data_2o8x_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 2o8x _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 ' 116' ' ' MET . . . . . 0.432 ' CG ' ' N ' ' A' ' 117' ' ' GLY . 0.2 OUTLIER . . . . . 0 N--CA 1.503 2.197 0 N-CA-C 114.914 1.45 . . . . 75.25 114.914 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . 0.432 ' N ' ' CG ' ' A' ' 116' ' ' MET . . . -98.96 -13.05 41.11 Favored Glycine 0 N--CA 1.473 1.126 0 C-N-CA 125.281 1.419 . . . . 71.0 111.556 170.093 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -77.42 -23.43 50.58 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 121.032 0.444 . . . . 69.109999999999999 112.004 168.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.78 -29.24 66.66 Favored 'General case' 0 C--O 1.251 1.155 0 C-N-CA 118.764 -1.174 . . . . 76.030000000000001 110.809 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' A' ' 124' ' ' VAL . 0.7 OUTLIER -82.37 -54.0 5.57 Favored 'General case' 0 CA--C 1.498 -1.049 0 O-C-N 123.892 0.745 . . . . 77.829999999999998 110.432 -179.853 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LEU . . . . . 1.454 ' O ' ' CG2' ' A' ' 125' ' ' THR . 51.8 mt -49.88 -28.49 6.63 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 124.049 0.843 . . . . 68.959999999999994 111.842 -174.257 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . 0.433 ' CA ' ' CG2' ' A' ' 125' ' ' THR . 13.2 m -86.43 -40.44 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.431 -0.804 . . . . 66.629999999999995 109.449 179.099 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.24 -37.26 79.85 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 105.671 -1.974 . . . . 73.260000000000005 105.671 177.801 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' VAL . . . . . 0.609 ' CG1' ' N ' ' A' ' 125' ' ' THR 0.269 0.9 OUTLIER -78.17 -52.89 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.563 0 CA-C-O 122.497 1.142 . . . . 63.490000000000002 109.845 -175.448 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' THR . . . . . 1.454 ' CG2' ' O ' ' A' ' 121' ' ' LEU . 0.2 OUTLIER -74.24 -14.41 60.92 Favored 'General case' 0 N--CA 1.416 -2.143 0 N-CA-C 106.058 -1.83 . . . . 60.899999999999999 106.058 -168.407 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -25.56 46.75 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-N 114.729 -1.123 . . . . 59.609999999999999 109.283 173.359 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.29 -50.88 10.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 58.719999999999999 111.241 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 3.7 pt -58.85 -2.74 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 55.18 111.174 175.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -92.45 -22.35 19.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 54.450000000000003 111.185 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -83.71 -10.0 58.45 Favored 'General case' 0 N--CA 1.411 -2.425 0 CA-C-O 118.162 -0.923 . . . . 57.039999999999999 109.405 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LEU . . . . . 0.693 ' C ' ' O ' ' A' ' 132' ' ' THR 0.419 85.6 mt -79.39 -160.63 0.26 Allowed 'General case' 0 C--O 1.184 -2.393 0 N-CA-C 101.942 -3.355 . . . . 53.380000000000003 101.942 -158.741 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' THR . . . . . 0.931 ' CG2' ' N ' ' A' ' 133' ' ' THR 0.293 0.9 OUTLIER -90.76 -161.62 0.82 Allowed 'General case' 0 CA--C 1.448 -2.964 1 N-CA-C 83.688 -10.116 . . . . 50.82 83.688 -159.808 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' THR . . . . . 0.931 ' N ' ' CG2' ' A' ' 132' ' ' THR . 0.3 OUTLIER -93.33 -33.11 14.03 Favored 'General case' 0 CA--C 1.475 -1.933 0 C-N-CA 114.452 -2.899 . . . . 50.409999999999997 110.405 159.008 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ASP . . . . . 0.48 ' N ' ' CG2' ' A' ' 132' ' ' THR . 6.6 m-20 -65.17 -26.88 68.35 Favored 'General case' 0 C--O 1.197 -1.702 0 CA-C-N 114.773 -1.103 . . . . 55.479999999999997 108.753 -176.287 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -77.06 -47.61 20.1 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 109.05 -0.722 . . . . 49.479999999999997 109.05 171.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 9.7 ttm105 -51.18 -50.56 58.78 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.782 -0.767 . . . . 53.32 112.3 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -53.41 -55.81 21.97 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.545 -0.909 . . . . 46.170000000000002 108.545 179.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -57.23 -56.6 19.66 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 108.583 -0.895 . . . . 40.68 108.583 -169.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 6.2 tp -52.14 -44.62 64.63 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 114.435 -1.257 . . . . 37.409999999999997 110.863 177.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 6.9 mt -65.51 -47.57 75.5 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 118.233 -1.387 . . . . 36.509999999999998 112.32 -174.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 91.0 mt -59.56 -48.51 81.37 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 121.457 0.646 . . . . 33.520000000000003 111.036 -178.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 77.7 p -73.8 -35.13 64.86 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-O 118.1 -0.953 . . . . 32.840000000000003 111.216 -176.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -98.33 -42.9 7.16 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 117.569 2.433 . . . . 34.759999999999998 117.569 -176.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 30.8 tp -75.07 -58.86 3.02 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 108.943 -0.762 . . . . 35.740000000000002 108.943 172.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.77 -14.01 62.27 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 118.28 -1.368 . . . . 34.509999999999998 114.006 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 55.58 34.27 60.11 Favored Glycine 0 N--CA 1.432 -1.584 0 N-CA-C 111.556 -0.617 . . . . 32.75 111.556 -176.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 78.8 mt -72.01 152.44 42.44 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 117.761 0.781 . . . . 31.030000000000001 112.216 174.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 78.0 p -66.81 167.64 11.03 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.369 -1.715 . . . . 30.02 106.369 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -61.6 -39.69 92.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 120.198 -0.601 . . . . 31.539999999999999 112.283 169.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.12 -44.06 96.69 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 108.596 -0.89 . . . . 33.219999999999999 108.596 -176.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -66.82 -50.24 63.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.325 -0.852 . . . . 33.509999999999998 110.086 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -53.85 -55.13 29.45 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.95 0.781 . . . . 35.590000000000003 110.771 174.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -51.85 -49.88 62.0 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 107.148 -1.427 . . . . 37.950000000000003 107.148 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -50.0 -65.13 0.61 Allowed 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 109.269 -0.641 . . . . 41.060000000000002 109.269 -177.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 25.4 t -40.4 -44.9 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 125.495 1.518 . . . . 43.119999999999997 113.427 178.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' CYS . . . . . . . . . . . . . 63.0 m -82.45 -16.59 48.33 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 115.156 1.539 . . . . 48.719999999999999 115.156 -174.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 68.05 49.86 44.36 Favored Glycine 0 C--O 1.213 -1.197 0 O-C-N 124.093 0.871 . . . . 49.109999999999999 113.966 -169.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 24.2 p -142.77 166.26 21.74 Favored Pre-proline 0 C--O 1.244 0.805 0 CA-C-N 118.448 1.124 . . . . 52.340000000000003 111.65 169.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.82 153.95 75.29 Favored 'Trans proline' 0 C--N 1.36 1.179 0 C-N-CA 120.822 1.015 . . . . 50.119999999999997 111.644 171.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -56.37 -33.98 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 113.863 1.06 . . . . 49.469999999999999 113.863 178.144 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' GLY . . . . . . . . . . . . . . . -58.49 -41.79 95.56 Favored Glycine 0 C--O 1.246 0.855 0 N-CA-C 109.115 -1.594 . . . . 48.549999999999997 109.115 -174.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 59.2 m -63.09 -53.07 59.39 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.803 -0.698 . . . . 48.560000000000002 111.159 -178.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 3.1 mm -52.62 -54.96 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 119.167 -0.444 . . . . 47.009999999999998 110.311 172.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.52 -50.38 2.94 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 123.606 0.566 . . . . 61.109999999999999 111.161 176.411 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 24.5 p -75.22 -44.15 47.84 Favored 'General case' 0 C--O 1.206 -1.228 0 N-CA-C 112.454 0.539 . . . . 45.350000000000001 112.454 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -48.72 -53.35 19.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.319 0.859 . . . . 43.0 113.319 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -61.79 -34.36 62.08 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.237 0 N-CA-C 113.642 0.978 . . . . 41.549999999999997 113.642 171.882 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' ALA . . . . . . . . . . . . . . . -60.24 -49.35 77.96 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.568 -1.333 . . . . 44.759999999999998 113.706 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -62.07 -39.87 93.89 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.35 -0.982 . . . . 63.960000000000001 108.35 175.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.71 92.67 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 115.02 -0.991 . . . . 45.729999999999997 110.323 -176.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -65.32 -46.96 78.21 Favored 'General case' 0 CA--C 1.495 -1.138 0 CA-C-N 114.559 -1.2 . . . . 45.549999999999997 111.472 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -53.23 -49.0 67.7 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 124.273 0.983 . . . . 52.060000000000002 113.157 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -59.33 -44.14 92.64 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.407 1.083 . . . . 45.5 111.556 -175.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 4.7 mp -78.35 -12.47 60.01 Favored 'General case' 0 CA--C 1.493 -1.223 0 CA-C-N 114.906 -1.043 . . . . 46.549999999999997 109.346 -175.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 80.3 mt -98.36 -19.36 17.8 Favored 'General case' 0 CA--C 1.506 -0.745 0 C-N-CA 118.711 -1.196 . . . . 48.840000000000003 112.427 176.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.334 0 C-N-CA 125.506 1.522 . . . . 49.490000000000002 113.743 -178.683 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' MET . . . . . 0.805 ' N ' ' N ' ' B' ' 118' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.209 -1.056 0 N-CA-C 107.928 -1.138 . . . . 71.799999999999997 107.928 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' GLY . . . . . 1.192 ' O ' ' CD1' ' B' ' 121' ' ' LEU . . . -61.12 -38.83 96.23 Favored Glycine 0 C--O 1.202 -1.856 0 N-CA-C 117.581 1.792 . . . . 67.530000000000001 117.581 107.68 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' PHE . . . . . 0.805 ' N ' ' N ' ' B' ' 116' ' ' MET . 60.7 t80 -46.26 -42.81 14.96 Favored 'General case' 0 C--O 1.198 -1.657 0 N-CA-C 111.872 0.323 . . . . 65.549999999999997 111.872 172.12 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLU . . . . . 0.563 ' N ' ' N ' ' B' ' 116' ' ' MET . 43.6 mt-10 -59.4 -36.82 76.56 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 114.083 1.142 . . . . 69.260000000000005 114.083 177.743 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ASP . . . . . 0.877 ' O ' ' CB ' ' B' ' 123' ' ' GLU . 75.0 m-20 -71.3 -60.94 1.96 Allowed 'General case' 0 CA--C 1.481 -1.701 0 CA-C-O 121.717 0.77 . . . . 65.680000000000007 109.716 -172.492 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' LEU . . . . . 1.192 ' CD1' ' O ' ' B' ' 117' ' ' GLY . 3.2 mp -44.58 -43.71 8.29 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 114.956 1.465 . . . . 61.539999999999999 114.956 -177.728 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' VAL . . . . . 0.499 ' CG2' ' O ' ' B' ' 118' ' ' PHE 0.467 0.8 OUTLIER -67.99 -43.09 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.845 0 N-CA-C 118.739 2.866 . . . . 61.18 118.739 163.138 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' GLU . . . . . 0.877 ' CB ' ' O ' ' B' ' 120' ' ' ASP 0.407 0.0 OUTLIER -40.28 -53.53 2.52 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-N 115.593 -0.731 . . . . 65.469999999999999 110.83 160.185 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' VAL . . . . . 0.633 ' CG1' ' N ' ' B' ' 125' ' ' THR . 1.8 t -65.6 -68.62 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.263 0 C-N-CA 118.873 -1.131 . . . . 56.899999999999999 110.253 -178.958 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' THR . . . . . 0.875 ' CG2' ' O ' ' B' ' 121' ' ' LEU . 0.9 OUTLIER -57.39 -19.05 20.76 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 115.365 -0.834 . . . . 55.829999999999998 110.201 -157.682 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' THR . . . . . 0.411 ' N ' ' O ' ' B' ' 124' ' ' VAL . 7.5 p -67.29 -48.05 68.8 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 112.262 0.468 . . . . 53.560000000000002 112.262 167.677 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' MET . . . . . 0.565 ' N ' ' O ' ' B' ' 124' ' ' VAL . 14.6 mtp -50.1 -16.68 0.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.321 0.388 . . . . 57.450000000000003 111.185 177.771 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ILE . . . . . 0.61 ' CD1' ' CD2' ' B' ' 174' ' ' LEU . 22.2 mm -114.99 -59.99 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 54.799999999999997 111.172 -152.131 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ALA . . . . . . . . . . . . . . . -14.63 -37.14 0.0 OUTLIER 'General case' 0 C--N 1.345 0.405 0 CA-C-O 121.998 0.904 . . . . 55.82 112.481 133.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' ASP . . . . . 0.556 ' N ' ' C ' ' B' ' 128' ' ' ILE . 0.6 OUTLIER -81.77 -26.55 34.36 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 115.804 -0.634 . . . . 62.630000000000003 111.171 -165.618 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 28.2 mt -52.08 -63.57 1.09 Allowed 'General case' 0 C--O 1.19 -2.074 1 N-CA-C 145.535 12.791 . . . . 53.789999999999999 145.535 -156.667 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' THR . . . . . 1.142 ' O ' ' O2 ' ' B' ' 109' ' ' SO4 0.259 42.4 p -127.87 -72.14 0.63 Allowed 'General case' 0 CA--C 1.44 -3.254 1 N-CA-C 122.935 4.421 . . . . 50.229999999999997 122.935 125.722 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' THR . . . . . 0.643 ' N ' ' OG1' ' B' ' 132' ' ' THR . 0.1 OUTLIER -132.07 -39.68 1.06 Allowed 'General case' 0 C--O 1.21 -0.975 1 C-N-CA 155.344 13.458 . . . . 52.149999999999999 116.197 110.936 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' ASP . . . . . 0.649 ' N ' ' OG1' ' B' ' 132' ' ' THR . 46.0 m-20 -74.31 -31.77 62.6 Favored 'General case' 0 C--O 1.191 -1.996 0 CA-C-N 113.961 -1.472 . . . . 53.210000000000001 113.86 -170.133 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' GLN . . . . . 0.806 ' OE1' ' O3 ' ' B' ' 106' ' ' SO4 . 0.0 OUTLIER -65.18 -52.7 53.32 Favored 'General case' 0 C--O 1.185 -2.331 0 N-CA-C 113.348 0.869 . . . . 55.520000000000003 113.348 163.499 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ARG . . . . . 0.606 ' NH1' ' OD2' ' C' ' 120' ' ' ASP . 4.9 ttm105 -50.2 -43.34 52.55 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 122.052 -0.405 . . . . 46.280000000000001 110.1 -179.473 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -62.0 -55.21 31.61 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 124.397 1.061 . . . . 51.359999999999999 111.479 -179.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.31 -46.39 69.37 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 123.678 0.611 . . . . 41.340000000000003 112.383 175.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 20.5 tp -63.57 -47.71 80.41 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.239 -0.584 . . . . 38.640000000000001 110.853 -175.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 59.6 mt -70.4 -42.12 72.1 Favored 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 108.365 -0.976 . . . . 40.189999999999998 108.365 -176.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' LEU . . . . . . . . . . . . . 7.9 mt -54.98 -26.01 33.79 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.677 0.611 . . . . 37.189999999999998 112.405 176.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 70.8 p -110.23 -22.89 11.53 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 116.302 1.964 . . . . 34.950000000000003 116.302 -176.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' GLN . . . . . . . . . . . . . 19.5 mm100 -108.19 -41.55 4.87 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 123.671 0.788 . . . . 37.100000000000001 110.67 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 60.1 tp -81.35 -40.81 22.98 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 119.78 -0.768 . . . . 37.030000000000001 109.222 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 1.3 mp -86.53 -26.77 24.38 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 118.425 -1.31 . . . . 34.299999999999997 113.4 174.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' GLY . . . . . . . . . . . . . . . 66.88 22.0 71.77 Favored Glycine 0 C--O 1.217 -0.924 0 N-CA-C 111.611 -0.596 . . . . 35.200000000000003 111.611 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' LEU . . . . . . . . . . . . . 14.3 mt -62.08 139.16 58.46 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.215 1.006 . . . . 38.659999999999997 111.025 168.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 88.3 p -55.05 153.27 6.68 Favored 'General case' 0 C--O 1.238 0.494 0 O-C-N 123.722 0.639 . . . . 35.119999999999997 109.926 169.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -46.49 -57.51 4.64 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 118.654 -1.218 . . . . 44.380000000000003 113.848 169.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -42.24 -55.85 3.15 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 113.622 0.971 . . . . 37.07 113.622 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -57.54 -46.15 84.23 Favored 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 112.788 0.662 . . . . 45.409999999999997 112.788 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -58.63 -46.7 86.52 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.408 0.623 . . . . 37.119999999999997 111.021 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' ALA . . . . . . . . . . . . . . . -58.15 -46.1 86.26 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.575 -1.268 . . . . 38.859999999999999 107.575 -178.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -54.85 -45.55 74.56 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.946 0.879 . . . . 39.710000000000001 111.159 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 47.0 t -61.23 -45.11 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 CA-C-N 115.171 -0.922 . . . . 40.990000000000002 108.968 -177.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' CYS . . . . . . . . . . . . . 45.0 m -89.46 5.85 43.47 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 114.527 1.306 . . . . 44.810000000000002 114.527 -177.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . 45.86 50.96 11.14 Favored Glycine 0 C--O 1.214 -1.146 0 CA-C-O 119.468 -0.629 . . . . 41.009999999999998 113.802 -177.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' CYS . . . . . . . . . . . . . 14.6 p -142.67 159.22 57.99 Favored Pre-proline 0 CA--C 1.557 1.214 0 N-CA-C 107.865 -1.161 . . . . 43.130000000000003 107.865 171.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.41 150.72 79.25 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 121.808 1.672 . . . . 36.119999999999997 115.25 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -44.45 -60.07 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 N-CA-C 113.595 0.961 . . . . 34.740000000000002 113.595 173.257 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -37.98 -37.74 0.46 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 111.673 -0.571 . . . . 35.609999999999999 111.673 -177.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' THR . . . . . . . . . . . . . 12.6 m -65.61 -62.22 1.64 Allowed 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.817 0.673 . . . . 39.140000000000001 112.817 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 28.3 mm -44.66 -42.52 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-O 120.89 0.376 . . . . 42.270000000000003 111.961 169.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 21.5 ttm105 -63.62 -42.69 98.16 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 120.292 -0.563 . . . . 63.829999999999998 110.096 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.7 p -82.38 -27.99 31.76 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 118.932 -1.107 . . . . 39.670000000000002 111.237 -173.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -61.59 -55.18 33.57 Favored 'General case' 0 CA--C 1.519 -0.246 0 O-C-N 123.437 0.46 . . . . 49.390000000000001 110.748 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' VAL . . . . . . . . . . . . . 1.4 p -54.74 -34.56 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 112.927 0.714 . . . . 38.479999999999997 112.927 169.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' ALA . . . . . . . . . . . . . . . -60.19 -44.79 94.82 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 107.217 -1.401 . . . . 41.200000000000003 107.217 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -69.59 -41.32 75.94 Favored 'General case' 0 C--O 1.213 -0.841 0 O-C-N 124.121 0.888 . . . . 57.840000000000003 111.703 -179.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -49.93 -36.31 27.21 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 113.072 0.767 . . . . 43.049999999999997 113.072 170.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -74.22 -27.42 60.78 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.472 -0.768 . . . . 46.25 110.988 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -76.57 -38.59 54.67 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 113.694 0.998 . . . . 55.109999999999999 113.694 -177.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' ALA . . . . . . . . . . . . . . . -70.25 -34.99 73.5 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 107.369 -1.345 . . . . 48.869999999999997 107.369 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' LEU . . . . . 0.61 ' CD2' ' CD1' ' B' ' 128' ' ' ILE . 3.5 mp -74.21 -21.3 59.86 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 114.449 1.277 . . . . 51.619999999999997 114.449 -179.004 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' LEU . . . . . . . . . . . . . 66.5 mt -109.91 -3.96 16.26 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 115.691 1.737 . . . . 50.909999999999997 115.691 -169.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 113.179 0.807 . . . . 52.270000000000003 113.179 -172.018 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' MET . . . . . . . . . . . . 0.375 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.975 0 N-CA-C 118.135 2.643 . . . . 74.510000000000005 118.135 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' GLY . . . . . . . . . . . . . . . 81.62 -124.45 6.46 Favored Glycine 0 C--N 1.349 1.272 0 CA-C-N 123.509 2.868 . . . . 65.099999999999994 108.887 11.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' PHE . . . . . 1.397 ' O ' ' CG2' ' C' ' 122' ' ' VAL . 62.7 m-85 -57.95 -22.52 49.38 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 112.84 0.682 . . . . 62.490000000000002 112.84 177.019 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' GLU . . . . . 0.42 ' C ' ' CG2' ' C' ' 122' ' ' VAL . 12.8 tt0 -52.94 -41.28 64.35 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 117.788 -1.565 . . . . 69.040000000000006 109.401 178.434 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' ASP . . . . . 0.656 ' O ' ' C ' ' C' ' 121' ' ' LEU . 18.9 m-20 -64.78 -69.28 0.3 Allowed 'General case' 0 CA--C 1.488 -1.427 0 CA-C-O 121.583 0.706 . . . . 64.200000000000003 111.912 -179.219 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' LEU . . . . . 0.853 ' N ' ' CD1' ' C' ' 121' ' ' LEU . 1.7 mp -51.37 -30.36 18.64 Favored 'General case' 0 CA--C 1.472 -2.055 1 N-CA-C 100.064 -4.05 . . . . 60.759999999999998 100.064 -161.148 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' VAL . . . . . 1.397 ' CG2' ' O ' ' C' ' 118' ' ' PHE . 1.4 t -50.76 -68.98 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.416 -2.17 0 N-CA-C 102.766 -3.05 . . . . 59.950000000000003 102.766 -176.139 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' C' ' 120' ' ' ASP . 1.5 pt-20 -64.17 -34.98 79.32 Favored 'General case' 0 C--O 1.201 -1.465 0 N-CA-C 113.98 1.104 . . . . 65.640000000000001 113.98 -162.712 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' VAL . . . . . . . . . . . . . 98.0 t -52.89 -51.29 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 CA-C-N 115.587 -0.733 . . . . 57.299999999999997 110.435 165.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' THR . . . . . 0.503 ' OG1' ' O ' ' C' ' 121' ' ' LEU . 24.0 m -57.71 -24.67 58.05 Favored 'General case' 0 C--O 1.199 -1.578 0 C-N-CA 119.693 -0.803 . . . . 54.600000000000001 108.946 -169.252 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 126' ' ' THR . . . . . . . . . . . . . 43.5 p -87.36 -33.29 19.21 Favored 'General case' 0 C--O 1.252 1.229 0 N-CA-C 115.31 1.596 . . . . 51.780000000000001 115.31 -175.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 127' ' ' MET . . . . . 0.425 ' O ' ' N ' ' C' ' 130' ' ' ASP . 3.5 mtt -45.34 -53.75 8.11 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 103.239 -2.875 . . . . 50.520000000000003 103.239 169.592 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 128' ' ' ILE . . . . . 0.544 ' O ' ' C ' ' C' ' 129' ' ' ALA . 49.3 mm -53.43 -59.21 1.97 Allowed 'Isoleucine or valine' 2 C--O 1.021 -10.949 2 CA-C-O 146.253 12.454 . . . . 49.289999999999999 111.251 -166.882 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 129' ' ' ALA . . . . . 0.544 ' C ' ' O ' ' C' ' 128' ' ' ILE . . . -62.48 -23.74 67.08 Favored 'General case' 1 C--N 0.94 -17.226 2 CA-C-N 87.393 -13.549 . . . . 50.469999999999999 113.33 177.056 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 130' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' C' ' 127' ' ' MET . 68.5 m-20 -74.06 -18.96 60.76 Favored 'General case' 0 CA--C 1.522 -0.109 0 N-CA-C 112.282 0.475 . . . . 56.600000000000001 112.282 170.759 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 131' ' ' LEU . . . . . . . . . . . . . 24.5 mt -57.05 161.4 3.08 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.792 -0.818 . . . . 48.170000000000002 108.792 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 132' ' ' THR . . . . . 0.447 ' OG1' ' CG ' ' C' ' 135' ' ' GLN . 4.6 p -68.4 161.84 26.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.938 -1.134 . . . . 47.149999999999999 107.938 173.782 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 133' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.14 -46.2 72.18 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 118.812 -1.155 . . . . 45.850000000000001 108.377 -177.689 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 134' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -61.74 -53.02 61.64 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 117.147 2.277 . . . . 48.990000000000002 117.147 -177.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 135' ' ' GLN . . . . . 0.447 ' CG ' ' OG1' ' C' ' 132' ' ' THR . 0.0 OUTLIER -56.63 -45.26 81.64 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 118.247 -1.381 . . . . 45.030000000000001 114.177 175.014 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 136' ' ' ARG . . . . . . . . . . . . . 23.1 ttm105 -59.87 -39.98 87.13 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.327 0.512 . . . . 47.710000000000001 111.524 176.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 137' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -62.44 -51.99 65.32 Favored 'General case' 0 C--O 1.246 0.877 0 C-N-CA 119.9 -0.72 . . . . 41.880000000000003 110.533 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.16 -45.87 75.7 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 114.831 -1.077 . . . . 36.200000000000003 111.006 -178.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 139' ' ' LEU . . . . . . . . . . . . . 2.0 tp -70.58 -32.77 70.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 123.763 0.664 . . . . 33.780000000000001 111.579 -177.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 140' ' ' LEU . . . . . . . . . . . . . 13.0 mt -74.84 -40.02 61.26 Favored 'General case' 0 CA--C 1.479 -1.782 0 N-CA-C 108.406 -0.961 . . . . 36.039999999999999 108.406 -177.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 141' ' ' LEU . . . . . . . . . . . . . 38.8 mt -62.2 -49.6 75.13 Favored 'General case' 0 C--O 1.245 0.835 0 O-C-N 124.309 1.006 . . . . 34.100000000000001 110.444 -178.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 142' ' ' THR . . . . . . . . . . . . . 75.9 p -77.67 -20.45 53.68 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.468 1.285 . . . . 35.329999999999998 114.468 -178.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 143' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -114.42 -40.21 3.68 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 115.314 1.598 . . . . 36.75 115.314 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 16.1 tp -78.39 -45.66 21.87 Favored 'General case' 0 C--O 1.205 -1.243 0 C-N-CA 117.933 -1.507 . . . . 34.700000000000003 108.039 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 145' ' ' LEU . . . . . . . . . . . . . 9.8 mp -85.53 -32.04 22.4 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 104.82 -2.289 . . . . 37.640000000000001 104.82 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 146' ' ' GLY . . . . . . . . . . . . . . . 66.39 44.95 89.31 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 120.04 -1.076 . . . . 33.43 114.881 -174.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 147' ' ' LEU . . . . . . . . . . . . . 10.4 mt -75.42 153.89 37.41 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 121.86 -0.788 . . . . 32.229999999999997 110.115 171.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 148' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.46 160.74 5.06 Favored 'General case' 0 CA--C 1.488 -1.425 0 N-CA-C 107.281 -1.377 . . . . 33.590000000000003 107.281 168.117 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 149' ' ' TYR . . . . . 0.423 ' N ' ' CD1' ' C' ' 149' ' ' TYR . 1.9 m-85 -58.13 -36.95 73.69 Favored 'General case' 0 C--O 1.215 -0.719 0 N-CA-C 107.83 -1.174 . . . . 41.890000000000001 107.83 171.559 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.03 -50.61 70.43 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 122.389 0.276 . . . . 33.859999999999999 110.969 177.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 151' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -70.14 -40.54 74.75 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 120.974 -0.29 . . . . 35.200000000000003 110.732 -176.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -54.14 -50.03 67.87 Favored 'General case' 0 C--O 1.216 -0.68 0 O-C-N 123.442 0.464 . . . . 32.649999999999999 110.15 172.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 153' ' ' ALA . . . . . . . . . . . . . . . -62.34 -34.4 76.57 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 113.009 0.744 . . . . 33.299999999999997 113.009 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 154' ' ' ALA . . . . . . . . . . . . . . . -64.54 -52.07 59.59 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 121.657 -0.652 . . . . 36.840000000000003 110.296 174.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 155' ' ' VAL . . . . . . . . . . . . . 25.1 t -47.28 -55.5 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-O 119.75 -0.167 . . . . 39.350000000000001 110.904 174.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 156' ' ' CYS . . . . . . . . . . . . . 63.2 m -79.58 -13.49 59.49 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 115.112 1.523 . . . . 40.280000000000001 115.112 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 157' ' ' GLY . . . . . . . . . . . . . . . 58.21 54.62 36.12 Favored Glycine 0 CA--C 1.534 1.219 0 N-CA-C 116.48 1.352 . . . . 40.740000000000002 116.48 -171.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 158' ' ' CYS . . . . . . . . . . . . . 25.0 p -142.48 167.75 15.44 Favored Pre-proline 0 C--O 1.239 0.551 0 O-C-N 122.244 -0.562 . . . . 41.939999999999998 110.303 173.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 159' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -58.94 148.5 84.42 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 122.965 0.981 . . . . 38.719999999999999 112.896 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 160' ' ' VAL . . . . . . . . . . . . . 55.3 t -53.88 -44.6 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.441 0 O-C-N 124.02 0.825 . . . . 37.68 108.91 178.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 161' ' ' GLY . . . . . . . . . . . . . . . -47.53 -40.31 16.49 Favored Glycine 0 C--N 1.336 0.582 0 CA-C-N 114.717 -1.129 . . . . 36.25 111.162 177.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 162' ' ' THR . . . . . . . . . . . . . 1.8 m -56.88 -54.5 45.84 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 119.319 -0.372 . . . . 37.390000000000001 110.951 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 163' ' ' ILE . . . . . . . . . . . . . 1.7 mm -60.68 -46.66 95.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 C-N-CA 120.413 -0.515 . . . . 36.780000000000001 111.572 177.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 164' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.47 -41.49 20.71 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 108.651 -0.87 . . . . 63.420000000000002 108.651 179.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 165' ' ' SER . . . . . . . . . . . . . 13.4 t -72.06 -48.49 43.88 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 113.542 0.941 . . . . 36.009999999999998 113.542 -176.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 166' ' ' ARG . . . . . . . . . . . . . 7.6 mmt85 -60.51 -37.03 79.8 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 106.827 -1.545 . . . . 34.979999999999997 106.827 -174.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 167' ' ' VAL . . . . . . . . . . . . . 85.8 t -72.17 -37.57 59.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 113.862 1.06 . . . . 30.149999999999999 113.862 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 168' ' ' ALA . . . . . . . . . . . . . . . -57.35 -48.41 79.08 Favored 'General case' 0 C--O 1.251 1.146 0 N-CA-C 106.864 -1.532 . . . . 32.640000000000001 106.864 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 169' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -73.29 -37.49 66.21 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 114.355 -1.293 . . . . 59.289999999999999 111.939 -173.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 170' ' ' ALA . . . . . . . . . . . . . . . -53.22 -43.53 67.34 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 124.121 0.888 . . . . 38.57 108.882 167.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 171' ' ' ARG . . . . . . . . . . . . . 40.8 mtt85 -69.37 -37.12 77.44 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 116.883 -1.927 . . . . 39.759999999999998 113.117 -177.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 172' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -67.8 -49.46 62.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 118.667 -1.213 . . . . 47.969999999999999 109.747 -179.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 173' ' ' ALA . . . . . . . . . . . . . . . -38.88 -58.1 1.14 Allowed 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 125.327 1.642 . . . . 44.369999999999997 110.314 169.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 174' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.07 -19.58 64.08 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.826 1.417 . . . . 47.170000000000002 114.826 -174.99 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 175' ' ' LEU . . . . . . . . . . . . . 16.8 mt -108.71 31.85 5.32 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 121.982 -0.449 . . . . 50.82 110.356 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 176' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 114.156 1.169 . . . . 51.990000000000002 114.156 -173.251 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' SO4 . . . . . 0.806 ' O3 ' ' OE1' ' B' ' 135' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' SO4 . . . . . 1.142 ' O2 ' ' O ' ' B' ' 132' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' MET . . . . . 0.878 ' HG3' ' H ' ' A' ' 117' ' ' GLY . 0.2 OUTLIER . . . . . 0 N--CA 1.503 2.197 0 N-CA-C 114.914 1.45 . . . . 75.25 114.914 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . 0.878 ' H ' ' HG3' ' A' ' 116' ' ' MET . . . -98.96 -13.05 41.11 Favored Glycine 0 N--CA 1.473 1.126 0 C-N-CA 125.281 1.419 . . . . 71.0 111.556 170.093 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' PHE . . . . . 0.748 ' HZ ' HG22 ' C' ' 126' ' ' THR . 87.5 m-85 -77.42 -23.43 50.58 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 121.032 0.444 . . . . 69.109999999999999 112.004 168.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . 0.45 ' HG3' ' N ' ' A' ' 116' ' ' MET . 6.5 mt-10 -58.78 -29.24 66.66 Favored 'General case' 0 C--O 1.251 1.155 0 C-N-CA 118.764 -1.174 . . . . 76.030000000000001 110.809 -178.859 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 120' ' ' ASP . 0.7 OUTLIER -82.37 -54.0 5.57 Favored 'General case' 0 CA--C 1.498 -1.049 0 O-C-N 123.892 0.745 . . . . 77.829999999999998 110.432 -179.853 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LEU . . . . . 1.454 ' O ' ' CG2' ' A' ' 125' ' ' THR . 51.8 mt -49.88 -28.49 6.63 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 124.049 0.843 . . . . 68.959999999999994 111.842 -174.257 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . 0.694 ' HA ' HG23 ' A' ' 125' ' ' THR . 13.2 m -86.43 -40.44 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.431 -0.804 . . . . 66.629999999999995 109.449 179.099 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.24 -37.26 79.85 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 105.671 -1.974 . . . . 73.260000000000005 105.671 177.801 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' VAL . . . . . 0.904 HG12 ' N ' ' A' ' 125' ' ' THR 0.269 0.9 OUTLIER -78.17 -52.89 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.563 0 CA-C-O 122.497 1.142 . . . . 63.490000000000002 109.845 -175.448 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 125' ' ' THR . . . . . 1.454 ' CG2' ' O ' ' A' ' 121' ' ' LEU . 0.2 OUTLIER -74.24 -14.41 60.92 Favored 'General case' 0 N--CA 1.416 -2.143 0 N-CA-C 106.058 -1.83 . . . . 60.899999999999999 106.058 -168.407 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -25.56 46.75 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-N 114.729 -1.123 . . . . 59.609999999999999 109.283 173.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.29 -50.88 10.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 58.719999999999999 111.241 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ILE . . . . . 0.872 HG22 HD21 ' A' ' 174' ' ' LEU . 3.7 pt -58.85 -2.74 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 55.18 111.174 175.917 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -92.45 -22.35 19.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 54.450000000000003 111.185 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -83.71 -10.0 58.45 Favored 'General case' 0 N--CA 1.411 -2.425 0 CA-C-O 118.162 -0.923 . . . . 57.039999999999999 109.405 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LEU . . . . . 0.893 HD21 HD13 ' A' ' 174' ' ' LEU 0.419 85.6 mt -79.39 -160.63 0.26 Allowed 'General case' 0 C--O 1.184 -2.393 0 N-CA-C 101.942 -3.355 . . . . 53.380000000000003 101.942 -158.741 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 132' ' ' THR . . . . . 1.129 HG22 ' N ' ' A' ' 133' ' ' THR 0.293 0.9 OUTLIER -90.76 -161.62 0.82 Allowed 'General case' 0 CA--C 1.448 -2.964 1 N-CA-C 83.688 -10.116 . . . . 50.82 83.688 -159.808 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 133' ' ' THR . . . . . 1.129 ' N ' HG22 ' A' ' 132' ' ' THR . 0.3 OUTLIER -93.33 -33.11 14.03 Favored 'General case' 0 CA--C 1.475 -1.933 0 C-N-CA 114.452 -2.899 . . . . 50.409999999999997 110.405 159.008 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ASP . . . . . 0.942 ' H ' HG22 ' A' ' 132' ' ' THR . 6.6 m-20 -65.17 -26.88 68.35 Favored 'General case' 0 C--O 1.197 -1.702 0 CA-C-N 114.773 -1.103 . . . . 55.479999999999997 108.753 -176.287 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLN . . . . . 0.403 ' HB2' ' H ' ' A' ' 132' ' ' THR . 83.5 mt-30 -77.06 -47.61 20.1 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 109.05 -0.722 . . . . 49.479999999999997 109.05 171.324 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 9.7 ttm105 -51.18 -50.56 58.78 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.782 -0.767 . . . . 53.32 112.3 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -53.41 -55.81 21.97 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.545 -0.909 . . . . 46.170000000000002 108.545 179.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -57.23 -56.6 19.66 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 108.583 -0.895 . . . . 40.68 108.583 -169.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 6.2 tp -52.14 -44.62 64.63 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 114.435 -1.257 . . . . 37.409999999999997 110.863 177.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 6.9 mt -65.51 -47.57 75.5 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 118.233 -1.387 . . . . 36.509999999999998 112.32 -174.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 91.0 mt -59.56 -48.51 81.37 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 121.457 0.646 . . . . 33.520000000000003 111.036 -178.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' THR . . . . . 0.636 ' O ' ' HA2' ' A' ' 146' ' ' GLY . 77.7 p -73.8 -35.13 64.86 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-O 118.1 -0.953 . . . . 32.840000000000003 111.216 -176.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -98.33 -42.9 7.16 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 117.569 2.433 . . . . 34.759999999999998 117.569 -176.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 30.8 tp -75.07 -58.86 3.02 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 108.943 -0.762 . . . . 35.740000000000002 108.943 172.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' LEU . . . . . 0.645 HD11 HD22 ' B' ' 174' ' ' LEU . 5.8 mp -70.77 -14.01 62.27 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 118.28 -1.368 . . . . 34.509999999999998 114.006 176.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' GLY . . . . . 0.636 ' HA2' ' O ' ' A' ' 142' ' ' THR . . . 55.58 34.27 60.11 Favored Glycine 0 N--CA 1.432 -1.584 0 N-CA-C 111.556 -0.617 . . . . 32.75 111.556 -176.149 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 78.8 mt -72.01 152.44 42.44 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 117.761 0.781 . . . . 31.030000000000001 112.216 174.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 78.0 p -66.81 167.64 11.03 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.369 -1.715 . . . . 30.02 106.369 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -61.6 -39.69 92.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 120.198 -0.601 . . . . 31.539999999999999 112.283 169.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.12 -44.06 96.69 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 108.596 -0.89 . . . . 33.219999999999999 108.596 -176.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -66.82 -50.24 63.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.325 -0.852 . . . . 33.509999999999998 110.086 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -53.85 -55.13 29.45 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.95 0.781 . . . . 35.590000000000003 110.771 174.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ALA . . . . . 0.579 ' HB1' ' O ' ' A' ' 158' ' ' CYS . . . -51.85 -49.88 62.0 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 107.148 -1.427 . . . . 37.950000000000003 107.148 177.475 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -50.0 -65.13 0.61 Allowed 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 109.269 -0.641 . . . . 41.060000000000002 109.269 -177.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 25.4 t -40.4 -44.9 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 125.495 1.518 . . . . 43.119999999999997 113.427 178.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' CYS . . . . . . . . . . . . . 63.0 m -82.45 -16.59 48.33 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 115.156 1.539 . . . . 48.719999999999999 115.156 -174.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 68.05 49.86 44.36 Favored Glycine 0 C--O 1.213 -1.197 0 O-C-N 124.093 0.871 . . . . 49.109999999999999 113.966 -169.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' CYS . . . . . 0.579 ' O ' ' HB1' ' A' ' 153' ' ' ALA . 24.2 p -142.77 166.26 21.74 Favored Pre-proline 0 C--O 1.244 0.805 0 CA-C-N 118.448 1.124 . . . . 52.340000000000003 111.65 169.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 159' ' ' PRO . . . . . 0.426 ' HD2' ' HB2' ' A' ' 158' ' ' CYS . 30.1 Cg_endo -64.82 153.95 75.29 Favored 'Trans proline' 0 C--N 1.36 1.179 0 C-N-CA 120.822 1.015 . . . . 50.119999999999997 111.644 171.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -56.37 -33.98 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 113.863 1.06 . . . . 49.469999999999999 113.863 178.144 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 161' ' ' GLY . . . . . . . . . . . . . . . -58.49 -41.79 95.56 Favored Glycine 0 C--O 1.246 0.855 0 N-CA-C 109.115 -1.594 . . . . 48.549999999999997 109.115 -174.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 59.2 m -63.09 -53.07 59.39 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.803 -0.698 . . . . 48.560000000000002 111.159 -178.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' ILE . . . . . 0.628 ' O ' HG13 ' A' ' 167' ' ' VAL . 3.1 mm -52.62 -54.96 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 119.167 -0.444 . . . . 47.009999999999998 110.311 172.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.52 -50.38 2.94 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 123.606 0.566 . . . . 61.109999999999999 111.161 176.411 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 24.5 p -75.22 -44.15 47.84 Favored 'General case' 0 C--O 1.206 -1.228 0 N-CA-C 112.454 0.539 . . . . 45.350000000000001 112.454 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -48.72 -53.35 19.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.319 0.859 . . . . 43.0 113.319 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' VAL . . . . . 0.628 HG13 ' O ' ' A' ' 163' ' ' ILE . 0.6 OUTLIER -61.79 -34.36 62.08 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.237 0 N-CA-C 113.642 0.978 . . . . 41.549999999999997 113.642 171.882 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 168' ' ' ALA . . . . . . . . . . . . . . . -60.24 -49.35 77.96 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.568 -1.333 . . . . 44.759999999999998 113.706 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -62.07 -39.87 93.89 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.35 -0.982 . . . . 63.960000000000001 108.35 175.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ALA . . . . . 0.402 ' HB3' ' HA ' ' A' ' 167' ' ' VAL . . . -59.36 -44.71 92.67 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 115.02 -0.991 . . . . 45.729999999999997 110.323 -176.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -65.32 -46.96 78.21 Favored 'General case' 0 CA--C 1.495 -1.138 0 CA-C-N 114.559 -1.2 . . . . 45.549999999999997 111.472 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -53.23 -49.0 67.7 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 124.273 0.983 . . . . 52.060000000000002 113.157 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -59.33 -44.14 92.64 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.407 1.083 . . . . 45.5 111.556 -175.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' LEU . . . . . 0.893 HD13 HD21 ' A' ' 131' ' ' LEU . 4.7 mp -78.35 -12.47 60.01 Favored 'General case' 0 CA--C 1.493 -1.223 0 CA-C-N 114.906 -1.043 . . . . 46.549999999999997 109.346 -175.699 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 80.3 mt -98.36 -19.36 17.8 Favored 'General case' 0 CA--C 1.506 -0.745 0 C-N-CA 118.711 -1.196 . . . . 48.840000000000003 112.427 176.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.334 0 C-N-CA 125.506 1.522 . . . . 49.490000000000002 113.743 -178.683 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' MET . . . . . 0.812 ' N ' ' H ' ' B' ' 119' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.209 -1.056 0 N-CA-C 107.928 -1.138 . . . . 71.799999999999997 107.928 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 117' ' ' GLY . . . . . 1.192 ' O ' ' CD1' ' B' ' 121' ' ' LEU . . . -61.12 -38.83 96.23 Favored Glycine 0 C--O 1.202 -1.856 0 N-CA-C 117.581 1.792 . . . . 67.530000000000001 117.581 107.68 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' PHE . . . . . 0.805 ' N ' ' N ' ' B' ' 116' ' ' MET . 60.7 t80 -46.26 -42.81 14.96 Favored 'General case' 0 C--O 1.198 -1.657 0 N-CA-C 111.872 0.323 . . . . 65.549999999999997 111.872 172.12 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLU . . . . . 0.847 ' O ' ' HB2' ' B' ' 123' ' ' GLU . 43.6 mt-10 -59.4 -36.82 76.56 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 114.083 1.142 . . . . 69.260000000000005 114.083 177.743 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ASP . . . . . 0.929 ' O ' ' HB3' ' B' ' 123' ' ' GLU . 75.0 m-20 -71.3 -60.94 1.96 Allowed 'General case' 0 CA--C 1.481 -1.701 0 CA-C-O 121.717 0.77 . . . . 65.680000000000007 109.716 -172.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 121' ' ' LEU . . . . . 1.248 ' O ' HG23 ' B' ' 125' ' ' THR . 3.2 mp -44.58 -43.71 8.29 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 114.956 1.465 . . . . 61.539999999999999 114.956 -177.728 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 122' ' ' VAL . . . . . 0.798 ' O ' HG23 ' B' ' 126' ' ' THR 0.467 0.8 OUTLIER -67.99 -43.09 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.845 0 N-CA-C 118.739 2.866 . . . . 61.18 118.739 163.138 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 123' ' ' GLU . . . . . 0.929 ' HB3' ' O ' ' B' ' 120' ' ' ASP 0.407 0.0 OUTLIER -40.28 -53.53 2.52 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-N 115.593 -0.731 . . . . 65.469999999999999 110.83 160.185 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 124' ' ' VAL . . . . . 0.937 HG12 ' N ' ' B' ' 125' ' ' THR . 1.8 t -65.6 -68.62 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.263 0 C-N-CA 118.873 -1.131 . . . . 56.899999999999999 110.253 -178.958 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 125' ' ' THR . . . . . 1.248 HG23 ' O ' ' B' ' 121' ' ' LEU . 0.9 OUTLIER -57.39 -19.05 20.76 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 115.365 -0.834 . . . . 55.829999999999998 110.201 -157.682 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 126' ' ' THR . . . . . 0.798 HG23 ' O ' ' B' ' 122' ' ' VAL . 7.5 p -67.29 -48.05 68.8 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 112.262 0.468 . . . . 53.560000000000002 112.262 167.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 127' ' ' MET . . . . . 0.665 ' C ' ' HB2' ' B' ' 130' ' ' ASP . 14.6 mtp -50.1 -16.68 0.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.321 0.388 . . . . 57.450000000000003 111.185 177.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ILE . . . . . 1.028 HD11 ' CD2' ' B' ' 174' ' ' LEU . 22.2 mm -114.99 -59.99 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 54.799999999999997 111.172 -152.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ALA . . . . . 0.497 ' H ' HD21 ' C' ' 121' ' ' LEU . . . -14.63 -37.14 0.0 OUTLIER 'General case' 0 C--N 1.345 0.405 0 CA-C-O 121.998 0.904 . . . . 55.82 112.481 133.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 130' ' ' ASP . . . . . 0.665 ' HB2' ' C ' ' B' ' 127' ' ' MET . 0.6 OUTLIER -81.77 -26.55 34.36 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 115.804 -0.634 . . . . 62.630000000000003 111.171 -165.618 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 131' ' ' LEU . . . . . 0.462 HD21 ' CD1' ' B' ' 174' ' ' LEU . 28.2 mt -52.08 -63.57 1.09 Allowed 'General case' 0 C--O 1.19 -2.074 1 N-CA-C 145.535 12.791 . . . . 53.789999999999999 145.535 -156.667 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 132' ' ' THR . . . . . 1.142 ' O ' ' O2 ' ' B' ' 109' ' ' SO4 0.259 42.4 p -127.87 -72.14 0.63 Allowed 'General case' 0 CA--C 1.44 -3.254 1 N-CA-C 122.935 4.421 . . . . 50.229999999999997 122.935 125.722 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 133' ' ' THR . . . . . 0.86 HG23 ' O3 ' ' B' ' 109' ' ' SO4 . 0.1 OUTLIER -132.07 -39.68 1.06 Allowed 'General case' 0 C--O 1.21 -0.975 1 C-N-CA 155.344 13.458 . . . . 52.149999999999999 116.197 110.936 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 134' ' ' ASP . . . . . 0.649 ' N ' ' OG1' ' B' ' 132' ' ' THR . 46.0 m-20 -74.31 -31.77 62.6 Favored 'General case' 0 C--O 1.191 -1.996 0 CA-C-N 113.961 -1.472 . . . . 53.210000000000001 113.86 -170.133 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' GLN . . . . . 0.872 ' CD ' HG23 ' B' ' 132' ' ' THR . 0.0 OUTLIER -65.18 -52.7 53.32 Favored 'General case' 0 C--O 1.185 -2.331 0 N-CA-C 113.348 0.869 . . . . 55.520000000000003 113.348 163.499 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ARG . . . . . 0.606 ' NH1' ' OD2' ' C' ' 120' ' ' ASP . 4.9 ttm105 -50.2 -43.34 52.55 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 122.052 -0.405 . . . . 46.280000000000001 110.1 -179.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 137' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -62.0 -55.21 31.61 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 124.397 1.061 . . . . 51.359999999999999 111.479 -179.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.31 -46.39 69.37 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 123.678 0.611 . . . . 41.340000000000003 112.383 175.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 20.5 tp -63.57 -47.71 80.41 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.239 -0.584 . . . . 38.640000000000001 110.853 -175.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 59.6 mt -70.4 -42.12 72.1 Favored 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 108.365 -0.976 . . . . 40.189999999999998 108.365 -176.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' B' ' 147' ' ' LEU . 7.9 mt -54.98 -26.01 33.79 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.677 0.611 . . . . 37.189999999999998 112.405 176.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 142' ' ' THR . . . . . 0.549 ' O ' ' HA2' ' B' ' 146' ' ' GLY . 70.8 p -110.23 -22.89 11.53 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 116.302 1.964 . . . . 34.950000000000003 116.302 -176.336 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 143' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -108.19 -41.55 4.87 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 123.671 0.788 . . . . 37.100000000000001 110.67 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 60.1 tp -81.35 -40.81 22.98 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 119.78 -0.768 . . . . 37.030000000000001 109.222 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' LEU . . . . . 0.708 HD11 HD23 ' C' ' 174' ' ' LEU . 1.3 mp -86.53 -26.77 24.38 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 118.425 -1.31 . . . . 34.299999999999997 113.4 174.582 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 146' ' ' GLY . . . . . 0.549 ' HA2' ' O ' ' B' ' 142' ' ' THR . . . 66.88 22.0 71.77 Favored Glycine 0 C--O 1.217 -0.924 0 N-CA-C 111.611 -0.596 . . . . 35.200000000000003 111.611 -179.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 147' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' B' ' 141' ' ' LEU . 14.3 mt -62.08 139.16 58.46 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.215 1.006 . . . . 38.659999999999997 111.025 168.524 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 88.3 p -55.05 153.27 6.68 Favored 'General case' 0 C--O 1.238 0.494 0 O-C-N 123.722 0.639 . . . . 35.119999999999997 109.926 169.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' TYR . . . . . 0.424 ' HB3' HG12 ' B' ' 160' ' ' VAL . 68.5 m-85 -46.49 -57.51 4.64 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 118.654 -1.218 . . . . 44.380000000000003 113.848 169.557 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -42.24 -55.85 3.15 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 113.622 0.971 . . . . 37.07 113.622 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -57.54 -46.15 84.23 Favored 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 112.788 0.662 . . . . 45.409999999999997 112.788 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -58.63 -46.7 86.52 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.408 0.623 . . . . 37.119999999999997 111.021 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' ALA . . . . . 0.481 ' HB1' ' O ' ' B' ' 158' ' ' CYS . . . -58.15 -46.1 86.26 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.575 -1.268 . . . . 38.859999999999999 107.575 -178.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -54.85 -45.55 74.56 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.946 0.879 . . . . 39.710000000000001 111.159 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 47.0 t -61.23 -45.11 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 CA-C-N 115.171 -0.922 . . . . 40.990000000000002 108.968 -177.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' CYS . . . . . . . . . . . . . 45.0 m -89.46 5.85 43.47 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 114.527 1.306 . . . . 44.810000000000002 114.527 -177.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . 45.86 50.96 11.14 Favored Glycine 0 C--O 1.214 -1.146 0 CA-C-O 119.468 -0.629 . . . . 41.009999999999998 113.802 -177.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' CYS . . . . . 0.481 ' O ' ' HB1' ' B' ' 153' ' ' ALA . 14.6 p -142.67 159.22 57.99 Favored Pre-proline 0 CA--C 1.557 1.214 0 N-CA-C 107.865 -1.161 . . . . 43.130000000000003 107.865 171.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 159' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.41 150.72 79.25 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 121.808 1.672 . . . . 36.119999999999997 115.25 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' VAL . . . . . 0.424 HG12 ' HB3' ' B' ' 149' ' ' TYR . 0.0 OUTLIER -44.45 -60.07 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 N-CA-C 113.595 0.961 . . . . 34.740000000000002 113.595 173.257 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -37.98 -37.74 0.46 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 111.673 -0.571 . . . . 35.609999999999999 111.673 -177.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' THR . . . . . . . . . . . . . 12.6 m -65.61 -62.22 1.64 Allowed 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.817 0.673 . . . . 39.140000000000001 112.817 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 163' ' ' ILE . . . . . 0.721 ' O ' HG12 ' B' ' 167' ' ' VAL . 28.3 mm -44.66 -42.52 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-O 120.89 0.376 . . . . 42.270000000000003 111.961 169.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 21.5 ttm105 -63.62 -42.69 98.16 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 120.292 -0.563 . . . . 63.829999999999998 110.096 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.7 p -82.38 -27.99 31.76 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 118.932 -1.107 . . . . 39.670000000000002 111.237 -173.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 166' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -61.59 -55.18 33.57 Favored 'General case' 0 CA--C 1.519 -0.246 0 O-C-N 123.437 0.46 . . . . 49.390000000000001 110.748 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 167' ' ' VAL . . . . . 0.721 HG12 ' O ' ' B' ' 163' ' ' ILE . 1.4 p -54.74 -34.56 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 112.927 0.714 . . . . 38.479999999999997 112.927 169.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 168' ' ' ALA . . . . . . . . . . . . . . . -60.19 -44.79 94.82 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 107.217 -1.401 . . . . 41.200000000000003 107.217 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 169' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -69.59 -41.32 75.94 Favored 'General case' 0 C--O 1.213 -0.841 0 O-C-N 124.121 0.888 . . . . 57.840000000000003 111.703 -179.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -49.93 -36.31 27.21 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 113.072 0.767 . . . . 43.049999999999997 113.072 170.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -74.22 -27.42 60.78 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.472 -0.768 . . . . 46.25 110.988 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 172' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -76.57 -38.59 54.67 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 113.694 0.998 . . . . 55.109999999999999 113.694 -177.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 173' ' ' ALA . . . . . . . . . . . . . . . -70.25 -34.99 73.5 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 107.369 -1.345 . . . . 48.869999999999997 107.369 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 174' ' ' LEU . . . . . 1.028 ' CD2' HD11 ' B' ' 128' ' ' ILE . 3.5 mp -74.21 -21.3 59.86 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 114.449 1.277 . . . . 51.619999999999997 114.449 -179.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 175' ' ' LEU . . . . . . . . . . . . . 66.5 mt -109.91 -3.96 16.26 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 115.691 1.737 . . . . 50.909999999999997 115.691 -169.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 113.179 0.807 . . . . 52.270000000000003 113.179 -172.018 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 116' ' ' MET . . . . . 0.651 ' SD ' ' HA3' ' C' ' 117' ' ' GLY 0.375 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.975 0 N-CA-C 118.135 2.643 . . . . 74.510000000000005 118.135 . . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 117' ' ' GLY . . . . . 0.651 ' HA3' ' SD ' ' C' ' 116' ' ' MET . . . 81.62 -124.45 6.46 Favored Glycine 0 C--N 1.349 1.272 0 CA-C-N 123.509 2.868 . . . . 65.099999999999994 108.887 11.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 118' ' ' PHE . . . . . 1.397 ' O ' ' CG2' ' C' ' 122' ' ' VAL . 62.7 m-85 -57.95 -22.52 49.38 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 112.84 0.682 . . . . 62.490000000000002 112.84 177.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 119' ' ' GLU . . . . . 0.687 ' C ' HG23 ' C' ' 122' ' ' VAL . 12.8 tt0 -52.94 -41.28 64.35 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 117.788 -1.565 . . . . 69.040000000000006 109.401 178.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 120' ' ' ASP . . . . . 0.656 ' O ' ' C ' ' C' ' 121' ' ' LEU . 18.9 m-20 -64.78 -69.28 0.3 Allowed 'General case' 0 CA--C 1.488 -1.427 0 CA-C-O 121.583 0.706 . . . . 64.200000000000003 111.912 -179.219 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 121' ' ' LEU . . . . . 1.059 ' H ' HD12 ' C' ' 121' ' ' LEU . 1.7 mp -51.37 -30.36 18.64 Favored 'General case' 0 CA--C 1.472 -2.055 1 N-CA-C 100.064 -4.05 . . . . 60.759999999999998 100.064 -161.148 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 122' ' ' VAL . . . . . 1.397 ' CG2' ' O ' ' C' ' 118' ' ' PHE . 1.4 t -50.76 -68.98 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.416 -2.17 0 N-CA-C 102.766 -3.05 . . . . 59.950000000000003 102.766 -176.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 123' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' C' ' 120' ' ' ASP . 1.5 pt-20 -64.17 -34.98 79.32 Favored 'General case' 0 C--O 1.201 -1.465 0 N-CA-C 113.98 1.104 . . . . 65.640000000000001 113.98 -162.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 124' ' ' VAL . . . . . 0.473 ' O ' HG12 ' C' ' 128' ' ' ILE . 98.0 t -52.89 -51.29 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 CA-C-N 115.587 -0.733 . . . . 57.299999999999997 110.435 165.878 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 125' ' ' THR . . . . . 0.409 ' N ' ' O ' ' C' ' 122' ' ' VAL . 24.0 m -57.71 -24.67 58.05 Favored 'General case' 0 C--O 1.199 -1.578 0 C-N-CA 119.693 -0.803 . . . . 54.600000000000001 108.946 -169.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 126' ' ' THR . . . . . 0.748 HG22 ' HZ ' ' A' ' 118' ' ' PHE . 43.5 p -87.36 -33.29 19.21 Favored 'General case' 0 C--O 1.252 1.229 0 N-CA-C 115.31 1.596 . . . . 51.780000000000001 115.31 -175.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 127' ' ' MET . . . . . 0.479 ' HB3' HD12 ' C' ' 174' ' ' LEU . 3.5 mtt -45.34 -53.75 8.11 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 103.239 -2.875 . . . . 50.520000000000003 103.239 169.592 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 128' ' ' ILE . . . . . 0.585 ' CD1' HD21 ' C' ' 174' ' ' LEU . 49.3 mm -53.43 -59.21 1.97 Allowed 'Isoleucine or valine' 2 C--O 1.021 -10.949 2 CA-C-O 146.253 12.454 . . . . 49.289999999999999 111.251 -166.882 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 129' ' ' ALA . . . . . 0.544 ' C ' ' O ' ' C' ' 128' ' ' ILE . . . -62.48 -23.74 67.08 Favored 'General case' 1 C--N 0.94 -17.226 2 CA-C-N 87.393 -13.549 . . . . 50.469999999999999 113.33 177.056 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 130' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' C' ' 127' ' ' MET . 68.5 m-20 -74.06 -18.96 60.76 Favored 'General case' 0 CA--C 1.522 -0.109 0 N-CA-C 112.282 0.475 . . . . 56.600000000000001 112.282 170.759 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 131' ' ' LEU . . . . . 0.558 HD21 HD13 ' C' ' 174' ' ' LEU . 24.5 mt -57.05 161.4 3.08 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.792 -0.818 . . . . 48.170000000000002 108.792 176.097 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 132' ' ' THR . . . . . 0.563 ' OG1' ' HG2' ' C' ' 135' ' ' GLN . 4.6 p -68.4 161.84 26.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.938 -1.134 . . . . 47.149999999999999 107.938 173.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 133' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.14 -46.2 72.18 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 118.812 -1.155 . . . . 45.850000000000001 108.377 -177.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 134' ' ' ASP . . . . . 0.504 ' HB3' ' HD2' ' C' ' 166' ' ' ARG . 72.5 m-20 -61.74 -53.02 61.64 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 117.147 2.277 . . . . 48.990000000000002 117.147 -177.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 135' ' ' GLN . . . . . 0.563 ' HG2' ' OG1' ' C' ' 132' ' ' THR . 0.0 OUTLIER -56.63 -45.26 81.64 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 118.247 -1.381 . . . . 45.030000000000001 114.177 175.014 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 136' ' ' ARG . . . . . 0.417 ' O ' ' HG ' ' C' ' 140' ' ' LEU . 23.1 ttm105 -59.87 -39.98 87.13 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.327 0.512 . . . . 47.710000000000001 111.524 176.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 137' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -62.44 -51.99 65.32 Favored 'General case' 0 C--O 1.246 0.877 0 C-N-CA 119.9 -0.72 . . . . 41.880000000000003 110.533 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.16 -45.87 75.7 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 114.831 -1.077 . . . . 36.200000000000003 111.006 -178.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 139' ' ' LEU . . . . . . . . . . . . . 2.0 tp -70.58 -32.77 70.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 123.763 0.664 . . . . 33.780000000000001 111.579 -177.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 140' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' C' ' 136' ' ' ARG . 13.0 mt -74.84 -40.02 61.26 Favored 'General case' 0 CA--C 1.479 -1.782 0 N-CA-C 108.406 -0.961 . . . . 36.039999999999999 108.406 -177.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 141' ' ' LEU . . . . . . . . . . . . . 38.8 mt -62.2 -49.6 75.13 Favored 'General case' 0 C--O 1.245 0.835 0 O-C-N 124.309 1.006 . . . . 34.100000000000001 110.444 -178.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 142' ' ' THR . . . . . 0.8 ' O ' ' HA2' ' C' ' 146' ' ' GLY . 75.9 p -77.67 -20.45 53.68 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.468 1.285 . . . . 35.329999999999998 114.468 -178.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 143' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -114.42 -40.21 3.68 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 115.314 1.598 . . . . 36.75 115.314 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 16.1 tp -78.39 -45.66 21.87 Favored 'General case' 0 C--O 1.205 -1.243 0 C-N-CA 117.933 -1.507 . . . . 34.700000000000003 108.039 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 145' ' ' LEU . . . . . . . . . . . . . 9.8 mp -85.53 -32.04 22.4 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 104.82 -2.289 . . . . 37.640000000000001 104.82 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 146' ' ' GLY . . . . . 0.8 ' HA2' ' O ' ' C' ' 142' ' ' THR . . . 66.39 44.95 89.31 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 120.04 -1.076 . . . . 33.43 114.881 -174.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 147' ' ' LEU . . . . . . . . . . . . . 10.4 mt -75.42 153.89 37.41 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 121.86 -0.788 . . . . 32.229999999999997 110.115 171.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 148' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.46 160.74 5.06 Favored 'General case' 0 CA--C 1.488 -1.425 0 N-CA-C 107.281 -1.377 . . . . 33.590000000000003 107.281 168.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 149' ' ' TYR . . . . . 0.433 ' H ' ' HD1' ' C' ' 149' ' ' TYR . 1.9 m-85 -58.13 -36.95 73.69 Favored 'General case' 0 C--O 1.215 -0.719 0 N-CA-C 107.83 -1.174 . . . . 41.890000000000001 107.83 171.559 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.03 -50.61 70.43 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 122.389 0.276 . . . . 33.859999999999999 110.969 177.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 151' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -70.14 -40.54 74.75 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 120.974 -0.29 . . . . 35.200000000000003 110.732 -176.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -54.14 -50.03 67.87 Favored 'General case' 0 C--O 1.216 -0.68 0 O-C-N 123.442 0.464 . . . . 32.649999999999999 110.15 172.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 153' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' C' ' 158' ' ' CYS . . . -62.34 -34.4 76.57 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 113.009 0.744 . . . . 33.299999999999997 113.009 -178.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 154' ' ' ALA . . . . . . . . . . . . . . . -64.54 -52.07 59.59 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 121.657 -0.652 . . . . 36.840000000000003 110.296 174.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 155' ' ' VAL . . . . . . . . . . . . . 25.1 t -47.28 -55.5 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-O 119.75 -0.167 . . . . 39.350000000000001 110.904 174.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 156' ' ' CYS . . . . . . . . . . . . . 63.2 m -79.58 -13.49 59.49 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 115.112 1.523 . . . . 40.280000000000001 115.112 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 157' ' ' GLY . . . . . . . . . . . . . . . 58.21 54.62 36.12 Favored Glycine 0 CA--C 1.534 1.219 0 N-CA-C 116.48 1.352 . . . . 40.740000000000002 116.48 -171.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 158' ' ' CYS . . . . . 0.486 ' O ' ' HB1' ' C' ' 153' ' ' ALA . 25.0 p -142.48 167.75 15.44 Favored Pre-proline 0 C--O 1.239 0.551 0 O-C-N 122.244 -0.562 . . . . 41.939999999999998 110.303 173.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 159' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -58.94 148.5 84.42 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 122.965 0.981 . . . . 38.719999999999999 112.896 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 160' ' ' VAL . . . . . . . . . . . . . 55.3 t -53.88 -44.6 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.441 0 O-C-N 124.02 0.825 . . . . 37.68 108.91 178.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 161' ' ' GLY . . . . . . . . . . . . . . . -47.53 -40.31 16.49 Favored Glycine 0 C--N 1.336 0.582 0 CA-C-N 114.717 -1.129 . . . . 36.25 111.162 177.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 162' ' ' THR . . . . . . . . . . . . . 1.8 m -56.88 -54.5 45.84 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 119.319 -0.372 . . . . 37.390000000000001 110.951 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 163' ' ' ILE . . . . . . . . . . . . . 1.7 mm -60.68 -46.66 95.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 C-N-CA 120.413 -0.515 . . . . 36.780000000000001 111.572 177.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 164' ' ' ARG . . . . . 0.416 ' HA ' ' CE2' ' C' ' 149' ' ' TYR . 0.0 OUTLIER -47.47 -41.49 20.71 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 108.651 -0.87 . . . . 63.420000000000002 108.651 179.381 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 165' ' ' SER . . . . . . . . . . . . . 13.4 t -72.06 -48.49 43.88 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 113.542 0.941 . . . . 36.009999999999998 113.542 -176.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 166' ' ' ARG . . . . . 0.504 ' HD2' ' HB3' ' C' ' 134' ' ' ASP . 7.6 mmt85 -60.51 -37.03 79.8 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 106.827 -1.545 . . . . 34.979999999999997 106.827 -174.401 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 167' ' ' VAL . . . . . 0.629 ' O ' ' HG3' ' C' ' 171' ' ' ARG . 85.8 t -72.17 -37.57 59.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 113.862 1.06 . . . . 30.149999999999999 113.862 178.539 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 168' ' ' ALA . . . . . . . . . . . . . . . -57.35 -48.41 79.08 Favored 'General case' 0 C--O 1.251 1.146 0 N-CA-C 106.864 -1.532 . . . . 32.640000000000001 106.864 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 169' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -73.29 -37.49 66.21 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 114.355 -1.293 . . . . 59.289999999999999 111.939 -173.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 170' ' ' ALA . . . . . . . . . . . . . . . -53.22 -43.53 67.34 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 124.121 0.888 . . . . 38.57 108.882 167.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 171' ' ' ARG . . . . . 0.629 ' HG3' ' O ' ' C' ' 167' ' ' VAL . 40.8 mtt85 -69.37 -37.12 77.44 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 116.883 -1.927 . . . . 39.759999999999998 113.117 -177.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 172' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -67.8 -49.46 62.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 118.667 -1.213 . . . . 47.969999999999999 109.747 -179.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 173' ' ' ALA . . . . . . . . . . . . . . . -38.88 -58.1 1.14 Allowed 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 125.327 1.642 . . . . 44.369999999999997 110.314 169.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 174' ' ' LEU . . . . . 0.708 HD23 HD11 ' B' ' 145' ' ' LEU . 0.2 OUTLIER -69.07 -19.58 64.08 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.826 1.417 . . . . 47.170000000000002 114.826 -174.99 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 175' ' ' LEU . . . . . . . . . . . . . 16.8 mt -108.71 31.85 5.32 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 121.982 -0.449 . . . . 50.82 110.356 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 176' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 114.156 1.169 . . . . 51.990000000000002 114.156 -173.251 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SO4 . . . . . 0.682 ' O3 ' HG23 ' A' ' 133' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' SO4 . . . . . 0.819 ' O1 ' HG21 ' B' ' 132' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' SO4 . . . . . 1.142 ' O2 ' ' O ' ' B' ' 132' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 104' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 107' ' ' SO4 . . . . . 0.403 ' O2 ' ' HB2' ' C' ' 134' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' MET . . . . . 0.878 ' HG3' ' H ' ' A' ' 117' ' ' GLY . 0.2 OUTLIER . . . . . 0 N--CA 1.503 2.197 0 N-CA-C 114.914 1.45 . . . . 75.25 114.914 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.878 ' H ' ' HG3' ' A' ' 116' ' ' MET . . . -98.96 -13.05 41.11 Favored Glycine 0 N--CA 1.473 1.126 0 C-N-CA 125.281 1.419 . . . . 71.0 111.556 170.093 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.748 ' HZ ' HG22 ' C' ' 126' ' ' THR . 87.5 m-85 -77.42 -23.43 50.58 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 121.032 0.444 . . . . 69.11 112.004 168.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.45 ' HG3' ' N ' ' A' ' 116' ' ' MET . 6.5 mt-10 -58.78 -29.24 66.66 Favored 'General case' 0 C--O 1.251 1.155 0 C-N-CA 118.764 -1.174 . . . . 76.03 110.809 -178.859 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 120' ' ' ASP . 0.7 OUTLIER -82.37 -54.0 5.57 Favored 'General case' 0 CA--C 1.498 -1.049 0 O-C-N 123.892 0.745 . . . . 77.83 110.432 -179.853 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LEU . . . . . 1.454 ' O ' ' CG2' ' A' ' 125' ' ' THR . 51.8 mt -49.88 -28.49 6.63 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 124.049 0.843 . . . . 68.96 111.842 -174.257 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.694 ' HA ' HG23 ' A' ' 125' ' ' THR . 13.2 m -86.43 -40.44 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.431 -0.804 . . . . 66.63 109.449 179.099 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.24 -37.26 79.85 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 105.671 -1.974 . . . . 73.26 105.671 177.801 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.904 HG12 ' N ' ' A' ' 125' ' ' THR 0.269 0.9 OUTLIER -78.17 -52.89 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.563 0 CA-C-O 122.497 1.142 . . . . 63.49 109.845 -175.448 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' THR . . . . . 1.454 ' CG2' ' O ' ' A' ' 121' ' ' LEU . 0.2 OUTLIER -74.24 -14.41 60.92 Favored 'General case' 0 N--CA 1.416 -2.143 0 N-CA-C 106.058 -1.83 . . . . 60.9 106.058 -168.407 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -25.56 46.75 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-N 114.729 -1.123 . . . . 59.61 109.283 173.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.29 -50.88 10.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 58.72 111.241 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.872 HG22 HD21 ' A' ' 174' ' ' LEU . 3.7 pt -58.85 -2.74 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 55.18 111.174 175.917 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -92.45 -22.35 19.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 54.45 111.185 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -83.71 -10.0 58.45 Favored 'General case' 0 N--CA 1.411 -2.425 0 CA-C-O 118.162 -0.923 . . . . 57.04 109.405 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.893 HD21 HD13 ' A' ' 174' ' ' LEU 0.419 85.6 mt -79.39 -160.63 0.26 Allowed 'General case' 0 C--O 1.184 -2.393 0 N-CA-C 101.942 -3.355 . . . . 53.38 101.942 -158.741 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' THR . . . . . 1.129 HG22 ' N ' ' A' ' 133' ' ' THR 0.293 0.9 OUTLIER -90.76 -161.62 0.82 Allowed 'General case' 0 CA--C 1.448 -2.964 1 N-CA-C 83.688 -10.116 . . . . 50.82 83.688 -159.808 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' THR . . . . . 1.129 ' N ' HG22 ' A' ' 132' ' ' THR . 0.3 OUTLIER -93.33 -33.11 14.03 Favored 'General case' 0 CA--C 1.475 -1.933 0 C-N-CA 114.452 -2.899 . . . . 50.41 110.405 159.008 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.942 ' H ' HG22 ' A' ' 132' ' ' THR . 6.6 m-20 -65.17 -26.88 68.35 Favored 'General case' 0 C--O 1.197 -1.702 0 CA-C-N 114.773 -1.103 . . . . 55.48 108.753 -176.287 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.403 ' HB2' ' H ' ' A' ' 132' ' ' THR . 22.7 mt-30 -77.06 -47.61 20.1 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 109.05 -0.722 . . . . 49.48 109.05 171.324 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 9.7 ttm105 -51.18 -50.56 58.78 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.782 -0.767 . . . . 53.32 112.3 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -53.41 -55.81 21.97 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.545 -0.909 . . . . 46.17 108.545 179.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -57.23 -56.6 19.66 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 108.583 -0.895 . . . . 40.68 108.583 -169.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 6.2 tp -52.14 -44.62 64.63 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 114.435 -1.257 . . . . 37.41 110.863 177.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 6.9 mt -65.51 -47.57 75.5 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 118.233 -1.387 . . . . 36.51 112.32 -174.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 91.0 mt -59.56 -48.51 81.37 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 121.457 0.646 . . . . 33.52 111.036 -178.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' THR . . . . . 0.636 ' O ' ' HA2' ' A' ' 146' ' ' GLY . 77.7 p -73.8 -35.13 64.86 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-O 118.1 -0.953 . . . . 32.84 111.216 -176.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -98.33 -42.9 7.16 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 117.569 2.433 . . . . 34.76 117.569 -176.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 30.8 tp -75.07 -58.86 3.02 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 108.943 -0.762 . . . . 35.74 108.943 172.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.645 HD11 HD22 ' B' ' 174' ' ' LEU . 5.8 mp -70.77 -14.01 62.27 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 118.28 -1.368 . . . . 34.51 114.006 176.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.636 ' HA2' ' O ' ' A' ' 142' ' ' THR . . . 55.58 34.27 60.11 Favored Glycine 0 N--CA 1.432 -1.584 0 N-CA-C 111.556 -0.617 . . . . 32.75 111.556 -176.149 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 78.8 mt -72.01 152.44 42.44 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 117.761 0.781 . . . . 31.03 112.216 174.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 78.0 p -66.81 167.64 11.03 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.369 -1.715 . . . . 30.02 106.369 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -61.6 -39.69 92.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 120.198 -0.601 . . . . 31.54 112.283 169.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.12 -44.06 96.69 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 108.596 -0.89 . . . . 33.22 108.596 -176.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -66.82 -50.24 63.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.325 -0.852 . . . . 33.51 110.086 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -53.85 -55.13 29.45 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.95 0.781 . . . . 35.59 110.771 174.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ALA . . . . . 0.579 ' HB1' ' O ' ' A' ' 158' ' ' CYS . . . -51.85 -49.88 62.0 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 107.148 -1.427 . . . . 37.95 107.148 177.475 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -50.0 -65.13 0.61 Allowed 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 109.269 -0.641 . . . . 41.06 109.269 -177.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 25.4 t -40.4 -44.9 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 125.495 1.518 . . . . 43.12 113.427 178.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' CYS . . . . . . . . . . . . . 63.0 m -82.45 -16.59 48.33 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 115.156 1.539 . . . . 48.72 115.156 -174.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 68.05 49.86 44.36 Favored Glycine 0 C--O 1.213 -1.197 0 O-C-N 124.093 0.871 . . . . 49.11 113.966 -169.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' CYS . . . . . 0.579 ' O ' ' HB1' ' A' ' 153' ' ' ALA . 24.2 p -142.77 166.26 21.74 Favored Pre-proline 0 C--O 1.244 0.805 0 CA-C-N 118.448 1.124 . . . . 52.34 111.65 169.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' PRO . . . . . 0.426 ' HD2' ' HB2' ' A' ' 158' ' ' CYS . 30.1 Cg_endo -64.82 153.95 75.29 Favored 'Trans proline' 0 C--N 1.36 1.179 0 C-N-CA 120.822 1.015 . . . . 50.12 111.644 171.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -56.37 -33.98 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 113.863 1.06 . . . . 49.47 113.863 178.144 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' GLY . . . . . . . . . . . . . . . -58.49 -41.79 95.56 Favored Glycine 0 C--O 1.246 0.855 0 N-CA-C 109.115 -1.594 . . . . 48.55 109.115 -174.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 59.2 m -63.09 -53.07 59.39 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.803 -0.698 . . . . 48.56 111.159 -178.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.628 ' O ' HG13 ' A' ' 167' ' ' VAL . 3.1 mm -52.62 -54.96 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 119.167 -0.444 . . . . 47.01 110.311 172.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.52 -50.38 2.94 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 123.606 0.566 . . . . 61.11 111.161 176.411 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 24.5 p -75.22 -44.15 47.84 Favored 'General case' 0 C--O 1.206 -1.228 0 N-CA-C 112.454 0.539 . . . . 45.35 112.454 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -48.72 -53.35 19.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.319 0.859 . . . . 43.0 113.319 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' VAL . . . . . 0.628 HG13 ' O ' ' A' ' 163' ' ' ILE . 0.6 OUTLIER -61.79 -34.36 62.08 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.237 0 N-CA-C 113.642 0.978 . . . . 41.55 113.642 171.882 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' ALA . . . . . . . . . . . . . . . -60.24 -49.35 77.96 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.568 -1.333 . . . . 44.76 113.706 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -62.07 -39.87 93.89 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.35 -0.982 . . . . 63.96 108.35 175.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ALA . . . . . 0.402 ' HB3' ' HA ' ' A' ' 167' ' ' VAL . . . -59.36 -44.71 92.67 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 115.02 -0.991 . . . . 45.73 110.323 -176.996 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -65.32 -46.96 78.21 Favored 'General case' 0 CA--C 1.495 -1.138 0 CA-C-N 114.559 -1.2 . . . . 45.55 111.472 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -53.23 -49.0 67.7 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 124.273 0.983 . . . . 52.06 113.157 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -59.33 -44.14 92.64 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.407 1.083 . . . . 45.5 111.556 -175.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' LEU . . . . . 0.893 HD13 HD21 ' A' ' 131' ' ' LEU . 4.7 mp -78.35 -12.47 60.01 Favored 'General case' 0 CA--C 1.493 -1.223 0 CA-C-N 114.906 -1.043 . . . . 46.55 109.346 -175.699 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 80.3 mt -98.36 -19.36 17.8 Favored 'General case' 0 CA--C 1.506 -0.745 0 C-N-CA 118.711 -1.196 . . . . 48.84 112.427 176.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.334 0 C-N-CA 125.506 1.522 . . . . 49.49 113.743 -178.683 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' MET . . . . . 0.812 ' N ' ' H ' ' B' ' 119' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.209 -1.056 0 N-CA-C 107.928 -1.138 . . . . 71.8 107.928 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' GLY . . . . . 1.192 ' O ' ' CD1' ' B' ' 121' ' ' LEU . . . -61.12 -38.83 96.23 Favored Glycine 0 C--O 1.202 -1.856 0 N-CA-C 117.581 1.792 . . . . 67.53 117.581 107.68 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' PHE . . . . . 0.805 ' N ' ' N ' ' B' ' 116' ' ' MET . 60.7 t80 -46.26 -42.81 14.96 Favored 'General case' 0 C--O 1.198 -1.657 0 N-CA-C 111.872 0.323 . . . . 65.55 111.872 172.12 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLU . . . . . 0.847 ' O ' ' HB2' ' B' ' 123' ' ' GLU . 43.6 mt-10 -59.4 -36.82 76.56 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 114.083 1.142 . . . . 69.26 114.083 177.743 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ASP . . . . . 0.929 ' O ' ' HB3' ' B' ' 123' ' ' GLU . 75.0 m-20 -71.3 -60.94 1.96 Allowed 'General case' 0 CA--C 1.481 -1.701 0 CA-C-O 121.717 0.77 . . . . 65.68 109.716 -172.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' LEU . . . . . 1.248 ' O ' HG23 ' B' ' 125' ' ' THR . 3.2 mp -44.58 -43.71 8.29 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 114.956 1.465 . . . . 61.54 114.956 -177.728 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.798 ' O ' HG23 ' B' ' 126' ' ' THR 0.467 0.8 OUTLIER -67.99 -43.09 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.845 0 N-CA-C 118.739 2.866 . . . . 61.18 118.739 163.138 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' GLU . . . . . 0.929 ' HB3' ' O ' ' B' ' 120' ' ' ASP 0.407 0.0 OUTLIER -40.28 -53.53 2.52 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-N 115.593 -0.731 . . . . 65.47 110.83 160.185 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' VAL . . . . . 0.937 HG12 ' N ' ' B' ' 125' ' ' THR . 1.8 t -65.6 -68.62 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.263 0 C-N-CA 118.873 -1.131 . . . . 56.9 110.253 -178.958 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' THR . . . . . 1.248 HG23 ' O ' ' B' ' 121' ' ' LEU . 0.9 OUTLIER -57.39 -19.05 20.76 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 115.365 -0.834 . . . . 55.83 110.201 -157.682 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' THR . . . . . 0.798 HG23 ' O ' ' B' ' 122' ' ' VAL . 7.5 p -67.29 -48.05 68.8 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 112.262 0.468 . . . . 53.56 112.262 167.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' MET . . . . . 0.665 ' C ' ' HB2' ' B' ' 130' ' ' ASP . 14.6 mtp -50.1 -16.68 0.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.321 0.388 . . . . 57.45 111.185 177.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ILE . . . . . 1.028 HD11 ' CD2' ' B' ' 174' ' ' LEU . 22.2 mm -114.99 -59.99 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 54.8 111.172 -152.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ALA . . . . . 0.497 ' H ' HD21 ' C' ' 121' ' ' LEU . . . -14.63 -37.14 0.0 OUTLIER 'General case' 0 C--N 1.345 0.405 0 CA-C-O 121.998 0.904 . . . . 55.82 112.481 133.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' ASP . . . . . 0.665 ' HB2' ' C ' ' B' ' 127' ' ' MET . 0.6 OUTLIER -81.77 -26.55 34.36 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 115.804 -0.634 . . . . 62.63 111.171 -165.618 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' LEU . . . . . 0.462 HD21 ' CD1' ' B' ' 174' ' ' LEU . 28.2 mt -52.08 -63.57 1.09 Allowed 'General case' 0 C--O 1.19 -2.074 1 N-CA-C 145.535 12.791 . . . . 53.79 145.535 -156.667 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' THR . . . . . 1.142 ' O ' ' O2 ' ' B' ' 109' ' ' SO4 0.259 42.4 p -127.87 -72.14 0.63 Allowed 'General case' 0 CA--C 1.44 -3.254 1 N-CA-C 122.935 4.421 . . . . 50.23 122.935 125.722 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' THR . . . . . 0.86 HG23 ' O3 ' ' B' ' 109' ' ' SO4 . 0.1 OUTLIER -132.07 -39.68 1.06 Allowed 'General case' 0 C--O 1.21 -0.975 1 C-N-CA 155.344 13.458 . . . . 52.15 116.197 110.936 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' ASP . . . . . 0.649 ' N ' ' OG1' ' B' ' 132' ' ' THR . 46.0 m-20 -74.31 -31.77 62.6 Favored 'General case' 0 C--O 1.191 -1.996 0 CA-C-N 113.961 -1.472 . . . . 53.21 113.86 -170.133 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' GLN . . . . . 0.872 ' CD ' HG23 ' B' ' 132' ' ' THR . 0.0 OUTLIER -65.18 -52.7 53.32 Favored 'General case' 0 C--O 1.185 -2.331 0 N-CA-C 113.348 0.869 . . . . 55.52 113.348 163.499 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ARG . . . . . 0.606 ' NH1' ' OD2' ' C' ' 120' ' ' ASP . 4.9 ttm105 -50.2 -43.34 52.55 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 122.052 -0.405 . . . . 46.28 110.1 -179.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -62.0 -55.21 31.61 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 124.397 1.061 . . . . 51.36 111.479 -179.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.31 -46.39 69.37 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 123.678 0.611 . . . . 41.34 112.383 175.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 20.5 tp -63.57 -47.71 80.41 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.239 -0.584 . . . . 38.64 110.853 -175.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 59.6 mt -70.4 -42.12 72.1 Favored 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 108.365 -0.976 . . . . 40.19 108.365 -176.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' B' ' 147' ' ' LEU . 7.9 mt -54.98 -26.01 33.79 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.677 0.611 . . . . 37.19 112.405 176.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' THR . . . . . 0.549 ' O ' ' HA2' ' B' ' 146' ' ' GLY . 70.8 p -110.23 -22.89 11.53 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 116.302 1.964 . . . . 34.95 116.302 -176.336 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' GLN . . . . . . . . . . . . . 19.5 mm100 -108.19 -41.55 4.87 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 123.671 0.788 . . . . 37.1 110.67 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 60.1 tp -81.35 -40.81 22.98 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 119.78 -0.768 . . . . 37.03 109.222 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' LEU . . . . . 0.708 HD11 HD23 ' C' ' 174' ' ' LEU . 1.3 mp -86.53 -26.77 24.38 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 118.425 -1.31 . . . . 34.3 113.4 174.582 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' GLY . . . . . 0.549 ' HA2' ' O ' ' B' ' 142' ' ' THR . . . 66.88 22.0 71.77 Favored Glycine 0 C--O 1.217 -0.924 0 N-CA-C 111.611 -0.596 . . . . 35.2 111.611 -179.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' B' ' 141' ' ' LEU . 14.3 mt -62.08 139.16 58.46 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.215 1.006 . . . . 38.66 111.025 168.524 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 88.3 p -55.05 153.27 6.68 Favored 'General case' 0 C--O 1.238 0.494 0 O-C-N 123.722 0.639 . . . . 35.12 109.926 169.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' TYR . . . . . 0.424 ' HB3' HG12 ' B' ' 160' ' ' VAL . 68.5 m-85 -46.49 -57.51 4.64 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 118.654 -1.218 . . . . 44.38 113.848 169.557 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -42.24 -55.85 3.15 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 113.622 0.971 . . . . 37.07 113.622 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -57.54 -46.15 84.23 Favored 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 112.788 0.662 . . . . 45.41 112.788 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -58.63 -46.7 86.52 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.408 0.623 . . . . 37.12 111.021 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' ALA . . . . . 0.481 ' HB1' ' O ' ' B' ' 158' ' ' CYS . . . -58.15 -46.1 86.26 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.575 -1.268 . . . . 38.86 107.575 -178.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -54.85 -45.55 74.56 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.946 0.879 . . . . 39.71 111.159 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 47.0 t -61.23 -45.11 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 CA-C-N 115.171 -0.922 . . . . 40.99 108.968 -177.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' CYS . . . . . . . . . . . . . 45.0 m -89.46 5.85 43.47 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 114.527 1.306 . . . . 44.81 114.527 -177.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . 45.86 50.96 11.14 Favored Glycine 0 C--O 1.214 -1.146 0 CA-C-O 119.468 -0.629 . . . . 41.01 113.802 -177.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' CYS . . . . . 0.481 ' O ' ' HB1' ' B' ' 153' ' ' ALA . 14.6 p -142.67 159.22 57.99 Favored Pre-proline 0 CA--C 1.557 1.214 0 N-CA-C 107.865 -1.161 . . . . 43.13 107.865 171.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.41 150.72 79.25 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 121.808 1.672 . . . . 36.12 115.25 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.424 HG12 ' HB3' ' B' ' 149' ' ' TYR . 0.0 OUTLIER -44.45 -60.07 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 N-CA-C 113.595 0.961 . . . . 34.74 113.595 173.257 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -37.98 -37.74 0.46 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 111.673 -0.571 . . . . 35.61 111.673 -177.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' THR . . . . . . . . . . . . . 12.6 m -65.61 -62.22 1.64 Allowed 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.817 0.673 . . . . 39.14 112.817 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.721 ' O ' HG12 ' B' ' 167' ' ' VAL . 28.3 mm -44.66 -42.52 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-O 120.89 0.376 . . . . 42.27 111.961 169.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 21.5 ttm105 -63.62 -42.69 98.16 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 120.292 -0.563 . . . . 63.83 110.096 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' SER . . . . . . . . . . . . . 2.7 p -82.38 -27.99 31.76 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 118.932 -1.107 . . . . 39.67 111.237 -173.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -61.59 -55.18 33.57 Favored 'General case' 0 CA--C 1.519 -0.246 0 O-C-N 123.437 0.46 . . . . 49.39 110.748 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' VAL . . . . . 0.721 HG12 ' O ' ' B' ' 163' ' ' ILE . 1.4 p -54.74 -34.56 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 112.927 0.714 . . . . 38.48 112.927 169.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' ALA . . . . . . . . . . . . . . . -60.19 -44.79 94.82 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 107.217 -1.401 . . . . 41.2 107.217 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -69.59 -41.32 75.94 Favored 'General case' 0 C--O 1.213 -0.841 0 O-C-N 124.121 0.888 . . . . 57.84 111.703 -179.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -49.93 -36.31 27.21 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 113.072 0.767 . . . . 43.05 113.072 170.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -74.22 -27.42 60.78 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.472 -0.768 . . . . 46.25 110.988 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -76.57 -38.59 54.67 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 113.694 0.998 . . . . 55.11 113.694 -177.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' ALA . . . . . . . . . . . . . . . -70.25 -34.99 73.5 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 107.369 -1.345 . . . . 48.87 107.369 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' LEU . . . . . 1.028 ' CD2' HD11 ' B' ' 128' ' ' ILE . 3.5 mp -74.21 -21.3 59.86 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 114.449 1.277 . . . . 51.62 114.449 -179.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' LEU . . . . . . . . . . . . . 66.5 mt -109.91 -3.96 16.26 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 115.691 1.737 . . . . 50.91 115.691 -169.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 113.179 0.807 . . . . 52.27 113.179 -172.018 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' MET . . . . . 0.651 ' SD ' ' HA3' ' C' ' 117' ' ' GLY 0.375 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.975 0 N-CA-C 118.135 2.643 . . . . 74.51 118.135 . . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' GLY . . . . . 0.651 ' HA3' ' SD ' ' C' ' 116' ' ' MET . . . 81.62 -124.45 6.46 Favored Glycine 0 C--N 1.349 1.272 0 CA-C-N 123.509 2.868 . . . . 65.1 108.887 11.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' PHE . . . . . 1.397 ' O ' ' CG2' ' C' ' 122' ' ' VAL . 62.7 m-85 -57.95 -22.52 49.38 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 112.84 0.682 . . . . 62.49 112.84 177.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' GLU . . . . . 0.687 ' C ' HG23 ' C' ' 122' ' ' VAL . 12.8 tt0 -52.94 -41.28 64.35 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 117.788 -1.565 . . . . 69.04 109.401 178.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' ASP . . . . . 0.656 ' O ' ' C ' ' C' ' 121' ' ' LEU . 18.9 m-20 -64.78 -69.28 0.3 Allowed 'General case' 0 CA--C 1.488 -1.427 0 CA-C-O 121.583 0.706 . . . . 64.2 111.912 -179.219 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' LEU . . . . . 1.059 HD12 ' H ' ' C' ' 121' ' ' LEU . 1.7 mp -51.37 -30.36 18.64 Favored 'General case' 0 CA--C 1.472 -2.055 1 N-CA-C 100.064 -4.05 . . . . 60.76 100.064 -161.148 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' VAL . . . . . 1.397 ' CG2' ' O ' ' C' ' 118' ' ' PHE . 1.4 t -50.76 -68.98 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.416 -2.17 0 N-CA-C 102.766 -3.05 . . . . 59.95 102.766 -176.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' C' ' 120' ' ' ASP . 1.5 pt-20 -64.17 -34.98 79.32 Favored 'General case' 0 C--O 1.201 -1.465 0 N-CA-C 113.98 1.104 . . . . 65.64 113.98 -162.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' VAL . . . . . 0.473 ' O ' HG12 ' C' ' 128' ' ' ILE . 98.0 t -52.89 -51.29 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 CA-C-N 115.587 -0.733 . . . . 57.3 110.435 165.878 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' THR . . . . . 0.409 ' N ' ' O ' ' C' ' 122' ' ' VAL . 24.0 m -57.71 -24.67 58.05 Favored 'General case' 0 C--O 1.199 -1.578 0 C-N-CA 119.693 -0.803 . . . . 54.6 108.946 -169.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 126' ' ' THR . . . . . 0.748 HG22 ' HZ ' ' A' ' 118' ' ' PHE . 43.5 p -87.36 -33.29 19.21 Favored 'General case' 0 C--O 1.252 1.229 0 N-CA-C 115.31 1.596 . . . . 51.78 115.31 -175.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 127' ' ' MET . . . . . 0.479 ' HB3' HD12 ' C' ' 174' ' ' LEU . 3.5 mtt -45.34 -53.75 8.11 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 103.239 -2.875 . . . . 50.52 103.239 169.592 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 128' ' ' ILE . . . . . 0.585 ' CD1' HD21 ' C' ' 174' ' ' LEU . 49.3 mm -53.43 -59.21 1.97 Allowed 'Isoleucine or valine' 2 C--O 1.021 -10.949 2 CA-C-O 146.253 12.454 . . . . 49.29 111.251 -166.882 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 129' ' ' ALA . . . . . 0.544 ' C ' ' O ' ' C' ' 128' ' ' ILE . . . -62.48 -23.74 67.08 Favored 'General case' 1 C--N 0.94 -17.226 2 CA-C-N 87.393 -13.549 . . . . 50.47 113.33 177.056 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 130' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' C' ' 127' ' ' MET . 68.5 m-20 -74.06 -18.96 60.76 Favored 'General case' 0 CA--C 1.522 -0.109 0 N-CA-C 112.282 0.475 . . . . 56.6 112.282 170.759 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 131' ' ' LEU . . . . . 0.558 HD21 HD13 ' C' ' 174' ' ' LEU . 24.5 mt -57.05 161.4 3.08 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.792 -0.818 . . . . 48.17 108.792 176.097 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 132' ' ' THR . . . . . 0.563 ' OG1' ' HG2' ' C' ' 135' ' ' GLN . 4.6 p -68.4 161.84 26.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.938 -1.134 . . . . 47.15 107.938 173.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 133' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.14 -46.2 72.18 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 118.812 -1.155 . . . . 45.85 108.377 -177.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 134' ' ' ASP . . . . . 0.504 ' HB3' ' HD2' ' C' ' 166' ' ' ARG . 72.5 m-20 -61.74 -53.02 61.64 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 117.147 2.277 . . . . 48.99 117.147 -177.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 135' ' ' GLN . . . . . 0.563 ' HG2' ' OG1' ' C' ' 132' ' ' THR . 0.0 OUTLIER -56.63 -45.26 81.64 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 118.247 -1.381 . . . . 45.03 114.177 175.014 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 136' ' ' ARG . . . . . 0.417 ' O ' ' HG ' ' C' ' 140' ' ' LEU . 23.1 ttm105 -59.87 -39.98 87.13 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.327 0.512 . . . . 47.71 111.524 176.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 137' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -62.44 -51.99 65.32 Favored 'General case' 0 C--O 1.246 0.877 0 C-N-CA 119.9 -0.72 . . . . 41.88 110.533 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.16 -45.87 75.7 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 114.831 -1.077 . . . . 36.2 111.006 -178.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 139' ' ' LEU . . . . . . . . . . . . . 2.0 tp -70.58 -32.77 70.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 123.763 0.664 . . . . 33.78 111.579 -177.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 140' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' C' ' 136' ' ' ARG . 13.0 mt -74.84 -40.02 61.26 Favored 'General case' 0 CA--C 1.479 -1.782 0 N-CA-C 108.406 -0.961 . . . . 36.04 108.406 -177.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 141' ' ' LEU . . . . . . . . . . . . . 38.8 mt -62.2 -49.6 75.13 Favored 'General case' 0 C--O 1.245 0.835 0 O-C-N 124.309 1.006 . . . . 34.1 110.444 -178.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 142' ' ' THR . . . . . 0.8 ' O ' ' HA2' ' C' ' 146' ' ' GLY . 75.9 p -77.67 -20.45 53.68 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.468 1.285 . . . . 35.33 114.468 -178.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 143' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -114.42 -40.21 3.68 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 115.314 1.598 . . . . 36.75 115.314 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 16.1 tp -78.39 -45.66 21.87 Favored 'General case' 0 C--O 1.205 -1.243 0 C-N-CA 117.933 -1.507 . . . . 34.7 108.039 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 145' ' ' LEU . . . . . . . . . . . . . 9.8 mp -85.53 -32.04 22.4 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 104.82 -2.289 . . . . 37.64 104.82 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 146' ' ' GLY . . . . . 0.8 ' HA2' ' O ' ' C' ' 142' ' ' THR . . . 66.39 44.95 89.31 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 120.04 -1.076 . . . . 33.43 114.881 -174.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 147' ' ' LEU . . . . . . . . . . . . . 10.4 mt -75.42 153.89 37.41 Favored 'General case' 0 C--O 1.242 0.669 0 O-C-N 121.86 -0.788 . . . . 32.23 110.115 171.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 148' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.46 160.74 5.06 Favored 'General case' 0 CA--C 1.488 -1.425 0 N-CA-C 107.281 -1.377 . . . . 33.59 107.281 168.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 149' ' ' TYR . . . . . 0.433 ' HD1' ' H ' ' C' ' 149' ' ' TYR . 1.9 m-85 -58.13 -36.95 73.69 Favored 'General case' 0 C--O 1.215 -0.719 0 N-CA-C 107.83 -1.174 . . . . 41.89 107.83 171.559 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.03 -50.61 70.43 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 122.389 0.276 . . . . 33.86 110.969 177.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 151' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -70.14 -40.54 74.75 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 120.974 -0.29 . . . . 35.2 110.732 -176.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 152' ' ' ALA . . . . . . . . . . . . . . . -54.14 -50.03 67.87 Favored 'General case' 0 C--O 1.216 -0.68 0 O-C-N 123.442 0.464 . . . . 32.65 110.15 172.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 153' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' C' ' 158' ' ' CYS . . . -62.34 -34.4 76.57 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 113.009 0.744 . . . . 33.3 113.009 -178.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 154' ' ' ALA . . . . . . . . . . . . . . . -64.54 -52.07 59.59 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 121.657 -0.652 . . . . 36.84 110.296 174.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 155' ' ' VAL . . . . . . . . . . . . . 25.1 t -47.28 -55.5 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-O 119.75 -0.167 . . . . 39.35 110.904 174.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 156' ' ' CYS . . . . . . . . . . . . . 63.2 m -79.58 -13.49 59.49 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 115.112 1.523 . . . . 40.28 115.112 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 157' ' ' GLY . . . . . . . . . . . . . . . 58.21 54.62 36.12 Favored Glycine 0 CA--C 1.534 1.219 0 N-CA-C 116.48 1.352 . . . . 40.74 116.48 -171.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 158' ' ' CYS . . . . . 0.486 ' O ' ' HB1' ' C' ' 153' ' ' ALA . 25.0 p -142.48 167.75 15.44 Favored Pre-proline 0 C--O 1.239 0.551 0 O-C-N 122.244 -0.562 . . . . 41.94 110.303 173.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 159' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -58.94 148.5 84.42 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 122.965 0.981 . . . . 38.72 112.896 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 160' ' ' VAL . . . . . . . . . . . . . 55.3 t -53.88 -44.6 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.441 0 O-C-N 124.02 0.825 . . . . 37.68 108.91 178.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 161' ' ' GLY . . . . . . . . . . . . . . . -47.53 -40.31 16.49 Favored Glycine 0 C--N 1.336 0.582 0 CA-C-N 114.717 -1.129 . . . . 36.25 111.162 177.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 162' ' ' THR . . . . . . . . . . . . . 1.8 m -56.88 -54.5 45.84 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 119.319 -0.372 . . . . 37.39 110.951 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 163' ' ' ILE . . . . . . . . . . . . . 1.7 mm -60.68 -46.66 95.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 C-N-CA 120.413 -0.515 . . . . 36.78 111.572 177.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 164' ' ' ARG . . . . . 0.416 ' HA ' ' CE2' ' C' ' 149' ' ' TYR . 0.0 OUTLIER -47.47 -41.49 20.71 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 108.651 -0.87 . . . . 63.42 108.651 179.381 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 165' ' ' SER . . . . . . . . . . . . . 13.4 t -72.06 -48.49 43.88 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 113.542 0.941 . . . . 36.01 113.542 -176.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 166' ' ' ARG . . . . . 0.504 ' HD2' ' HB3' ' C' ' 134' ' ' ASP . 7.6 mmt85 -60.51 -37.03 79.8 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 106.827 -1.545 . . . . 34.98 106.827 -174.401 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 167' ' ' VAL . . . . . 0.629 ' O ' ' HG3' ' C' ' 171' ' ' ARG . 85.8 t -72.17 -37.57 59.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 113.862 1.06 . . . . 30.15 113.862 178.539 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 168' ' ' ALA . . . . . . . . . . . . . . . -57.35 -48.41 79.08 Favored 'General case' 0 C--O 1.251 1.146 0 N-CA-C 106.864 -1.532 . . . . 32.64 106.864 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 169' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -73.29 -37.49 66.21 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 114.355 -1.293 . . . . 59.29 111.939 -173.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 170' ' ' ALA . . . . . . . . . . . . . . . -53.22 -43.53 67.34 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 124.121 0.888 . . . . 38.57 108.882 167.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 171' ' ' ARG . . . . . 0.629 ' HG3' ' O ' ' C' ' 167' ' ' VAL . 40.8 mtt85 -69.37 -37.12 77.44 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 116.883 -1.927 . . . . 39.76 113.117 -177.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 172' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -67.8 -49.46 62.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 118.667 -1.213 . . . . 47.97 109.747 -179.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 173' ' ' ALA . . . . . . . . . . . . . . . -38.88 -58.1 1.14 Allowed 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 125.327 1.642 . . . . 44.37 110.314 169.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 174' ' ' LEU . . . . . 0.708 HD23 HD11 ' B' ' 145' ' ' LEU . 0.2 OUTLIER -69.07 -19.58 64.08 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.826 1.417 . . . . 47.17 114.826 -174.99 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 175' ' ' LEU . . . . . . . . . . . . . 16.8 mt -108.71 31.85 5.32 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 121.982 -0.449 . . . . 50.82 110.356 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 176' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 114.156 1.169 . . . . 51.99 114.156 -173.251 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SO4 . . . . . 0.682 ' O3 ' HG23 ' A' ' 133' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' SO4 . . . . . 0.819 ' O1 ' HG21 ' B' ' 132' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' SO4 . . . . . 1.142 ' O2 ' ' O ' ' B' ' 132' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' SO4 . . . . . 0.403 ' O2 ' ' HB2' ' C' ' 134' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_