 111.471 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -68.32 -48.38 65.03 Favored 'General case' 0 C--O 1.261 1.683 0 N-CA-C 108.31 -0.996 . . . . 91.349999999999994 108.31 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 15.9 t -54.36 -46.17 69.4 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.797 0 CA-C-N 114.894 -1.048 . . . . 78.689999999999998 110.407 173.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 18.3 mt -58.15 -54.59 45.3 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 113.457 0.91 . . . . 70.75 113.457 175.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 65.0 m -46.9 -39.17 11.66 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.77 0.828 . . . . 81.129999999999995 110.719 173.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -69.45 -50.82 42.09 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.514 -0.742 . . . . 93.909999999999997 110.191 -178.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.35 -42.61 70.46 Favored 'General case' 0 N--CA 1.444 -0.738 0 O-C-N 124.961 1.413 . . . . 83.409999999999997 110.256 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 63.2 t-20 -61.31 -57.83 10.72 Favored 'General case' 0 C--O 1.2 -1.535 0 N-CA-C 108.091 -1.077 . . . . 85.930000000000007 108.091 175.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 4.1 t -67.27 -43.46 88.11 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.652 0 N-CA-C 108.206 -1.035 . . . . 99.609999999999999 108.206 -163.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -108.02 14.94 24.77 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 123.69 0.619 . . . . 105.81 112.029 -170.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 51.99 47.54 24.55 Favored 'General case' 0 C--O 1.21 -1.016 0 N-CA-C 117.1 2.259 . . . . 96.189999999999998 117.1 171.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -110.67 118.72 36.95 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.408 1.083 . . . . 103.51000000000001 109.046 -175.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -81.06 -38.29 27.61 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.626 0.602 . . . . 91.620000000000005 112.626 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 22.4 p -47.51 -27.1 1.62 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.066 0.946 . . . . 97.549999999999997 110.946 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 39.8 mttt -75.98 -46.64 28.55 Favored 'General case' 0 C--O 1.259 1.57 0 CA-C-N 114.698 -1.137 . . . . 86.140000000000001 112.904 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 22.1 mt -55.58 -36.64 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 CA-C-O 119.146 -0.454 . . . . 75.719999999999999 110.037 171.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -55.87 -48.78 74.94 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 117.396 -1.721 . . . . 91.510000000000005 112.181 173.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 36.1 mt -52.38 -40.07 61.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 121.632 -0.668 . . . . 93.790000000000006 109.593 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 40.3 t -70.82 -51.93 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-O 121.232 0.539 . . . . 75.650000000000006 112.381 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' LEU . . . . . 0.579 ' HB3' HH21 ' B' ' 111' ' ' ARG . 0.2 OUTLIER -37.08 -52.66 0.99 Allowed 'General case' 0 CA--C 1.588 2.416 0 N-CA-C 114.427 1.269 . . . . 74.549999999999997 114.427 164.48 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -67.12 -24.65 65.94 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 121.257 0.551 . . . . 94.129999999999995 111.679 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 37.2 t -74.58 -60.87 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-O 118.314 -0.85 . . . . 76.329999999999998 111.847 177.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -51.83 -44.63 63.64 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 109.597 -0.52 . . . . 74.719999999999999 109.597 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' ARG . . . . . 0.593 ' HG3' HD21 ' B' ' 32' ' ' LEU . 27.4 mtm180 -49.57 -58.03 5.99 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 121.171 -0.212 . . . . 114.56 111.243 175.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . -57.14 -40.07 90.94 Favored Glycine 0 C--O 1.201 -1.937 0 O-C-N 124.808 1.318 . . . . 84.540000000000006 114.0 173.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 97.7 mt -66.36 -43.38 86.14 Favored 'General case' 0 C--O 1.247 0.93 0 CA-C-N 120.102 1.951 . . . . 81.260000000000005 109.876 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.44 HD22 HD12 ' B' ' 32' ' ' LEU . 62.6 tp -72.44 -35.42 68.28 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 112.912 0.708 . . . . 84.019999999999996 112.912 -171.802 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -63.43 -45.37 91.27 Favored 'General case' 0 CA--C 1.579 2.067 0 O-C-N 124.231 0.957 . . . . 109.04000000000001 110.324 173.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -53.85 -49.94 67.33 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.099 1.518 . . . . 88.420000000000002 115.099 168.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' TRP . . . . . 0.46 ' CZ2' HD13 ' B' ' 24' ' ' ILE . 34.5 t-105 -55.79 -59.14 5.29 Favored 'General case' 0 N--CA 1.507 2.384 0 N-CA-C 114.853 1.427 . . . . 88.180000000000007 114.853 177.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 87.8 mtt180 -52.04 -49.16 63.98 Favored 'General case' 0 C--O 1.263 1.774 0 CA-C-N 115.709 -0.678 . . . . 98.189999999999998 112.38 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -48.11 -48.57 33.75 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-O 118.383 -0.818 . . . . 110.92 111.035 177.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 18.5 mt . . . . . 0 CA--C 1.553 1.066 0 CA-C-N 119.93 1.241 . . . . 102.55 108.868 168.314 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . 0.786 ' O ' ' HD3' ' A' ' 33' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' HOH . . . . . 0.507 ' O ' ' HG3' ' A' ' 115' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_