data_6xtk_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6xtk _Structure_validation_residue.Date_analyzed 2020-05-08 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 ' 10' ' ' CYS . . . . . . . . . . . . . 40.7 t . . . . . 0 C--O 1.24 0.561 0 N-CA-C 106.563 -1.644 . . . . 72.49 106.563 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -89.97 -2.24 5.58 Favored 'Trans proline' 0 C--O 1.239 0.562 0 C-N-CA 121.303 1.335 . . . . 46.73 115.484 -171.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 49.4 tp -143.37 114.76 7.98 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.036 -1.468 . . . . 38.46 107.036 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 6.6 tmm? -124.39 147.72 48.05 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.202 -1.036 . . . . 51.72 108.202 177.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 66.6 t -124.52 131.56 72.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 107.092 -1.447 . . . . 31.75 107.092 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -126.04 133.36 51.75 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.365 -0.606 . . . . 45.24 109.365 177.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 t -127.17 129.94 71.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 109.626 -0.509 . . . . 28.54 109.626 -176.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.4 mt -118.46 150.77 39.03 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.528 1.131 . . . . 36.76 109.412 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -106.82 113.87 27.62 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 125.479 1.512 . . . . 33.83 108.266 178.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.18 -9.58 59.72 Favored 'General case' 0 C--O 1.255 1.354 0 C-N-CA 124.11 0.964 . . . . 30.3 113.492 -176.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -86.95 -49.79 14.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-O 121.753 0.787 . . . . 44.21 111.042 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 85.6 mtp180 -86.35 -16.07 38.54 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 112.637 0.606 . . . . 75.8 112.637 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.67 56.08 14.68 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 119.788 -1.196 . . . . 34.0 112.407 -176.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.2 p -157.09 169.08 11.21 Favored Pre-proline 0 C--O 1.248 1.006 0 N-CA-C 107.441 -1.318 . . . . 40.99 107.441 -168.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.15 149.27 90.02 Favored 'Trans proline' 0 C--O 1.236 0.402 0 N-CA-C 109.955 -0.825 . . . . 38.57 109.955 165.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.08 108.96 20.32 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 106.914 -1.513 . . . . 32.96 106.914 172.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 67.3 mt -96.14 140.93 16.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 109.221 -0.659 . . . . 43.67 109.221 -166.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 44.4 t30 66.49 35.27 5.62 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.29 -0.414 . . . . 63.09 111.939 172.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.6 t -88.0 127.73 40.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.682 0 N-CA-C 107.776 -1.194 . . . . 32.44 107.776 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.33 137.26 37.96 Favored 'General case' 0 C--O 1.241 0.608 0 C-N-CA 119.053 -1.059 . . . . 28.89 109.565 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 99.3 t -129.7 128.49 65.61 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.256 0 N-CA-C 107.647 -1.242 . . . . 30.15 107.647 -179.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.0 m-70 -119.24 133.05 55.97 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 122.971 0.508 . . . . 39.25 109.779 175.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.46 134.56 59.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 N-CA-C 109.052 -0.721 . . . . 32.71 109.052 -176.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -127.18 157.25 40.25 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.66 0.743 . . . . 41.35 109.535 -179.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.1 ttt-85 -128.01 135.26 49.65 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.403 -0.962 . . . . 53.54 108.403 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.2 ttpt -73.73 125.42 28.05 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 118.49 -1.284 . . . . 66.74 109.92 -176.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.88 170.54 11.57 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 122.19 0.995 . . . . 48.72 111.557 -176.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.49 -41.73 53.69 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.822 -1.081 . . . . 51.26 112.048 176.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.6 p30 -80.06 11.13 3.61 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.153 0.797 . . . . 67.14 113.153 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 72.39 7.59 5.67 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.401 1.08 . . . . 89.19 113.722 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 39.2 p -87.73 162.41 17.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 119.251 0.932 . . . . 57.21 110.188 171.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -87.74 119.48 28.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.143 -0.935 . . . . 61.14 109.176 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -104.79 139.82 20.47 Favored Pre-proline 0 C--N 1.314 -0.974 0 C-N-CA 118.544 -1.262 . . . . 82.85 111.533 175.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -58.44 133.77 56.86 Favored 'Trans proline' 0 N--CA 1.475 0.397 0 C-N-CA 120.496 0.797 . . . . 45.47 110.824 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -116.56 -46.34 2.77 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.84 0.682 . . . . 40.03 112.84 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -169.36 156.3 6.77 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.355 -1.35 . . . . 36.76 107.355 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 82.7 p -150.38 168.41 24.21 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 118.791 -1.164 . . . . 37.17 110.98 172.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.25 -174.04 44.18 Favored Glycine 0 C--N 1.34 0.771 0 CA-C-N 115.078 -0.965 . . . . 32.15 111.698 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.6 mttp -125.12 144.03 50.63 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.592 -0.892 . . . . 59.07 108.592 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.8 p -68.11 150.94 47.76 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 116.581 -2.048 . . . . 31.95 111.207 174.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.6 p -86.66 -171.77 3.69 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.977 0.894 . . . . 39.06 111.236 -178.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -61.91 -22.49 65.62 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-N 115.907 -0.588 . . . . 106.88 112.313 177.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.9 p -91.24 3.89 53.68 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.221 0.823 . . . . 39.93 113.221 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.82 7.04 87.43 Favored Glycine 0 C--N 1.338 0.677 0 N-CA-C 114.709 0.644 . . . . 33.9 114.709 -173.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -105.9 149.65 26.36 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 118.452 1.126 . . . . 65.14 110.989 -173.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.9 tp -127.37 107.73 10.23 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 106.542 -1.651 . . . . 32.47 106.542 177.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -109.32 165.39 11.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.753 0.787 . . . . 52.42 109.873 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.49 15.53 80.74 Favored Glycine 0 C--O 1.244 0.752 0 C-N-CA 118.736 -1.697 . . . . 38.65 114.903 171.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.8 mt -63.2 -39.17 93.86 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 118.344 1.072 . . . . 37.51 111.051 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.9 t -150.23 -173.95 4.59 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 119.836 -0.746 . . . . 41.04 109.654 -172.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 65.1 p -130.42 165.9 21.61 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 124.899 1.279 . . . . 42.81 109.984 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -61.46 -37.7 84.53 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 115.113 -0.949 . . . . 86.58 111.426 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.9 mp0 -68.77 -43.82 74.96 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.555 -0.458 . . . . 63.48 111.664 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -74.63 -30.27 61.58 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 112.479 0.548 . . . . 58.02 112.479 -174.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -86.77 76.06 9.53 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.05 0.929 . . . . 35.85 109.975 -173.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.7 m -82.88 172.45 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.611 0 CA-C-N 115.683 -0.689 . . . . 34.28 109.744 -178.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -44.63 144.12 1.19 Allowed 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.384 0.611 . . . . 52.48 110.417 166.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 164.8 178.56 38.23 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.037 -1.078 . . . . 36.55 110.562 171.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 82.7 mt -99.9 125.9 53.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 107.537 -1.283 . . . . 45.2 107.537 170.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -117.18 152.46 34.73 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.038 0.447 . . . . 34.61 110.869 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -127.8 122.05 31.72 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.057 -1.46 . . . . 50.84 107.057 179.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 87.0 t -108.63 114.07 45.73 Favored 'Isoleucine or valine' 0 C--O 1.241 0.627 0 N-CA-C 106.643 -1.614 . . . . 36.28 106.643 175.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -105.57 114.68 29.0 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.308 -0.997 . . . . 57.2 108.308 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 73.4 mt -100.0 122.58 52.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 108.021 -1.103 . . . . 31.95 108.021 -176.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 58.9 t0 -80.29 75.73 7.09 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 122.969 1.366 . . . . 48.53 110.363 -175.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 59.0 p -71.43 -31.87 67.71 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-N 114.52 -1.218 . . . . 36.76 111.536 -178.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -61.55 -50.2 73.6 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 119.718 -0.793 . . . . 57.88 111.398 -177.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 74.8 m -60.27 -38.93 85.08 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.78 -0.768 . . . . 41.76 110.966 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -53.69 -55.4 26.44 Favored 'General case' 0 C--O 1.244 0.778 0 C-N-CA 119.941 -0.704 . . . . 36.31 110.898 178.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 75.3 m95 -68.81 -38.98 80.3 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 116.328 -0.396 . . . . 40.97 111.049 -174.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.0 mttm -62.08 -41.9 98.65 Favored 'General case' 0 C--N 1.346 0.424 0 C-N-CA 119.443 -0.903 . . . . 63.1 110.776 -178.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.29 -20.54 59.58 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 112.849 0.685 . . . . 51.19 112.849 175.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.4 mt -96.54 9.93 39.94 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 113.154 0.798 . . . . 52.28 113.154 174.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.76 16.16 77.91 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 115.626 1.01 . . . . 62.03 115.626 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 57.8 mt -112.42 134.94 53.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 118.481 1.141 . . . . 53.34 108.191 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.3 m -95.01 105.22 17.91 Favored Pre-proline 0 C--O 1.242 0.697 0 N-CA-C 107.866 -1.161 . . . . 55.58 107.866 173.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -85.29 173.03 8.0 Favored 'Trans proline' 0 C--N 1.327 -0.594 0 C-N-CA 120.694 0.929 . . . . 39.98 111.731 -173.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -80.74 -45.58 16.83 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 114.833 -1.076 . . . . 40.38 111.667 -178.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -88.76 147.7 24.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.015 0.912 . . . . 35.63 112.794 -171.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . 0.645 ' OE2' ' O ' ' A' ' 301' ' ' HOH . 54.5 mm-40 -70.18 -36.01 74.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.131 -1.028 . . . . 52.29 111.468 173.262 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HIS . . . . . 0.769 ' NE2' ' O ' ' B' ' 301' ' ' HOH . 4.1 p-80 -170.9 179.3 3.18 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 105.497 -2.038 . . . . 53.87 105.497 -176.786 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -125.73 119.97 29.38 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 107.214 -1.402 . . . . 37.29 107.214 171.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -106.11 137.43 44.05 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 124.288 1.035 . . . . 56.34 108.997 -177.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 77.2 t -127.87 120.74 54.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 105.883 -1.895 . . . . 38.47 105.883 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 66.0 t -123.06 129.78 74.83 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 108.95 -0.759 . . . . 37.94 108.95 -175.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -156.63 155.49 31.88 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 119.474 -0.891 . . . . 33.39 110.61 -173.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 68.1 m -87.03 129.6 34.82 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.097 -0.956 . . . . 38.58 108.482 172.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -114.0 143.37 44.86 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.316 -0.402 . . . . 36.32 110.831 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 71.19 18.82 5.65 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.543 1.537 . . . . 38.96 113.618 166.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -64.21 -27.48 69.09 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.314 -0.866 . . . . 74.8 112.357 -174.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.5 m -111.33 25.81 11.33 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.008 -0.433 . . . . 67.44 111.905 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 114.29 168.62 16.27 Favored Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 110.208 -1.157 . . . . 45.73 110.208 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -61.29 138.74 79.05 Favored 'Trans proline' 0 C--N 1.331 -0.362 0 CA-C-N 117.204 0.502 . . . . 48.13 111.693 -179.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 85.7 mmt-85 -129.6 168.15 16.86 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.146 -0.687 . . . . 59.75 109.146 170.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -105.98 134.02 49.77 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.578 -0.897 . . . . 84.43 108.578 167.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -121.44 127.06 50.74 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 109.366 -0.605 . . . . 39.03 109.366 -172.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 55.3 m -109.55 122.76 48.13 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 107.314 -1.365 . . . . 34.93 107.314 163.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 39.8 mm -100.66 115.13 41.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 106.825 -1.546 . . . . 33.84 106.825 172.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -114.3 143.44 44.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.038 -0.727 . . . . 32.79 109.038 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -133.81 138.25 45.56 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.617 -0.512 . . . . 29.39 109.617 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 57.7 tp -112.65 123.85 51.22 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.086 -1.45 . . . . 31.74 107.086 176.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 32.6 mt -108.98 134.75 51.22 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 113.796 1.036 . . . . 34.98 113.796 -168.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 43.9 m -128.49 162.15 52.68 Favored Pre-proline 0 C--O 1.239 0.543 0 N-CA-C 107.598 -1.26 . . . . 32.31 107.598 164.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -57.53 -35.58 98.81 Favored 'Trans proline' 0 C--O 1.247 0.974 0 N-CA-C 114.486 0.918 . . . . 34.8 114.486 -175.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 72.5 m -120.27 21.49 11.7 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 112.698 0.629 . . . . 36.38 112.698 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 26.3 t -161.26 152.15 18.33 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 118.833 -1.147 . . . . 36.76 108.08 -178.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -150.14 159.7 44.22 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 118.617 -1.233 . . . . 38.86 108.663 165.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' SER . . . . . 0.412 ' OG ' H20A ' A' ' 201' ' ' TCW . 42.8 p -128.85 155.6 44.96 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 106.513 -1.662 . . . . 43.09 106.513 172.146 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.0 t -139.3 146.39 40.28 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 119.022 -1.071 . . . . 32.8 109.424 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 5.1 t -141.44 168.48 19.68 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 118.173 -1.411 . . . . 33.75 109.043 174.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -123.27 136.11 54.55 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.802 -1.09 . . . . 33.71 108.476 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 29.0 t -115.91 113.68 43.98 Favored 'Isoleucine or valine' 0 C--O 1.243 0.758 0 N-CA-C 106.702 -1.592 . . . . 42.93 106.702 168.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 19.3 t -115.93 117.99 57.33 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 N-CA-C 107.144 -1.428 . . . . 41.7 107.144 -174.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 77.2 p -125.79 157.56 37.2 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.539 0.685 . . . . 53.39 109.549 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -103.34 105.02 44.55 Favored Pre-proline 0 C--O 1.237 0.445 0 CA-C-N 114.828 -1.078 . . . . 69.75 108.71 -176.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo . . . . . 0 C--N 1.347 0.469 0 C-N-CA 123.309 2.673 . . . . 75.76 114.211 -171.136 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 m . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 120.696 0.284 . . . . 86.57 111.009 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -84.96 -5.11 9.72 Favored 'Trans proline' 0 C--O 1.239 0.557 0 O-C-N 123.052 1.027 . . . . 51.51 114.261 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 46.3 tp -147.2 120.18 8.77 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.324 -0.991 . . . . 45.95 108.324 -173.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -136.06 148.96 48.56 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.827 -0.805 . . . . 69.62 108.827 -177.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 62.6 t -124.37 131.61 72.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.575 -0.898 . . . . 39.36 108.575 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -127.62 130.91 49.81 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.597 -1.261 . . . . 54.91 107.597 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 18.7 t -125.91 132.15 71.01 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 108.83 -0.804 . . . . 33.52 108.83 -176.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . 0.4 ' CD1' ' C12' ' B' ' 201' ' ' TCW . 76.1 mt -122.56 150.7 42.24 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.91 1.284 . . . . 44.56 108.931 -177.027 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -109.38 112.47 24.62 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 124.856 1.262 . . . . 36.99 107.986 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.29 -12.16 59.94 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 113.679 0.992 . . . . 32.27 113.679 -176.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 37.7 t -86.43 -47.69 16.16 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 CA-C-O 121.496 0.665 . . . . 38.11 110.366 179.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 85.6 mtp180 -84.53 -17.35 39.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.051 -0.977 . . . . 91.42 113.229 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.75 52.59 47.38 Favored Glycine 0 C--N 1.336 0.537 0 C-N-CA 120.347 -0.93 . . . . 38.34 112.929 -175.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 59.6 p -156.72 168.24 12.83 Favored Pre-proline 0 C--O 1.242 0.68 0 N-CA-C 108.329 -0.989 . . . . 47.18 108.329 -172.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -57.26 150.29 59.08 Favored 'Trans proline' 0 C--N 1.324 -0.747 0 N-CA-C 109.69 -0.927 . . . . 36.05 109.69 166.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -95.08 108.92 21.02 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 106.834 -1.543 . . . . 35.68 106.834 173.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 24.6 mt -98.22 139.71 19.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 123.516 0.726 . . . . 47.87 109.726 -167.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 57.6 m-20 65.75 34.87 7.17 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.538 0.685 . . . . 68.25 111.984 173.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 58.1 t -86.75 124.93 40.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 108.204 -1.036 . . . . 37.82 108.204 172.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.04 136.53 45.01 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 120.609 -0.436 . . . . 38.49 111.114 175.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 66.0 t -133.09 127.91 55.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 124.769 1.228 . . . . 38.1 108.571 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -119.08 134.51 55.16 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 123.149 0.579 . . . . 49.44 110.111 175.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 22.3 t -115.39 136.71 51.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 108.166 -1.05 . . . . 44.9 108.166 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -126.99 153.16 46.26 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 124.218 1.007 . . . . 54.59 109.25 179.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ARG . . . . . . . . . . . . . 32.6 ttp85 -116.0 141.85 47.58 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.016 -0.735 . . . . 77.13 109.016 172.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -74.18 122.73 23.24 Favored 'General case' 0 C--O 1.21 -0.983 0 CA-C-O 118.388 -0.815 . . . . 74.63 109.315 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' B' ' 39' ' ' ASP . . . -88.68 162.49 16.26 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 124.865 1.353 . . . . 77.66 110.374 178.295 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -46.85 -39.22 11.61 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.513 -0.767 . . . . 85.63 111.488 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.64 0.33 1.71 Allowed 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.3 0.64 . . . . 103.65 112.01 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' B' ' 36' ' ' ALA . 3.8 m-20 57.61 27.53 14.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.137 0.494 . . . . 99.92 110.978 -169.764 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.6 m -92.62 146.33 23.74 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 109.136 -0.69 . . . . 79.57 109.136 169.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 72.0 m95 -83.26 114.09 21.14 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.572 -0.899 . . . . 72.0 108.572 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -97.17 128.7 34.24 Favored Pre-proline 0 C--O 1.244 0.79 0 C-N-CA 125.393 1.477 . . . . 94.98 110.774 178.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -55.24 144.55 70.44 Favored 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 120.176 0.584 . . . . 68.81 111.197 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -133.16 -49.67 0.86 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.792 -0.64 . . . . 55.61 111.598 -172.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -160.69 164.85 31.37 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.507 -0.923 . . . . 48.19 108.507 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 86.3 p -163.48 166.84 22.25 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 120.34 -0.544 . . . . 41.54 109.558 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.3 -174.46 47.01 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 110.188 -1.165 . . . . 37.66 110.188 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -121.24 138.45 54.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.605 -0.887 . . . . 61.41 108.605 176.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 63.1 p -62.14 150.11 39.52 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 118.195 -1.402 . . . . 38.99 110.906 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 81.2 p -80.95 -172.75 3.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 122.181 0.991 . . . . 48.06 111.913 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -65.22 -20.49 66.46 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 121.808 -0.558 . . . . 96.41 112.189 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 98.4 p -91.33 6.7 44.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.812 0.278 . . . . 49.17 111.572 175.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.78 11.19 77.75 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-O 119.137 -0.813 . . . . 39.49 115.086 -175.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -106.43 147.64 29.06 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 118.844 1.322 . . . . 70.21 110.41 -175.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 21.2 tp -126.65 105.71 8.9 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 106.948 -1.501 . . . . 46.7 106.948 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -106.19 172.27 6.9 Favored 'General case' 0 N--CA 1.478 0.968 0 O-C-N 123.91 0.756 . . . . 67.32 110.597 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLY . . . . . . . . . . . . . . . 64.17 32.76 85.26 Favored Glycine 0 CA--C 1.505 -0.582 0 C-N-CA 119.635 -1.269 . . . . 55.69 113.179 171.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 49.6 mt -73.22 -31.98 64.48 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 119.959 -0.697 . . . . 55.22 111.419 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' THR . . . . . . . . . . . . . 13.4 t -153.06 179.68 8.48 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 108.9 -0.778 . . . . 52.5 108.9 -174.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 5.0 p -118.32 165.78 13.43 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.403 -0.962 . . . . 66.47 108.403 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -67.09 -35.59 80.12 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 119.79 -0.764 . . . . 93.94 111.662 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -67.8 -38.03 82.78 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 119.621 -0.832 . . . . 77.49 111.34 178.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -79.36 -23.92 43.05 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 113.188 0.81 . . . . 85.36 113.188 -175.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -89.69 78.36 6.97 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 122.516 1.151 . . . . 55.18 109.101 -173.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.4 m -88.49 162.52 2.58 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.038 0 CA-C-N 115.477 -0.783 . . . . 50.65 109.46 -178.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -48.46 144.58 4.03 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.402 -0.817 . . . . 79.01 110.376 171.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.56 -175.22 36.46 Favored Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 109.906 -1.277 . . . . 43.1 109.906 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 28.7 mt -101.17 126.58 54.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 108.534 -0.914 . . . . 54.43 108.534 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -118.73 152.09 36.8 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.302 0.573 . . . . 48.08 110.722 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LYS . . . . . 0.46 ' NZ ' ' O ' ' B' ' 303' ' ' HOH . 35.9 ttpt -124.22 124.34 42.22 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 107.558 -1.275 . . . . 62.02 107.558 179.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 88.4 t -109.01 118.23 56.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.072 -1.084 . . . . 42.63 108.072 173.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -107.09 117.87 35.2 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 110.095 -0.335 . . . . 79.62 110.095 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 62.7 mt -103.04 124.7 57.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 N-CA-C 107.985 -1.117 . . . . 37.99 107.985 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -83.45 75.81 9.97 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 122.722 1.249 . . . . 54.27 109.245 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 72.0 p -69.53 -31.8 70.23 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 114.607 -1.178 . . . . 37.63 111.828 -177.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -64.2 -44.71 91.11 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 119.627 -0.829 . . . . 70.16 110.906 -174.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 68.2 m -63.24 -39.43 94.59 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 120.843 -0.343 . . . . 42.28 111.525 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -56.16 -53.83 52.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.007 0.432 . . . . 40.01 110.847 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 77.4 m95 -65.77 -42.06 91.28 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 120.237 -0.585 . . . . 46.59 110.808 -178.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -50.7 -50.83 54.23 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.542 -0.463 . . . . 70.48 111.236 174.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -59.78 -21.53 60.91 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.128 -0.629 . . . . 56.67 112.37 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 73.6 mt -96.47 1.54 51.65 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 118.167 0.439 . . . . 56.02 112.124 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 68.57 33.67 77.09 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 114.848 0.699 . . . . 55.94 114.848 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 54.3 mt -124.34 135.27 64.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 118.217 1.008 . . . . 51.78 108.709 -177.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 33.9 t -80.6 118.02 70.5 Favored Pre-proline 0 C--O 1.239 0.502 0 CA-C-N 116.165 -0.471 . . . . 56.73 110.4 -171.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -98.62 153.9 0.72 Allowed 'Trans proline' 0 CA--C 1.509 -0.748 0 CA-C-N 119.166 0.738 . . . . 41.75 112.427 -176.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -84.72 -45.39 12.47 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 113.451 0.908 . . . . 36.82 113.451 176.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -87.5 151.52 22.95 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-O 121.586 0.707 . . . . 34.48 111.634 -170.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -71.23 -35.41 71.46 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 115.276 -0.875 . . . . 57.27 111.63 172.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' HIS . . . . . 0.766 ' NE2' ' O ' ' B' ' 302' ' ' HOH . 7.8 p-80 -171.48 -178.89 2.43 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 105.894 -1.891 . . . . 46.74 105.894 -179.348 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -126.07 121.34 32.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.665 -1.235 . . . . 38.83 107.665 173.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLU . . . . . 0.721 ' OE2' ' O ' ' B' ' 301' ' ' HOH . 12.0 tt0 -108.65 137.92 45.81 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.352 0.408 . . . . 49.82 110.278 -179.196 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 60.7 t -126.41 120.8 57.37 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.388 0 N-CA-C 106.75 -1.574 . . . . 37.88 106.75 175.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 58.8 t -121.95 125.83 73.69 Favored 'Isoleucine or valine' 0 C--O 1.241 0.654 0 N-CA-C 108.934 -0.765 . . . . 43.29 108.934 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -150.84 162.65 40.36 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.34 0.59 . . . . 42.2 110.769 -173.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 97.0 m -100.58 127.96 46.79 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.569 -0.741 . . . . 45.14 109.81 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -87.37 138.46 31.47 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 123.612 0.57 . . . . 54.82 109.774 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 N--CA 1.48 1.03 0 C-N-CA 127.508 2.323 . . . . 90.27 116.206 -163.534 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 . . . . . 0 C--O 1.232 0.162 0 N-CA-C 109.789 -0.449 . . . . 101.58 109.789 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -97.82 134.49 40.9 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.484 -0.562 . . . . 92.19 109.484 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -114.84 126.11 54.44 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.825 0.85 . . . . 58.53 110.245 -177.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 97.4 m -112.26 125.23 53.94 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.615 -0.883 . . . . 41.23 108.615 163.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 38.9 mm -101.79 112.16 33.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 105.09 -2.189 . . . . 41.38 105.09 173.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -108.87 143.3 38.27 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 109.517 -0.549 . . . . 33.91 109.517 -179.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -131.43 133.97 45.75 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.725 -0.67 . . . . 33.47 110.372 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 63.6 tp -111.48 120.7 43.02 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 106.902 -1.518 . . . . 36.38 106.902 176.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 30.8 mt -108.43 132.44 53.77 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.075 0.769 . . . . 33.1 113.075 -168.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 55.8 m -123.53 162.17 41.78 Favored Pre-proline 0 N--CA 1.452 -0.331 0 C-N-CA 124.826 1.25 . . . . 33.64 109.039 162.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -57.78 -34.41 98.19 Favored 'Trans proline' 0 C--O 1.244 0.801 0 N-CA-C 113.755 0.637 . . . . 32.59 113.755 -176.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' CYS . . . . . . . . . . . . . 96.8 m -119.42 16.85 13.01 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 113.031 0.752 . . . . 33.09 113.031 -177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 42.7 t -158.2 149.65 21.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 107.946 -1.131 . . . . 34.87 107.946 -176.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -148.87 161.44 41.84 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.087 -1.045 . . . . 41.18 109.775 164.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' SER . . . . . 0.414 ' OG ' H20A ' B' ' 201' ' ' TCW . 79.5 p -133.71 154.77 50.7 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.367 -1.346 . . . . 39.12 107.367 174.4 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 10.1 t -143.93 146.21 32.8 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 118.396 -1.321 . . . . 34.38 107.452 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 10.5 t -142.81 162.36 35.67 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.232 -1.396 . . . . 34.14 107.232 177.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -103.75 133.16 49.2 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.933 -1.031 . . . . 38.32 109.078 174.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 21.7 t -121.04 102.75 12.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 N-CA-C 104.79 -2.3 . . . . 41.08 104.79 172.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.54 125.03 65.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 107.009 -1.478 . . . . 57.86 107.009 -176.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 56.9 p -131.24 158.87 39.42 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.503 0.668 . . . . 69.6 109.69 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -117.95 119.06 34.09 Favored Pre-proline 0 C--O 1.245 0.867 0 CA-C-N 115.502 -0.772 . . . . 104.83 109.543 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo . . . . . 0 C--N 1.349 0.604 0 C-N-CA 124.609 3.539 . . . . 109.33 112.752 176.463 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' TCW . . . . . 0.49 ' C5 ' ' H15' ' A' ' 201' ' ' TCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' TCW . . . . . 0.414 H20A ' OG ' ' B' ' 117' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.645 ' O ' ' OE2' ' A' ' 89' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . 0.769 ' O ' ' NE2' ' A' ' 90' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . 0.766 ' O ' ' NE2' ' B' ' 90' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . 0.46 ' O ' ' NZ ' ' B' ' 70' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 40.7 t . . . . . 0 C--O 1.24 0.561 0 N-CA-C 106.563 -1.644 . . . . 72.49 106.563 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -89.97 -2.24 5.58 Favored 'Trans proline' 0 C--O 1.239 0.562 0 C-N-CA 121.303 1.335 . . . . 46.73 115.484 -171.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 49.4 tp -143.37 114.76 7.98 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.036 -1.468 . . . . 38.46 107.036 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . 0.46 ' HG3' ' CE1' ' A' ' 56' ' ' HIS . 6.6 tmm? -124.39 147.72 48.05 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.202 -1.036 . . . . 51.72 108.202 177.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 66.6 t -124.52 131.56 72.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 107.092 -1.447 . . . . 31.75 107.092 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -126.04 133.36 51.75 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.365 -0.606 . . . . 45.24 109.365 177.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 t -127.17 129.94 71.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 109.626 -0.509 . . . . 28.54 109.626 -176.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.4 mt -118.46 150.77 39.03 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.528 1.131 . . . . 36.76 109.412 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -106.82 113.87 27.62 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 125.479 1.512 . . . . 33.83 108.266 178.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.18 -9.58 59.72 Favored 'General case' 0 C--O 1.255 1.354 0 C-N-CA 124.11 0.964 . . . . 30.3 113.492 -176.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -86.95 -49.79 14.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-O 121.753 0.787 . . . . 44.21 111.042 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 85.6 mtp180 -86.35 -16.07 38.54 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 112.637 0.606 . . . . 75.8 112.637 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.67 56.08 14.68 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 119.788 -1.196 . . . . 34.0 112.407 -176.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.2 p -157.09 169.08 11.21 Favored Pre-proline 0 C--O 1.248 1.006 0 N-CA-C 107.441 -1.318 . . . . 40.99 107.441 -168.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.15 149.27 90.02 Favored 'Trans proline' 0 C--O 1.236 0.402 0 N-CA-C 109.955 -0.825 . . . . 38.57 109.955 165.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.08 108.96 20.32 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 106.914 -1.513 . . . . 32.96 106.914 172.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 67.3 mt -96.14 140.93 16.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 109.221 -0.659 . . . . 43.67 109.221 -166.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . 0.608 ' OD1' ' HD3' ' A' ' 48' ' ' LYS . 44.4 t30 66.49 35.27 5.62 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.29 -0.414 . . . . 63.09 111.939 172.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.6 t -88.0 127.73 40.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.682 0 N-CA-C 107.776 -1.194 . . . . 32.44 107.776 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.33 137.26 37.96 Favored 'General case' 0 C--O 1.241 0.608 0 C-N-CA 119.053 -1.059 . . . . 28.89 109.565 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 99.3 t -129.7 128.49 65.61 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.256 0 N-CA-C 107.647 -1.242 . . . . 30.15 107.647 -179.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.0 m-70 -119.24 133.05 55.97 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 122.971 0.508 . . . . 39.25 109.779 175.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.46 134.56 59.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 N-CA-C 109.052 -0.721 . . . . 32.71 109.052 -176.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -127.18 157.25 40.25 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.66 0.743 . . . . 41.35 109.535 -179.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.1 ttt-85 -128.01 135.26 49.65 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.403 -0.962 . . . . 53.54 108.403 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.2 ttpt -73.73 125.42 28.05 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 118.49 -1.284 . . . . 66.74 109.92 -176.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . 0.595 ' HB2' ' HG3' ' A' ' 42' ' ' GLU . . . -86.88 170.54 11.57 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 122.19 0.995 . . . . 48.72 111.557 -176.106 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.49 -41.73 53.69 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.822 -1.081 . . . . 51.26 112.048 176.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 39' ' ' ASP . 38.6 p30 -80.06 11.13 3.61 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.153 0.797 . . . . 67.14 113.153 -177.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 31.5 m-20 72.39 7.59 5.67 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.401 1.08 . . . . 89.19 113.722 179.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 39.2 p -87.73 162.41 17.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 119.251 0.932 . . . . 57.21 110.188 171.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -87.74 119.48 28.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.143 -0.935 . . . . 61.14 109.176 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . 0.595 ' HG3' ' HB2' ' A' ' 36' ' ' ALA . 10.2 mm-40 -104.79 139.82 20.47 Favored Pre-proline 0 C--N 1.314 -0.974 0 C-N-CA 118.544 -1.262 . . . . 82.85 111.533 175.303 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -58.44 133.77 56.86 Favored 'Trans proline' 0 N--CA 1.475 0.397 0 C-N-CA 120.496 0.797 . . . . 45.47 110.824 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -116.56 -46.34 2.77 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.84 0.682 . . . . 40.03 112.84 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -169.36 156.3 6.77 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.355 -1.35 . . . . 36.76 107.355 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 82.7 p -150.38 168.41 24.21 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 118.791 -1.164 . . . . 37.17 110.98 172.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.25 -174.04 44.18 Favored Glycine 0 C--N 1.34 0.771 0 CA-C-N 115.078 -0.965 . . . . 32.15 111.698 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . 0.608 ' HD3' ' OD1' ' A' ' 27' ' ' ASN . 9.6 mttp -125.12 144.03 50.63 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.592 -0.892 . . . . 59.07 108.592 178.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.8 p -68.11 150.94 47.76 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 116.581 -2.048 . . . . 31.95 111.207 174.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.6 p -86.66 -171.77 3.69 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.977 0.894 . . . . 39.06 111.236 -178.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -61.91 -22.49 65.62 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-N 115.907 -0.588 . . . . 106.88 112.313 177.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.9 p -91.24 3.89 53.68 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.221 0.823 . . . . 39.93 113.221 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.82 7.04 87.43 Favored Glycine 0 C--N 1.338 0.677 0 N-CA-C 114.709 0.644 . . . . 33.9 114.709 -173.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -105.9 149.65 26.36 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 118.452 1.126 . . . . 65.14 110.989 -173.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.9 tp -127.37 107.73 10.23 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 106.542 -1.651 . . . . 32.47 106.542 177.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' HIS . . . . . 0.46 ' CE1' ' HG3' ' A' ' 13' ' ' MET . 93.3 m-70 -109.32 165.39 11.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.753 0.787 . . . . 52.42 109.873 179.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.49 15.53 80.74 Favored Glycine 0 C--O 1.244 0.752 0 C-N-CA 118.736 -1.697 . . . . 38.65 114.903 171.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.8 mt -63.2 -39.17 93.86 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 118.344 1.072 . . . . 37.51 111.051 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.9 t -150.23 -173.95 4.59 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 119.836 -0.746 . . . . 41.04 109.654 -172.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 65.1 p -130.42 165.9 21.61 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 124.899 1.279 . . . . 42.81 109.984 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -61.46 -37.7 84.53 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 115.113 -0.949 . . . . 86.58 111.426 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.9 mp0 -68.77 -43.82 74.96 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.555 -0.458 . . . . 63.48 111.664 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -74.63 -30.27 61.58 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 112.479 0.548 . . . . 58.02 112.479 -174.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -86.77 76.06 9.53 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.05 0.929 . . . . 35.85 109.975 -173.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.7 m -82.88 172.45 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.611 0 CA-C-N 115.683 -0.689 . . . . 34.28 109.744 -178.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -44.63 144.12 1.19 Allowed 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.384 0.611 . . . . 52.48 110.417 166.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 164.8 178.56 38.23 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.037 -1.078 . . . . 36.55 110.562 171.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 82.7 mt -99.9 125.9 53.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 107.537 -1.283 . . . . 45.2 107.537 170.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -117.18 152.46 34.73 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.038 0.447 . . . . 34.61 110.869 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -127.8 122.05 31.72 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.057 -1.46 . . . . 50.84 107.057 179.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 87.0 t -108.63 114.07 45.73 Favored 'Isoleucine or valine' 0 C--O 1.241 0.627 0 N-CA-C 106.643 -1.614 . . . . 36.28 106.643 175.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -105.57 114.68 29.0 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.308 -0.997 . . . . 57.2 108.308 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 73.4 mt -100.0 122.58 52.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 108.021 -1.103 . . . . 31.95 108.021 -176.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 58.9 t0 -80.29 75.73 7.09 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 122.969 1.366 . . . . 48.53 110.363 -175.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 59.0 p -71.43 -31.87 67.71 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-N 114.52 -1.218 . . . . 36.76 111.536 -178.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -61.55 -50.2 73.6 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 119.718 -0.793 . . . . 57.88 111.398 -177.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 74.8 m -60.27 -38.93 85.08 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.78 -0.768 . . . . 41.76 110.966 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -53.69 -55.4 26.44 Favored 'General case' 0 C--O 1.244 0.778 0 C-N-CA 119.941 -0.704 . . . . 36.31 110.898 178.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 75.3 m95 -68.81 -38.98 80.3 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 116.328 -0.396 . . . . 40.97 111.049 -174.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.0 mttm -62.08 -41.9 98.65 Favored 'General case' 0 C--N 1.346 0.424 0 C-N-CA 119.443 -0.903 . . . . 63.1 110.776 -178.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.29 -20.54 59.58 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 112.849 0.685 . . . . 51.19 112.849 175.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.4 mt -96.54 9.93 39.94 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 113.154 0.798 . . . . 52.28 113.154 174.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.76 16.16 77.91 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 115.626 1.01 . . . . 62.03 115.626 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 57.8 mt -112.42 134.94 53.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 118.481 1.141 . . . . 53.34 108.191 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.3 m -95.01 105.22 17.91 Favored Pre-proline 0 C--O 1.242 0.697 0 N-CA-C 107.866 -1.161 . . . . 55.58 107.866 173.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -85.29 173.03 8.0 Favored 'Trans proline' 0 C--N 1.327 -0.594 0 C-N-CA 120.694 0.929 . . . . 39.98 111.731 -173.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -80.74 -45.58 16.83 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 114.833 -1.076 . . . . 40.38 111.667 -178.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -88.76 147.7 24.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.015 0.912 . . . . 35.63 112.794 -171.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . 0.645 ' OE2' ' O ' ' A' ' 301' ' ' HOH . 54.5 mm-40 -70.18 -36.01 74.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.131 -1.028 . . . . 52.29 111.468 173.262 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HIS . . . . . 0.621 ' NE2' ' O ' ' B' ' 301' ' ' HOH . 4.1 p-80 -170.9 179.3 3.18 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 105.497 -2.038 . . . . 53.87 105.497 -176.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -125.73 119.97 29.38 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 107.214 -1.402 . . . . 37.29 107.214 171.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -106.11 137.43 44.05 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 124.288 1.035 . . . . 56.34 108.997 -177.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 77.2 t -127.87 120.74 54.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 105.883 -1.895 . . . . 38.47 105.883 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 66.0 t -123.06 129.78 74.83 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 108.95 -0.759 . . . . 37.94 108.95 -175.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -156.63 155.49 31.88 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 119.474 -0.891 . . . . 33.39 110.61 -173.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 68.1 m -87.03 129.6 34.82 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.097 -0.956 . . . . 38.58 108.482 172.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -114.0 143.37 44.86 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.316 -0.402 . . . . 36.32 110.831 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 71.19 18.82 5.65 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.543 1.537 . . . . 38.96 113.618 166.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -64.21 -27.48 69.09 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.314 -0.866 . . . . 74.8 112.357 -174.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.5 m -111.33 25.81 11.33 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.008 -0.433 . . . . 67.44 111.905 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 114.29 168.62 16.27 Favored Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 110.208 -1.157 . . . . 45.73 110.208 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -61.29 138.74 79.05 Favored 'Trans proline' 0 C--N 1.331 -0.362 0 CA-C-N 117.204 0.502 . . . . 48.13 111.693 -179.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 85.7 mmt-85 -129.6 168.15 16.86 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.146 -0.687 . . . . 59.75 109.146 170.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ARG . . . . . 0.419 ' NE ' ' HB3' ' A' ' 125' ' ' PRO . 99.8 mtt180 -105.98 134.02 49.77 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.578 -0.897 . . . . 84.43 108.578 167.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -121.44 127.06 50.74 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 109.366 -0.605 . . . . 39.03 109.366 -172.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 55.3 m -109.55 122.76 48.13 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 107.314 -1.365 . . . . 34.93 107.314 163.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 39.8 mm -100.66 115.13 41.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 106.825 -1.546 . . . . 33.84 106.825 172.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -114.3 143.44 44.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.038 -0.727 . . . . 32.79 109.038 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -133.81 138.25 45.56 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.617 -0.512 . . . . 29.39 109.617 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 57.7 tp -112.65 123.85 51.22 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.086 -1.45 . . . . 31.74 107.086 176.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 32.6 mt -108.98 134.75 51.22 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 113.796 1.036 . . . . 34.98 113.796 -168.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 43.9 m -128.49 162.15 52.68 Favored Pre-proline 0 C--O 1.239 0.543 0 N-CA-C 107.598 -1.26 . . . . 32.31 107.598 164.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -57.53 -35.58 98.81 Favored 'Trans proline' 0 C--O 1.247 0.974 0 N-CA-C 114.486 0.918 . . . . 34.8 114.486 -175.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 72.5 m -120.27 21.49 11.7 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 112.698 0.629 . . . . 36.38 112.698 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 26.3 t -161.26 152.15 18.33 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 118.833 -1.147 . . . . 36.76 108.08 -178.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -150.14 159.7 44.22 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 118.617 -1.233 . . . . 38.86 108.663 165.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' SER . . . . . 0.584 ' HB3' ' HB3' ' B' ' 117' ' ' SER . 42.8 p -128.85 155.6 44.96 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 106.513 -1.662 . . . . 43.09 106.513 172.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.0 t -139.3 146.39 40.28 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 119.022 -1.071 . . . . 32.8 109.424 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 5.1 t -141.44 168.48 19.68 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 118.173 -1.411 . . . . 33.75 109.043 174.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -123.27 136.11 54.55 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.802 -1.09 . . . . 33.71 108.476 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 29.0 t -115.91 113.68 43.98 Favored 'Isoleucine or valine' 0 C--O 1.243 0.758 0 N-CA-C 106.702 -1.592 . . . . 42.93 106.702 168.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 19.3 t -115.93 117.99 57.33 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 N-CA-C 107.144 -1.428 . . . . 41.7 107.144 -174.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 77.2 p -125.79 157.56 37.2 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.539 0.685 . . . . 53.39 109.549 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -103.34 105.02 44.55 Favored Pre-proline 0 C--O 1.237 0.445 0 CA-C-N 114.828 -1.078 . . . . 69.75 108.71 -176.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' PRO . . . . . 0.419 ' HB3' ' NE ' ' A' ' 104' ' ' ARG . 63.0 Cg_endo . . . . . 0 C--N 1.347 0.469 0 C-N-CA 123.309 2.673 . . . . 75.76 114.211 -171.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 m . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 120.696 0.284 . . . . 86.57 111.009 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -84.96 -5.11 9.72 Favored 'Trans proline' 0 C--O 1.239 0.557 0 O-C-N 123.052 1.027 . . . . 51.51 114.261 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 46.3 tp -147.2 120.18 8.77 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.324 -0.991 . . . . 45.95 108.324 -173.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' MET . . . . . 0.43 ' HG3' ' CD2' ' B' ' 56' ' ' HIS . 5.3 tmm? -136.06 148.96 48.56 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.827 -0.805 . . . . 69.62 108.827 -177.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 62.6 t -124.37 131.61 72.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.575 -0.898 . . . . 39.36 108.575 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -127.62 130.91 49.81 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.597 -1.261 . . . . 54.91 107.597 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 18.7 t -125.91 132.15 71.01 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 108.83 -0.804 . . . . 33.52 108.83 -176.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . 0.52 HD11 ' C3 ' ' B' ' 201' ' ' TCW . 76.1 mt -122.56 150.7 42.24 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.91 1.284 . . . . 44.56 108.931 -177.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -109.38 112.47 24.62 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 124.856 1.262 . . . . 36.99 107.986 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.29 -12.16 59.94 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 113.679 0.992 . . . . 32.27 113.679 -176.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 37.7 t -86.43 -47.69 16.16 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 CA-C-O 121.496 0.665 . . . . 38.11 110.366 179.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 85.6 mtp180 -84.53 -17.35 39.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.051 -0.977 . . . . 91.42 113.229 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.75 52.59 47.38 Favored Glycine 0 C--N 1.336 0.537 0 C-N-CA 120.347 -0.93 . . . . 38.34 112.929 -175.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 59.6 p -156.72 168.24 12.83 Favored Pre-proline 0 C--O 1.242 0.68 0 N-CA-C 108.329 -0.989 . . . . 47.18 108.329 -172.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -57.26 150.29 59.08 Favored 'Trans proline' 0 C--N 1.324 -0.747 0 N-CA-C 109.69 -0.927 . . . . 36.05 109.69 166.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -95.08 108.92 21.02 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 106.834 -1.543 . . . . 35.68 106.834 173.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 24.6 mt -98.22 139.71 19.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 123.516 0.726 . . . . 47.87 109.726 -167.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 57.6 m-20 65.75 34.87 7.17 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.538 0.685 . . . . 68.25 111.984 173.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' VAL . . . . . 0.422 HG22 ' CD1' ' B' ' 78' ' ' TYR . 58.1 t -86.75 124.93 40.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 108.204 -1.036 . . . . 37.82 108.204 172.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.04 136.53 45.01 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 120.609 -0.436 . . . . 38.49 111.114 175.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 66.0 t -133.09 127.91 55.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 124.769 1.228 . . . . 38.1 108.571 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -119.08 134.51 55.16 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 123.149 0.579 . . . . 49.44 110.111 175.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 22.3 t -115.39 136.71 51.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 108.166 -1.05 . . . . 44.9 108.166 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -126.99 153.16 46.26 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 124.218 1.007 . . . . 54.59 109.25 179.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ARG . . . . . . . . . . . . . 32.6 ttp85 -116.0 141.85 47.58 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.016 -0.735 . . . . 77.13 109.016 172.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -74.18 122.73 23.24 Favored 'General case' 0 C--O 1.21 -0.983 0 CA-C-O 118.388 -0.815 . . . . 74.63 109.315 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' ASP . . . -88.68 162.49 16.26 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 124.865 1.353 . . . . 77.66 110.374 178.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -46.85 -39.22 11.61 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.513 -0.767 . . . . 85.63 111.488 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.64 0.33 1.71 Allowed 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.3 0.64 . . . . 103.65 112.01 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' B' ' 36' ' ' ALA . 3.8 m-20 57.61 27.53 14.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.137 0.494 . . . . 99.92 110.978 -169.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.6 m -92.62 146.33 23.74 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 109.136 -0.69 . . . . 79.57 109.136 169.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 72.0 m95 -83.26 114.09 21.14 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.572 -0.899 . . . . 72.0 108.572 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -97.17 128.7 34.24 Favored Pre-proline 0 C--O 1.244 0.79 0 C-N-CA 125.393 1.477 . . . . 94.98 110.774 178.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -55.24 144.55 70.44 Favored 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 120.176 0.584 . . . . 68.81 111.197 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -133.16 -49.67 0.86 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.792 -0.64 . . . . 55.61 111.598 -172.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -160.69 164.85 31.37 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.507 -0.923 . . . . 48.19 108.507 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 86.3 p -163.48 166.84 22.25 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 120.34 -0.544 . . . . 41.54 109.558 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.3 -174.46 47.01 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 110.188 -1.165 . . . . 37.66 110.188 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -121.24 138.45 54.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.605 -0.887 . . . . 61.41 108.605 176.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 63.1 p -62.14 150.11 39.52 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 118.195 -1.402 . . . . 38.99 110.906 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 81.2 p -80.95 -172.75 3.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 122.181 0.991 . . . . 48.06 111.913 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -65.22 -20.49 66.46 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 121.808 -0.558 . . . . 96.41 112.189 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 98.4 p -91.33 6.7 44.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.812 0.278 . . . . 49.17 111.572 175.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.78 11.19 77.75 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-O 119.137 -0.813 . . . . 39.49 115.086 -175.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -106.43 147.64 29.06 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 118.844 1.322 . . . . 70.21 110.41 -175.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 21.2 tp -126.65 105.71 8.9 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 106.948 -1.501 . . . . 46.7 106.948 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' HIS . . . . . 0.43 ' CD2' ' HG3' ' B' ' 13' ' ' MET . 63.8 m80 -106.19 172.27 6.9 Favored 'General case' 0 N--CA 1.478 0.968 0 O-C-N 123.91 0.756 . . . . 67.32 110.597 -177.363 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLY . . . . . . . . . . . . . . . 64.17 32.76 85.26 Favored Glycine 0 CA--C 1.505 -0.582 0 C-N-CA 119.635 -1.269 . . . . 55.69 113.179 171.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 49.6 mt -73.22 -31.98 64.48 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 119.959 -0.697 . . . . 55.22 111.419 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' THR . . . . . . . . . . . . . 13.4 t -153.06 179.68 8.48 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 108.9 -0.778 . . . . 52.5 108.9 -174.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 5.0 p -118.32 165.78 13.43 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.403 -0.962 . . . . 66.47 108.403 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -67.09 -35.59 80.12 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 119.79 -0.764 . . . . 93.94 111.662 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -67.8 -38.03 82.78 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 119.621 -0.832 . . . . 77.49 111.34 178.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -79.36 -23.92 43.05 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 113.188 0.81 . . . . 85.36 113.188 -175.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -89.69 78.36 6.97 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 122.516 1.151 . . . . 55.18 109.101 -173.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.4 m -88.49 162.52 2.58 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.038 0 CA-C-N 115.477 -0.783 . . . . 50.65 109.46 -178.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -48.46 144.58 4.03 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.402 -0.817 . . . . 79.01 110.376 171.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.56 -175.22 36.46 Favored Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 109.906 -1.277 . . . . 43.1 109.906 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 28.7 mt -101.17 126.58 54.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 108.534 -0.914 . . . . 54.43 108.534 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -118.73 152.09 36.8 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.302 0.573 . . . . 48.08 110.722 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -124.22 124.34 42.22 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 107.558 -1.275 . . . . 62.02 107.558 179.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 88.4 t -109.01 118.23 56.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.072 -1.084 . . . . 42.63 108.072 173.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -107.09 117.87 35.2 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 110.095 -0.335 . . . . 79.62 110.095 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 62.7 mt -103.04 124.7 57.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 N-CA-C 107.985 -1.117 . . . . 37.99 107.985 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -83.45 75.81 9.97 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 122.722 1.249 . . . . 54.27 109.245 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 72.0 p -69.53 -31.8 70.23 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 114.607 -1.178 . . . . 37.63 111.828 -177.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -64.2 -44.71 91.11 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 119.627 -0.829 . . . . 70.16 110.906 -174.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 68.2 m -63.24 -39.43 94.59 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 120.843 -0.343 . . . . 42.28 111.525 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' TYR . . . . . 0.422 ' CD1' HG22 ' B' ' 28' ' ' VAL . 89.6 t80 -56.16 -53.83 52.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.007 0.432 . . . . 40.01 110.847 178.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 77.4 m95 -65.77 -42.06 91.28 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 120.237 -0.585 . . . . 46.59 110.808 -178.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -50.7 -50.83 54.23 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.542 -0.463 . . . . 70.48 111.236 174.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -59.78 -21.53 60.91 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.128 -0.629 . . . . 56.67 112.37 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 73.6 mt -96.47 1.54 51.65 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 118.167 0.439 . . . . 56.02 112.124 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 68.57 33.67 77.09 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 114.848 0.699 . . . . 55.94 114.848 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 54.3 mt -124.34 135.27 64.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 118.217 1.008 . . . . 51.78 108.709 -177.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 33.9 t -80.6 118.02 70.5 Favored Pre-proline 0 C--O 1.239 0.502 0 CA-C-N 116.165 -0.471 . . . . 56.73 110.4 -171.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -98.62 153.9 0.72 Allowed 'Trans proline' 0 CA--C 1.509 -0.748 0 CA-C-N 119.166 0.738 . . . . 41.75 112.427 -176.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -84.72 -45.39 12.47 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 113.451 0.908 . . . . 36.82 113.451 176.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -87.5 151.52 22.95 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-O 121.586 0.707 . . . . 34.48 111.634 -170.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -71.23 -35.41 71.46 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 115.276 -0.875 . . . . 57.27 111.63 172.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' HIS . . . . . 0.61 ' NE2' ' O ' ' B' ' 302' ' ' HOH . 7.8 p-80 -171.48 -178.89 2.43 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 105.894 -1.891 . . . . 46.74 105.894 -179.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -126.07 121.34 32.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.665 -1.235 . . . . 38.83 107.665 173.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLU . . . . . 0.721 ' OE2' ' O ' ' B' ' 301' ' ' HOH . 12.0 tt0 -108.65 137.92 45.81 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.352 0.408 . . . . 49.82 110.278 -179.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 60.7 t -126.41 120.8 57.37 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.388 0 N-CA-C 106.75 -1.574 . . . . 37.88 106.75 175.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 58.8 t -121.95 125.83 73.69 Favored 'Isoleucine or valine' 0 C--O 1.241 0.654 0 N-CA-C 108.934 -0.765 . . . . 43.29 108.934 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -150.84 162.65 40.36 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.34 0.59 . . . . 42.2 110.769 -173.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 97.0 m -100.58 127.96 46.79 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.569 -0.741 . . . . 45.14 109.81 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -87.37 138.46 31.47 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 123.612 0.57 . . . . 54.82 109.774 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 N--CA 1.48 1.03 0 C-N-CA 127.508 2.323 . . . . 90.27 116.206 -163.534 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 . . . . . 0 C--O 1.232 0.162 0 N-CA-C 109.789 -0.449 . . . . 101.58 109.789 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ARG . . . . . 0.726 ' NH1' ' HB3' ' B' ' 125' ' ' PRO . 37.5 mtm-85 -97.82 134.49 40.9 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.484 -0.562 . . . . 92.19 109.484 176.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -114.84 126.11 54.44 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.825 0.85 . . . . 58.53 110.245 -177.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 97.4 m -112.26 125.23 53.94 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.615 -0.883 . . . . 41.23 108.615 163.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 38.9 mm -101.79 112.16 33.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 105.09 -2.189 . . . . 41.38 105.09 173.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -108.87 143.3 38.27 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 109.517 -0.549 . . . . 33.91 109.517 -179.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -131.43 133.97 45.75 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.725 -0.67 . . . . 33.47 110.372 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 63.6 tp -111.48 120.7 43.02 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 106.902 -1.518 . . . . 36.38 106.902 176.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 30.8 mt -108.43 132.44 53.77 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.075 0.769 . . . . 33.1 113.075 -168.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 55.8 m -123.53 162.17 41.78 Favored Pre-proline 0 N--CA 1.452 -0.331 0 C-N-CA 124.826 1.25 . . . . 33.64 109.039 162.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -57.78 -34.41 98.19 Favored 'Trans proline' 0 C--O 1.244 0.801 0 N-CA-C 113.755 0.637 . . . . 32.59 113.755 -176.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' CYS . . . . . . . . . . . . . 96.8 m -119.42 16.85 13.01 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 113.031 0.752 . . . . 33.09 113.031 -177.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 42.7 t -158.2 149.65 21.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 107.946 -1.131 . . . . 34.87 107.946 -176.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -148.87 161.44 41.84 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.087 -1.045 . . . . 41.18 109.775 164.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' SER . . . . . 0.585 ' OG ' H20B ' B' ' 201' ' ' TCW . 79.5 p -133.71 154.77 50.7 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.367 -1.346 . . . . 39.12 107.367 174.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 10.1 t -143.93 146.21 32.8 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 118.396 -1.321 . . . . 34.38 107.452 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 10.5 t -142.81 162.36 35.67 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.232 -1.396 . . . . 34.14 107.232 177.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -103.75 133.16 49.2 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.933 -1.031 . . . . 38.32 109.078 174.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 21.7 t -121.04 102.75 12.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 N-CA-C 104.79 -2.3 . . . . 41.08 104.79 172.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.54 125.03 65.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 107.009 -1.478 . . . . 57.86 107.009 -176.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 56.9 p -131.24 158.87 39.42 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.503 0.668 . . . . 69.6 109.69 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -117.95 119.06 34.09 Favored Pre-proline 0 C--O 1.245 0.867 0 CA-C-N 115.502 -0.772 . . . . 104.83 109.543 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' PRO . . . . . 0.726 ' HB3' ' NH1' ' B' ' 104' ' ' ARG . 79.3 Cg_endo . . . . . 0 C--N 1.349 0.604 0 C-N-CA 124.609 3.539 . . . . 109.33 112.752 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' TCW . . . . . 0.451 ' C5 ' ' H15' ' A' ' 201' ' ' TCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 201' ' ' TCW . . . . . 0.585 H20B ' OG ' ' B' ' 117' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.645 ' O ' ' OE2' ' A' ' 89' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . 0.721 ' O ' ' OE2' ' B' ' 92' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . 0.61 ' O ' ' NE2' ' B' ' 90' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 40.7 t . . . . . 0 C--O 1.24 0.561 0 N-CA-C 106.563 -1.644 . . . . 72.49 106.563 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -89.97 -2.24 5.58 Favored 'Trans proline' 0 C--O 1.239 0.562 0 C-N-CA 121.303 1.335 . . . . 46.73 115.484 -171.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 49.4 tp -143.37 114.76 7.98 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.036 -1.468 . . . . 38.46 107.036 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . 0.46 ' HG3' ' CE1' ' A' ' 56' ' ' HIS . 6.6 tmm? -124.39 147.72 48.05 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.202 -1.036 . . . . 51.72 108.202 177.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 66.6 t -124.52 131.56 72.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 107.092 -1.447 . . . . 31.75 107.092 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -126.04 133.36 51.75 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.365 -0.606 . . . . 45.24 109.365 177.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 t -127.17 129.94 71.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 109.626 -0.509 . . . . 28.54 109.626 -176.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.4 mt -118.46 150.77 39.03 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.528 1.131 . . . . 36.76 109.412 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -106.82 113.87 27.62 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 125.479 1.512 . . . . 33.83 108.266 178.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.18 -9.58 59.72 Favored 'General case' 0 C--O 1.255 1.354 0 C-N-CA 124.11 0.964 . . . . 30.3 113.492 -176.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -86.95 -49.79 14.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-O 121.753 0.787 . . . . 44.21 111.042 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 85.6 mtp180 -86.35 -16.07 38.54 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 112.637 0.606 . . . . 75.8 112.637 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.67 56.08 14.68 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 119.788 -1.196 . . . . 34.0 112.407 -176.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.2 p -157.09 169.08 11.21 Favored Pre-proline 0 C--O 1.248 1.006 0 N-CA-C 107.441 -1.318 . . . . 40.99 107.441 -168.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.15 149.27 90.02 Favored 'Trans proline' 0 C--O 1.236 0.402 0 N-CA-C 109.955 -0.825 . . . . 38.57 109.955 165.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.08 108.96 20.32 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 106.914 -1.513 . . . . 32.96 106.914 172.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 67.3 mt -96.14 140.93 16.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 109.221 -0.659 . . . . 43.67 109.221 -166.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.608 ' OD1' ' HD3' ' A' ' 48' ' ' LYS . 44.4 t30 66.49 35.27 5.62 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.29 -0.414 . . . . 63.09 111.939 172.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.6 t -88.0 127.73 40.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.682 0 N-CA-C 107.776 -1.194 . . . . 32.44 107.776 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.33 137.26 37.96 Favored 'General case' 0 C--O 1.241 0.608 0 C-N-CA 119.053 -1.059 . . . . 28.89 109.565 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 99.3 t -129.7 128.49 65.61 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.256 0 N-CA-C 107.647 -1.242 . . . . 30.15 107.647 -179.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.0 m-70 -119.24 133.05 55.97 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 122.971 0.508 . . . . 39.25 109.779 175.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.46 134.56 59.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 N-CA-C 109.052 -0.721 . . . . 32.71 109.052 -176.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -127.18 157.25 40.25 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.66 0.743 . . . . 41.35 109.535 -179.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 77.1 ttt-85 -128.01 135.26 49.65 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.403 -0.962 . . . . 53.54 108.403 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.2 ttpt -73.73 125.42 28.05 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 118.49 -1.284 . . . . 66.74 109.92 -176.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.595 ' HB2' ' HG3' ' A' ' 42' ' ' GLU . . . -86.88 170.54 11.57 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 122.19 0.995 . . . . 48.72 111.557 -176.106 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.49 -41.73 53.69 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.822 -1.081 . . . . 51.26 112.048 176.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 39' ' ' ASP . 38.6 p30 -80.06 11.13 3.61 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.153 0.797 . . . . 67.14 113.153 -177.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 31.5 m-20 72.39 7.59 5.67 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.401 1.08 . . . . 89.19 113.722 179.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 39.2 p -87.73 162.41 17.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 119.251 0.932 . . . . 57.21 110.188 171.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -87.74 119.48 28.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.143 -0.935 . . . . 61.14 109.176 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.595 ' HG3' ' HB2' ' A' ' 36' ' ' ALA . 10.2 mm-40 -104.79 139.82 20.47 Favored Pre-proline 0 C--N 1.314 -0.974 0 C-N-CA 118.544 -1.262 . . . . 82.85 111.533 175.303 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -58.44 133.77 56.86 Favored 'Trans proline' 0 N--CA 1.475 0.397 0 C-N-CA 120.496 0.797 . . . . 45.47 110.824 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -116.56 -46.34 2.77 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.84 0.682 . . . . 40.03 112.84 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -169.36 156.3 6.77 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.355 -1.35 . . . . 36.76 107.355 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 82.7 p -150.38 168.41 24.21 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 118.791 -1.164 . . . . 37.17 110.98 172.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.25 -174.04 44.18 Favored Glycine 0 C--N 1.34 0.771 0 CA-C-N 115.078 -0.965 . . . . 32.15 111.698 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.608 ' HD3' ' OD1' ' A' ' 27' ' ' ASN . 9.6 mttp -125.12 144.03 50.63 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.592 -0.892 . . . . 59.07 108.592 178.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.8 p -68.11 150.94 47.76 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 116.581 -2.048 . . . . 31.95 111.207 174.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.6 p -86.66 -171.77 3.69 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.977 0.894 . . . . 39.06 111.236 -178.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -61.91 -22.49 65.62 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-N 115.907 -0.588 . . . . 106.88 112.313 177.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.9 p -91.24 3.89 53.68 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.221 0.823 . . . . 39.93 113.221 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.82 7.04 87.43 Favored Glycine 0 C--N 1.338 0.677 0 N-CA-C 114.709 0.644 . . . . 33.9 114.709 -173.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -105.9 149.65 26.36 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 118.452 1.126 . . . . 65.14 110.989 -173.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.9 tp -127.37 107.73 10.23 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 106.542 -1.651 . . . . 32.47 106.542 177.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.46 ' CE1' ' HG3' ' A' ' 13' ' ' MET . 93.3 m-70 -109.32 165.39 11.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.753 0.787 . . . . 52.42 109.873 179.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.49 15.53 80.74 Favored Glycine 0 C--O 1.244 0.752 0 C-N-CA 118.736 -1.697 . . . . 38.65 114.903 171.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.8 mt -63.2 -39.17 93.86 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 118.344 1.072 . . . . 37.51 111.051 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.9 t -150.23 -173.95 4.59 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 119.836 -0.746 . . . . 41.04 109.654 -172.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 65.1 p -130.42 165.9 21.61 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 124.899 1.279 . . . . 42.81 109.984 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -61.46 -37.7 84.53 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 115.113 -0.949 . . . . 86.58 111.426 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.9 mp0 -68.77 -43.82 74.96 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.555 -0.458 . . . . 63.48 111.664 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -74.63 -30.27 61.58 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 112.479 0.548 . . . . 58.02 112.479 -174.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -86.77 76.06 9.53 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.05 0.929 . . . . 35.85 109.975 -173.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.7 m -82.88 172.45 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.611 0 CA-C-N 115.683 -0.689 . . . . 34.28 109.744 -178.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -44.63 144.12 1.19 Allowed 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.384 0.611 . . . . 52.48 110.417 166.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 164.8 178.56 38.23 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.037 -1.078 . . . . 36.55 110.562 171.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 82.7 mt -99.9 125.9 53.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 107.537 -1.283 . . . . 45.2 107.537 170.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -117.18 152.46 34.73 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.038 0.447 . . . . 34.61 110.869 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -127.8 122.05 31.72 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.057 -1.46 . . . . 50.84 107.057 179.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 87.0 t -108.63 114.07 45.73 Favored 'Isoleucine or valine' 0 C--O 1.241 0.627 0 N-CA-C 106.643 -1.614 . . . . 36.28 106.643 175.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -105.57 114.68 29.0 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.308 -0.997 . . . . 57.2 108.308 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 73.4 mt -100.0 122.58 52.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 108.021 -1.103 . . . . 31.95 108.021 -176.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 58.9 t0 -80.29 75.73 7.09 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 122.969 1.366 . . . . 48.53 110.363 -175.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 59.0 p -71.43 -31.87 67.71 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-N 114.52 -1.218 . . . . 36.76 111.536 -178.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -61.55 -50.2 73.6 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 119.718 -0.793 . . . . 57.88 111.398 -177.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 74.8 m -60.27 -38.93 85.08 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.78 -0.768 . . . . 41.76 110.966 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -53.69 -55.4 26.44 Favored 'General case' 0 C--O 1.244 0.778 0 C-N-CA 119.941 -0.704 . . . . 36.31 110.898 178.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 75.3 m95 -68.81 -38.98 80.3 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 116.328 -0.396 . . . . 40.97 111.049 -174.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.0 mttm -62.08 -41.9 98.65 Favored 'General case' 0 C--N 1.346 0.424 0 C-N-CA 119.443 -0.903 . . . . 63.1 110.776 -178.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.29 -20.54 59.58 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 112.849 0.685 . . . . 51.19 112.849 175.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.4 mt -96.54 9.93 39.94 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 113.154 0.798 . . . . 52.28 113.154 174.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.76 16.16 77.91 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 115.626 1.01 . . . . 62.03 115.626 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 57.8 mt -112.42 134.94 53.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 118.481 1.141 . . . . 53.34 108.191 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.3 m -95.01 105.22 17.91 Favored Pre-proline 0 C--O 1.242 0.697 0 N-CA-C 107.866 -1.161 . . . . 55.58 107.866 173.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -85.29 173.03 8.0 Favored 'Trans proline' 0 C--N 1.327 -0.594 0 C-N-CA 120.694 0.929 . . . . 39.98 111.731 -173.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -80.74 -45.58 16.83 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 114.833 -1.076 . . . . 40.38 111.667 -178.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -88.76 147.7 24.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.015 0.912 . . . . 35.63 112.794 -171.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.645 ' OE2' ' O ' ' A' ' 301' ' ' HOH . 54.5 mm-40 -70.18 -36.01 74.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.131 -1.028 . . . . 52.29 111.468 173.262 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.621 ' NE2' ' O ' ' B' ' 301' ' ' HOH . 4.1 p-80 -170.9 179.3 3.18 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 105.497 -2.038 . . . . 53.87 105.497 -176.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -125.73 119.97 29.38 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 107.214 -1.402 . . . . 37.29 107.214 171.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -106.11 137.43 44.05 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 124.288 1.035 . . . . 56.34 108.997 -177.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 77.2 t -127.87 120.74 54.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 105.883 -1.895 . . . . 38.47 105.883 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 66.0 t -123.06 129.78 74.83 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 108.95 -0.759 . . . . 37.94 108.95 -175.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -156.63 155.49 31.88 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 119.474 -0.891 . . . . 33.39 110.61 -173.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 68.1 m -87.03 129.6 34.82 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.097 -0.956 . . . . 38.58 108.482 172.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -114.0 143.37 44.86 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.316 -0.402 . . . . 36.32 110.831 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 71.19 18.82 5.65 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.543 1.537 . . . . 38.96 113.618 166.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -64.21 -27.48 69.09 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.314 -0.866 . . . . 74.8 112.357 -174.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.5 m -111.33 25.81 11.33 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.008 -0.433 . . . . 67.44 111.905 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 114.29 168.62 16.27 Favored Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 110.208 -1.157 . . . . 45.73 110.208 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -61.29 138.74 79.05 Favored 'Trans proline' 0 C--N 1.331 -0.362 0 CA-C-N 117.204 0.502 . . . . 48.13 111.693 -179.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 85.7 mmt-85 -129.6 168.15 16.86 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.146 -0.687 . . . . 59.75 109.146 170.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.419 ' NE ' ' HB3' ' A' ' 125' ' ' PRO . 99.8 mtt180 -105.98 134.02 49.77 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.578 -0.897 . . . . 84.43 108.578 167.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -121.44 127.06 50.74 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 109.366 -0.605 . . . . 39.03 109.366 -172.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 55.3 m -109.55 122.76 48.13 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 107.314 -1.365 . . . . 34.93 107.314 163.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 39.8 mm -100.66 115.13 41.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 106.825 -1.546 . . . . 33.84 106.825 172.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -114.3 143.44 44.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.038 -0.727 . . . . 32.79 109.038 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -133.81 138.25 45.56 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.617 -0.512 . . . . 29.39 109.617 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 57.7 tp -112.65 123.85 51.22 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.086 -1.45 . . . . 31.74 107.086 176.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 32.6 mt -108.98 134.75 51.22 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 113.796 1.036 . . . . 34.98 113.796 -168.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 43.9 m -128.49 162.15 52.68 Favored Pre-proline 0 C--O 1.239 0.543 0 N-CA-C 107.598 -1.26 . . . . 32.31 107.598 164.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -57.53 -35.58 98.81 Favored 'Trans proline' 0 C--O 1.247 0.974 0 N-CA-C 114.486 0.918 . . . . 34.8 114.486 -175.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 72.5 m -120.27 21.49 11.7 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 112.698 0.629 . . . . 36.38 112.698 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 26.3 t -161.26 152.15 18.33 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 118.833 -1.147 . . . . 36.76 108.08 -178.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -150.14 159.7 44.22 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 118.617 -1.233 . . . . 38.86 108.663 165.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' SER . . . . . 0.584 ' HB3' ' HB3' ' B' ' 117' ' ' SER . 42.8 p -128.85 155.6 44.96 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 106.513 -1.662 . . . . 43.09 106.513 172.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.0 t -139.3 146.39 40.28 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 119.022 -1.071 . . . . 32.8 109.424 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 5.1 t -141.44 168.48 19.68 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 118.173 -1.411 . . . . 33.75 109.043 174.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -123.27 136.11 54.55 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.802 -1.09 . . . . 33.71 108.476 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 29.0 t -115.91 113.68 43.98 Favored 'Isoleucine or valine' 0 C--O 1.243 0.758 0 N-CA-C 106.702 -1.592 . . . . 42.93 106.702 168.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 19.3 t -115.93 117.99 57.33 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 N-CA-C 107.144 -1.428 . . . . 41.7 107.144 -174.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 77.2 p -125.79 157.56 37.2 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.539 0.685 . . . . 53.39 109.549 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -103.34 105.02 44.55 Favored Pre-proline 0 C--O 1.237 0.445 0 CA-C-N 114.828 -1.078 . . . . 69.75 108.71 -176.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.419 ' HB3' ' NE ' ' A' ' 104' ' ' ARG . 63.0 Cg_endo . . . . . 0 C--N 1.347 0.469 0 C-N-CA 123.309 2.673 . . . . 75.76 114.211 -171.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 m . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 120.696 0.284 . . . . 86.57 111.009 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -84.96 -5.11 9.72 Favored 'Trans proline' 0 C--O 1.239 0.557 0 O-C-N 123.052 1.027 . . . . 51.51 114.261 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 46.3 tp -147.2 120.18 8.77 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.324 -0.991 . . . . 45.95 108.324 -173.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' MET . . . . . 0.43 ' HG3' ' CD2' ' B' ' 56' ' ' HIS . 5.3 tmm? -136.06 148.96 48.56 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.827 -0.805 . . . . 69.62 108.827 -177.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 62.6 t -124.37 131.61 72.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.575 -0.898 . . . . 39.36 108.575 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -127.62 130.91 49.81 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.597 -1.261 . . . . 54.91 107.597 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 18.7 t -125.91 132.15 71.01 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 108.83 -0.804 . . . . 33.52 108.83 -176.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.52 HD11 ' C3 ' ' B' ' 201' ' ' TCW . 76.1 mt -122.56 150.7 42.24 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.91 1.284 . . . . 44.56 108.931 -177.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -109.38 112.47 24.62 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 124.856 1.262 . . . . 36.99 107.986 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.29 -12.16 59.94 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 113.679 0.992 . . . . 32.27 113.679 -176.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 37.7 t -86.43 -47.69 16.16 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 CA-C-O 121.496 0.665 . . . . 38.11 110.366 179.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 85.6 mtp180 -84.53 -17.35 39.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.051 -0.977 . . . . 91.42 113.229 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.75 52.59 47.38 Favored Glycine 0 C--N 1.336 0.537 0 C-N-CA 120.347 -0.93 . . . . 38.34 112.929 -175.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 59.6 p -156.72 168.24 12.83 Favored Pre-proline 0 C--O 1.242 0.68 0 N-CA-C 108.329 -0.989 . . . . 47.18 108.329 -172.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -57.26 150.29 59.08 Favored 'Trans proline' 0 C--N 1.324 -0.747 0 N-CA-C 109.69 -0.927 . . . . 36.05 109.69 166.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -95.08 108.92 21.02 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 106.834 -1.543 . . . . 35.68 106.834 173.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 24.6 mt -98.22 139.71 19.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 123.516 0.726 . . . . 47.87 109.726 -167.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 57.6 m-20 65.75 34.87 7.17 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.538 0.685 . . . . 68.25 111.984 173.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.422 HG22 ' CD1' ' B' ' 78' ' ' TYR . 58.1 t -86.75 124.93 40.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 108.204 -1.036 . . . . 37.82 108.204 172.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.04 136.53 45.01 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 120.609 -0.436 . . . . 38.49 111.114 175.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 66.0 t -133.09 127.91 55.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 124.769 1.228 . . . . 38.1 108.571 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -119.08 134.51 55.16 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 123.149 0.579 . . . . 49.44 110.111 175.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 22.3 t -115.39 136.71 51.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 108.166 -1.05 . . . . 44.9 108.166 178.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -126.99 153.16 46.26 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 124.218 1.007 . . . . 54.59 109.25 179.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ARG . . . . . . . . . . . . . 32.6 ttp85 -116.0 141.85 47.58 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.016 -0.735 . . . . 77.13 109.016 172.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -74.18 122.73 23.24 Favored 'General case' 0 C--O 1.21 -0.983 0 CA-C-O 118.388 -0.815 . . . . 74.63 109.315 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' ASP . . . -88.68 162.49 16.26 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 124.865 1.353 . . . . 77.66 110.374 178.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -46.85 -39.22 11.61 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.513 -0.767 . . . . 85.63 111.488 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.64 0.33 1.71 Allowed 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.3 0.64 . . . . 103.65 112.01 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' B' ' 36' ' ' ALA . 3.8 m-20 57.61 27.53 14.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.137 0.494 . . . . 99.92 110.978 -169.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.6 m -92.62 146.33 23.74 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 109.136 -0.69 . . . . 79.57 109.136 169.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 72.0 m95 -83.26 114.09 21.14 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.572 -0.899 . . . . 72.0 108.572 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -97.17 128.7 34.24 Favored Pre-proline 0 C--O 1.244 0.79 0 C-N-CA 125.393 1.477 . . . . 94.98 110.774 178.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -55.24 144.55 70.44 Favored 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 120.176 0.584 . . . . 68.81 111.197 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -133.16 -49.67 0.86 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.792 -0.64 . . . . 55.61 111.598 -172.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -160.69 164.85 31.37 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.507 -0.923 . . . . 48.19 108.507 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 86.3 p -163.48 166.84 22.25 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 120.34 -0.544 . . . . 41.54 109.558 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.3 -174.46 47.01 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 110.188 -1.165 . . . . 37.66 110.188 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -121.24 138.45 54.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.605 -0.887 . . . . 61.41 108.605 176.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 63.1 p -62.14 150.11 39.52 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 118.195 -1.402 . . . . 38.99 110.906 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 81.2 p -80.95 -172.75 3.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 122.181 0.991 . . . . 48.06 111.913 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -65.22 -20.49 66.46 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 121.808 -0.558 . . . . 96.41 112.189 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 98.4 p -91.33 6.7 44.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.812 0.278 . . . . 49.17 111.572 175.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.78 11.19 77.75 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-O 119.137 -0.813 . . . . 39.49 115.086 -175.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -106.43 147.64 29.06 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 118.844 1.322 . . . . 70.21 110.41 -175.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 21.2 tp -126.65 105.71 8.9 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 106.948 -1.501 . . . . 46.7 106.948 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' HIS . . . . . 0.43 ' CD2' ' HG3' ' B' ' 13' ' ' MET . 63.8 m80 -106.19 172.27 6.9 Favored 'General case' 0 N--CA 1.478 0.968 0 O-C-N 123.91 0.756 . . . . 67.32 110.597 -177.363 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLY . . . . . . . . . . . . . . . 64.17 32.76 85.26 Favored Glycine 0 CA--C 1.505 -0.582 0 C-N-CA 119.635 -1.269 . . . . 55.69 113.179 171.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 49.6 mt -73.22 -31.98 64.48 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 119.959 -0.697 . . . . 55.22 111.419 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' THR . . . . . . . . . . . . . 13.4 t -153.06 179.68 8.48 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 108.9 -0.778 . . . . 52.5 108.9 -174.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 5.0 p -118.32 165.78 13.43 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.403 -0.962 . . . . 66.47 108.403 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -67.09 -35.59 80.12 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 119.79 -0.764 . . . . 93.94 111.662 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -67.8 -38.03 82.78 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 119.621 -0.832 . . . . 77.49 111.34 178.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -79.36 -23.92 43.05 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 113.188 0.81 . . . . 85.36 113.188 -175.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -89.69 78.36 6.97 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 122.516 1.151 . . . . 55.18 109.101 -173.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.4 m -88.49 162.52 2.58 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.038 0 CA-C-N 115.477 -0.783 . . . . 50.65 109.46 -178.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -48.46 144.58 4.03 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.402 -0.817 . . . . 79.01 110.376 171.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.56 -175.22 36.46 Favored Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 109.906 -1.277 . . . . 43.1 109.906 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 28.7 mt -101.17 126.58 54.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 108.534 -0.914 . . . . 54.43 108.534 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -118.73 152.09 36.8 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.302 0.573 . . . . 48.08 110.722 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -124.22 124.34 42.22 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 107.558 -1.275 . . . . 62.02 107.558 179.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 88.4 t -109.01 118.23 56.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.072 -1.084 . . . . 42.63 108.072 173.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -107.09 117.87 35.2 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 110.095 -0.335 . . . . 79.62 110.095 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 62.7 mt -103.04 124.7 57.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 N-CA-C 107.985 -1.117 . . . . 37.99 107.985 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -83.45 75.81 9.97 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 122.722 1.249 . . . . 54.27 109.245 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 72.0 p -69.53 -31.8 70.23 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 114.607 -1.178 . . . . 37.63 111.828 -177.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -64.2 -44.71 91.11 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 119.627 -0.829 . . . . 70.16 110.906 -174.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 68.2 m -63.24 -39.43 94.59 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 120.843 -0.343 . . . . 42.28 111.525 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' TYR . . . . . 0.422 ' CD1' HG22 ' B' ' 28' ' ' VAL . 89.6 t80 -56.16 -53.83 52.4 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.007 0.432 . . . . 40.01 110.847 178.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 77.4 m95 -65.77 -42.06 91.28 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 120.237 -0.585 . . . . 46.59 110.808 -178.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -50.7 -50.83 54.23 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.542 -0.463 . . . . 70.48 111.236 174.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -59.78 -21.53 60.91 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.128 -0.629 . . . . 56.67 112.37 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 73.6 mt -96.47 1.54 51.65 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 118.167 0.439 . . . . 56.02 112.124 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 68.57 33.67 77.09 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 114.848 0.699 . . . . 55.94 114.848 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 54.3 mt -124.34 135.27 64.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 118.217 1.008 . . . . 51.78 108.709 -177.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 33.9 t -80.6 118.02 70.5 Favored Pre-proline 0 C--O 1.239 0.502 0 CA-C-N 116.165 -0.471 . . . . 56.73 110.4 -171.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -98.62 153.9 0.72 Allowed 'Trans proline' 0 CA--C 1.509 -0.748 0 CA-C-N 119.166 0.738 . . . . 41.75 112.427 -176.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -84.72 -45.39 12.47 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 113.451 0.908 . . . . 36.82 113.451 176.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -87.5 151.52 22.95 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-O 121.586 0.707 . . . . 34.48 111.634 -170.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -71.23 -35.41 71.46 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 115.276 -0.875 . . . . 57.27 111.63 172.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' HIS . . . . . 0.61 ' NE2' ' O ' ' B' ' 302' ' ' HOH . 7.8 p-80 -171.48 -178.89 2.43 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 105.894 -1.891 . . . . 46.74 105.894 -179.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -126.07 121.34 32.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.665 -1.235 . . . . 38.83 107.665 173.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLU . . . . . 0.721 ' OE2' ' O ' ' B' ' 301' ' ' HOH . 12.0 tt0 -108.65 137.92 45.81 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.352 0.408 . . . . 49.82 110.278 -179.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 60.7 t -126.41 120.8 57.37 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.388 0 N-CA-C 106.75 -1.574 . . . . 37.88 106.75 175.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 58.8 t -121.95 125.83 73.69 Favored 'Isoleucine or valine' 0 C--O 1.241 0.654 0 N-CA-C 108.934 -0.765 . . . . 43.29 108.934 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -150.84 162.65 40.36 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.34 0.59 . . . . 42.2 110.769 -173.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 97.0 m -100.58 127.96 46.79 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.569 -0.741 . . . . 45.14 109.81 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -87.37 138.46 31.47 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 123.612 0.57 . . . . 54.82 109.774 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 N--CA 1.48 1.03 0 C-N-CA 127.508 2.323 . . . . 90.27 116.206 -163.534 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 . . . . . 0 C--O 1.232 0.162 0 N-CA-C 109.789 -0.449 . . . . 101.58 109.789 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.726 ' NH1' ' HB3' ' B' ' 125' ' ' PRO . 37.5 mtm-85 -97.82 134.49 40.9 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.484 -0.562 . . . . 92.19 109.484 176.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -114.84 126.11 54.44 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.825 0.85 . . . . 58.53 110.245 -177.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 97.4 m -112.26 125.23 53.94 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.615 -0.883 . . . . 41.23 108.615 163.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 38.9 mm -101.79 112.16 33.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 105.09 -2.189 . . . . 41.38 105.09 173.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -108.87 143.3 38.27 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 109.517 -0.549 . . . . 33.91 109.517 -179.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -131.43 133.97 45.75 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.725 -0.67 . . . . 33.47 110.372 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 63.6 tp -111.48 120.7 43.02 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 106.902 -1.518 . . . . 36.38 106.902 176.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 30.8 mt -108.43 132.44 53.77 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.075 0.769 . . . . 33.1 113.075 -168.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 55.8 m -123.53 162.17 41.78 Favored Pre-proline 0 N--CA 1.452 -0.331 0 C-N-CA 124.826 1.25 . . . . 33.64 109.039 162.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -57.78 -34.41 98.19 Favored 'Trans proline' 0 C--O 1.244 0.801 0 N-CA-C 113.755 0.637 . . . . 32.59 113.755 -176.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' CYS . . . . . . . . . . . . . 96.8 m -119.42 16.85 13.01 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 113.031 0.752 . . . . 33.09 113.031 -177.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 42.7 t -158.2 149.65 21.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 107.946 -1.131 . . . . 34.87 107.946 -176.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -148.87 161.44 41.84 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.087 -1.045 . . . . 41.18 109.775 164.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' SER . . . . . 0.585 ' OG ' H20B ' B' ' 201' ' ' TCW . 79.5 p -133.71 154.77 50.7 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.367 -1.346 . . . . 39.12 107.367 174.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 10.1 t -143.93 146.21 32.8 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 118.396 -1.321 . . . . 34.38 107.452 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 10.5 t -142.81 162.36 35.67 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.232 -1.396 . . . . 34.14 107.232 177.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -103.75 133.16 49.2 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.933 -1.031 . . . . 38.32 109.078 174.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 21.7 t -121.04 102.75 12.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 N-CA-C 104.79 -2.3 . . . . 41.08 104.79 172.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.54 125.03 65.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 107.009 -1.478 . . . . 57.86 107.009 -176.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 56.9 p -131.24 158.87 39.42 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.503 0.668 . . . . 69.6 109.69 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -117.95 119.06 34.09 Favored Pre-proline 0 C--O 1.245 0.867 0 CA-C-N 115.502 -0.772 . . . . 104.83 109.543 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' PRO . . . . . 0.726 ' HB3' ' NH1' ' B' ' 104' ' ' ARG . 79.3 Cg_endo . . . . . 0 C--N 1.349 0.604 0 C-N-CA 124.609 3.539 . . . . 109.33 112.752 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' TCW . . . . . 0.451 ' C5 ' ' H15' ' A' ' 201' ' ' TCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' TCW . . . . . 0.585 H20B ' OG ' ' B' ' 117' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.645 ' O ' ' OE2' ' A' ' 89' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . 0.721 ' O ' ' OE2' ' B' ' 92' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . 0.61 ' O ' ' NE2' ' B' ' 90' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_