data_1btg_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1btg _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.202 0 N-CA-C 110.691 -0.964 . . . . 80.0 110.691 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.313 4.0 mm-40 -82.71 138.77 33.98 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 114.754 1.39 . . . . 80.0 114.754 -178.52 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -50.62 123.67 9.33 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 113.267 -1.788 . . . . 63.990000000000002 107.61 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 t -128.83 172.49 11.25 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.238 1.199 . . . . 45.689999999999998 114.238 -174.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 28.3 m -73.35 -9.83 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 C-N-CA 120.159 -0.617 . . . . 19.91 111.454 173.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.0 m -141.9 130.68 22.87 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.361 1.064 . . . . 24.550000000000001 112.816 178.261 -64.442 -76.382 -85.511 103.511 1.99 105.504 -87.576 -60.194 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -86.89 128.55 35.06 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 123.007 1.384 . . . . 34.960000000000001 114.04 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.8 p -123.24 170.19 10.52 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 120.149 -1.594 . . . . 32.950000000000003 114.277 -175.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 4.0 p -139.85 128.46 26.96 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.51 -0.922 . . . . 42.310000000000002 108.51 -178.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . 0.444 ' OG ' ' OG1' ' A' ' 56' ' ' THR . 19.1 m -118.15 148.74 42.04 Favored 'General case' 0 CA--C 1.484 -1.583 0 CA-C-O 122.337 1.065 . . . . 23.699999999999999 112.389 -177.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.1 p -163.78 159.28 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.285 -2.217 0 C-N-CA 115.812 -2.355 . . . . 61.159999999999997 109.747 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -93.18 122.72 35.86 Favored 'General case' 0 C--N 1.347 0.487 0 O-C-N 123.831 0.707 . . . . 21.640000000000001 109.402 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.0 m -110.77 120.89 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.452 0 C-N-CA 123.113 0.565 . . . . 18.120000000000001 110.864 177.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -111.66 9.94 27.99 Favored Glycine 0 CA--C 1.523 0.576 0 CA-C-O 121.561 0.534 . . . . 28.539999999999999 112.818 -177.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -128.74 19.12 6.16 Favored 'General case' 0 C--O 1.209 -1.062 0 N-CA-C 114.758 1.392 . . . . 52.890000000000001 114.758 -179.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.9 ttmm -55.64 135.33 51.26 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 106.324 -1.732 . . . . 75.239999999999995 106.324 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 76.9 p -124.36 -23.73 4.42 Favored 'General case' 0 CA--C 1.48 -1.738 0 C-N-CA 116.997 -1.881 . . . . 25.829999999999998 107.559 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . 0.317 0.6 OUTLIER -122.81 145.2 48.64 Favored 'General case' 0 N--CA 1.419 -2.009 0 C-N-CA 114.222 -2.991 . . . . 31.489999999999998 111.703 -175.977 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -162.59 172.65 15.07 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 118.603 -1.239 . . . . 21.600000000000001 112.829 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 87.3 m -113.32 122.84 48.61 Favored 'General case' 0 C--O 1.245 0.839 0 O-C-N 125.386 1.679 . . . . 36.840000000000003 109.211 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -73.55 176.18 6.38 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 114.659 -1.155 . . . . 29.739999999999998 108.412 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . 0.401 ' CG2' ' N ' ' A' ' 32' ' ' LYS . 10.2 tt -60.34 -30.57 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.554 0 O-C-N 124.342 1.026 . . . . 36.530000000000001 113.27 -178.493 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . 0.401 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 3.7 mtpt -80.57 -3.19 49.35 Favored 'General case' 0 CA--C 1.494 -1.178 0 O-C-N 123.545 0.528 . . . . 80.0 111.197 -179.761 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.66 6.8 76.27 Favored Glycine 0 CA--C 1.541 1.672 0 CA-C-O 122.481 1.045 . . . . 33.200000000000003 114.368 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.5 mtmp? -90.64 139.46 30.69 Favored 'General case' 0 N--CA 1.419 -1.979 0 O-C-N 121.951 -0.735 . . . . 80.0 109.653 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.07 145.78 42.04 Favored 'General case' 0 C--O 1.196 -1.743 0 O-C-N 121.61 -0.681 . . . . 80.0 112.51 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 26.3 m -147.34 167.56 5.29 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 C-N-CA 118.857 -1.137 . . . . 21.16 110.024 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 45.7 m -100.67 137.64 38.8 Favored 'General case' 0 N--CA 1.425 -1.707 0 CA-C-O 122.33 1.062 . . . . 22.010000000000002 110.493 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.0 t -93.81 116.59 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.202 0 CA-C-N 115.152 -0.931 . . . . 19.0 112.678 179.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . 0.42 ' O ' ' NE2' ' A' ' 51' ' ' GLN 0.293 10.4 mp -56.95 135.38 56.11 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 122.59 1.186 . . . . 26.550000000000001 112.282 178.306 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.58 -35.68 67.99 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 115.448 1.647 . . . . 38.770000000000003 115.448 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -123.89 132.94 53.83 Favored 'General case' 0 CA--C 1.481 -1.699 0 N-CA-C 107.172 -1.418 . . . . 80.0 107.172 -176.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . 0.558 ' O ' ' N ' ' A' ' 49' ' ' PHE . 12.0 p -112.03 138.59 40.28 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.118 0 C-N-CA 116.93 -1.908 . . . . 62.149999999999999 107.35 175.876 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . 0.691 ' ND2' ' N ' ' A' ' 47' ' ' SER . 2.1 t-20 -112.92 106.1 14.31 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 123.369 1.556 . . . . 80.0 114.67 -179.222 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . 0.655 ' N ' ' O ' ' A' ' 47' ' ' SER . 1.5 mm -106.45 125.07 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 118.574 -1.251 . . . . 72.090000000000003 112.455 180.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 51.1 m-20 51.8 42.67 30.14 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 122.159 0.981 . . . . 80.0 111.143 179.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 66.49 25.42 10.16 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 122.368 1.08 . . . . 80.0 112.972 179.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' SER . . . . . 0.691 ' N ' ' ND2' ' A' ' 43' ' ' ASN . 0.3 OUTLIER -125.52 129.98 50.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 112.69 -2.05 . . . . 80.0 106.18 175.402 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -109.25 132.26 57.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 113.616 0.969 . . . . 54.659999999999997 113.616 -177.689 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . 0.558 ' N ' ' O ' ' A' ' 42' ' ' VAL . 0.1 OUTLIER -133.77 159.58 40.16 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 114.609 1.337 . . . . 75.170000000000002 114.609 -179.445 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -79.03 148.21 32.58 Favored 'General case' 0 C--N 1.354 0.785 0 CA-C-N 114.546 -1.207 . . . . 80.0 109.711 176.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLN . . . . . 0.42 ' NE2' ' O ' ' A' ' 39' ' ' LEU . 36.6 mt-30 -96.23 117.63 31.17 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 120.873 -1.142 . . . . 25.550000000000001 109.855 178.22 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -109.04 142.25 40.02 Favored 'General case' 0 CA--C 1.485 -1.537 0 O-C-N 120.885 -1.134 . . . . 39.619999999999997 113.658 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -130.84 143.4 50.71 Favored 'General case' 0 CA--C 1.505 -0.772 0 O-C-N 126.048 2.092 . . . . 20.07 110.67 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -107.46 108.9 20.44 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 105.102 -2.184 . . . . 21.300000000000001 105.102 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -109.92 142.46 41.23 Favored 'General case' 0 C--N 1.363 1.155 0 N-CA-C 114.261 1.208 . . . . 47.549999999999997 114.261 -175.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . 0.444 ' OG1' ' OG ' ' A' ' 19' ' ' SER . 89.5 m -129.97 121.23 26.15 Favored 'General case' 0 CA--C 1.483 -1.611 0 O-C-N 124.707 1.255 . . . . 28.34 107.936 178.67 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.92 157.6 23.14 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 126.601 2.438 . . . . 80.0 112.207 -179.792 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.275 56.6 m -75.65 149.94 38.07 Favored 'General case' 0 N--CA 1.421 -1.9 0 N-CA-C 106.568 -1.641 . . . . 25.32 106.568 174.668 -75.078 -59.023 104.937 102.522 1.967 102.303 77.899 -176.389 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -38.75 53.73 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.123 -0.631 . . . . 80.0 110.958 173.41 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.03 161.77 41.25 Favored 'General case' 0 CA--C 1.483 -1.634 0 N-CA-C 106.128 -1.804 . . . . 28.379999999999999 106.128 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' SER . . . . . 0.41 ' OG ' ' N ' ' C' ' 117' ' ' THR . 3.6 p -79.29 -14.63 58.89 Favored 'General case' 0 C--N 1.31 -1.133 0 C-N-CA 119.043 -1.063 . . . . 59.899999999999999 110.244 177.058 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -141.71 86.98 10.38 Favored Pre-proline 0 N--CA 1.439 -0.983 0 C-N-CA 119.654 -0.818 . . . . 70.049999999999997 111.091 -179.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -56.05 -13.02 8.33 Favored 'Trans proline' 0 CA--C 1.509 -0.727 0 C-N-CA 122.565 2.177 . . . . 39.450000000000003 111.126 179.785 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -151.33 153.68 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.814 0 N-CA-C 105.954 -1.869 . . . . 33.329999999999998 105.954 -176.826 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.389 0.6 OUTLIER -41.54 -54.39 3.19 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 116.582 2.068 . . . . 80.0 116.582 -173.412 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.1 p -69.42 -11.07 60.51 Favored 'General case' 0 N--CA 1.439 -0.979 0 N-CA-C 116.449 2.018 . . . . 80.0 116.449 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 132.01 -125.45 4.29 Favored Glycine 0 CA--C 1.53 1.03 0 N-CA-C 110.828 -0.909 . . . . 26.98 110.828 -177.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 3.8 m -76.76 150.19 36.24 Favored 'General case' 0 C--O 1.209 -1.041 0 C-N-CA 118.537 -1.265 . . . . 20.789999999999999 112.413 176.092 -39.48 153.505 101.211 101.606 2.025 104.494 77.244 -174.266 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 10.7 ttm105 -73.98 135.93 43.18 Favored 'General case' 0 N--CA 1.437 -1.125 0 O-C-N 121.821 -0.55 . . . . 24.420000000000002 111.554 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 97.84 -10.54 64.3 Favored Glycine 0 C--O 1.253 1.298 0 N-CA-C 118.326 2.09 . . . . 25.68 118.326 177.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.3 mm -71.84 138.95 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.158 0 N-CA-C 117.443 2.386 . . . . 38.670000000000002 117.443 -175.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASP . . . . . 0.651 ' OD2' ' NE2' ' A' ' 75' ' ' HIS . 44.4 t0 -71.05 89.78 0.82 Allowed 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 103.838 -2.653 . . . . 44.310000000000002 103.838 173.479 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.3 p -75.43 13.44 0.76 Allowed 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 117.872 2.545 . . . . 80.0 117.872 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . . . -90.08 -24.73 21.05 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 119.701 -1.875 . . . . 48.670000000000002 106.722 175.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' HIS . . . . . 0.681 ' NE2' ' O ' ' A' ' 903' ' ' HOH 0.253 0.0 OUTLIER -114.83 -7.09 12.65 Favored 'General case' 0 N--CA 1.413 -2.316 0 N-CA-C 116.194 1.924 . . . . 76.920000000000002 116.194 -178.2 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -140.88 156.93 46.01 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 121.447 1.93 . . . . 26.359999999999999 115.276 -179.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . 0.538 ' N ' ' O ' ' A' ' 113' ' ' SER . 85.4 m-20 -104.14 154.93 19.15 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 103.761 -2.681 . . . . 25.52 103.761 168.804 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.6 p -161.76 160.51 28.47 Favored 'General case' 0 C--O 1.209 -1.058 0 C-N-CA 119.239 -0.984 . . . . 16.949999999999999 112.314 179.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -160.56 162.73 33.01 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-O 116.976 -1.488 . . . . 15.720000000000001 107.41 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 81.7 m -100.44 134.85 42.77 Favored 'General case' 0 CA--C 1.479 -1.786 0 O-C-N 125.643 1.84 . . . . 19.530000000000001 112.064 -176.734 -60.194 -87.576 -85.511 105.504 1.99 103.511 -76.382 -64.442 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 t -138.68 163.28 32.52 Favored 'General case' 0 N--CA 1.411 -2.404 0 CA-C-O 122.822 1.296 . . . . 27.68 110.065 -178.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.8 m -98.48 143.84 28.47 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 114.108 -1.405 . . . . 28.32 114.486 -177.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . 0.332 3.0 p -119.81 173.19 7.19 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 118.092 -1.443 . . . . 33.990000000000002 112.87 176.886 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HIS . . . . . 0.509 ' NE2' ' OD1' ' A' ' 105' ' ' ASP . 68.9 m80 -123.03 155.49 36.76 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 117.341 2.348 . . . . 27.140000000000001 117.341 -171.254 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.4 t -124.82 174.85 7.65 Favored 'General case' 0 C--O 1.209 -1.077 0 N-CA-C 104.57 -2.381 . . . . 20.780000000000001 104.57 167.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -121.89 126.42 48.63 Favored 'General case' 0 CA--C 1.474 -1.949 0 CA-C-N 121.181 1.81 . . . . 22.629999999999999 110.565 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -123.29 141.43 43.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 O-C-N 125.426 1.703 . . . . 29.489999999999998 112.695 176.265 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.8 mttp -70.56 143.25 51.64 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 116.596 -2.041 . . . . 80.0 107.119 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -147.57 149.58 32.84 Favored 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 108.203 -1.036 . . . . 19.5 108.203 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.2 tp -79.37 111.76 15.94 Favored 'General case' 0 C--O 1.256 1.435 0 N-CA-C 108.072 -1.084 . . . . 22.399999999999999 108.072 172.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . 0.341 67.3 p -127.76 -176.77 3.87 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 122.168 0.985 . . . . 21.02 112.336 179.973 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.297 14.2 t -152.98 141.77 21.07 Favored 'General case' 0 CA--C 1.484 -1.564 0 C-N-CA 124.815 1.246 . . . . 19.129999999999999 111.435 171.508 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . 0.518 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 34.6 p-10 -108.6 12.03 26.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 113.983 -1.462 . . . . 27.34 108.685 177.214 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . 0.304 69.8 mt-10 89.29 -17.2 0.25 Allowed 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 113.66 0.985 . . . . 30.739999999999998 113.66 178.576 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -100.45 -52.34 3.39 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 123.317 0.647 . . . . 80.0 110.808 174.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.76 136.34 38.84 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 113.088 0.773 . . . . 80.0 113.088 177.605 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -97.51 124.28 41.69 Favored 'General case' 0 C--O 1.249 1.05 0 CA-C-O 121.88 0.848 . . . . 36.130000000000003 109.455 -179.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . 0.269 . . -160.55 -178.5 6.93 Favored 'General case' 0 CA--C 1.493 -1.218 0 C-N-CA 118.516 -1.273 . . . . 31.449999999999999 111.562 -177.283 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . 0.267 89.6 m95 -90.24 128.21 36.34 Favored 'General case' 0 CA--C 1.47 -2.117 0 N-CA-C 106.964 -1.495 . . . . 21.449999999999999 106.964 173.656 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 25.2 mtt85 -131.65 168.69 17.29 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.447 -1.316 . . . . 19.539999999999999 107.447 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -95.07 122.33 37.61 Favored 'General case' 0 C--O 1.249 1.042 0 N-CA-C 105.27 -2.122 . . . . 33.960000000000001 105.27 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ILE . . . . . 0.4 ' CG1' ' CD1' ' A' ' 104' ' ' ILE . 0.1 OUTLIER -110.63 162.81 7.91 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.149 0 O-C-N 124.484 1.115 . . . . 20.449999999999999 110.577 -179.627 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.56 149.32 25.03 Favored 'General case' 0 N--CA 1.42 -1.938 0 C-N-CA 114.827 -2.749 . . . . 52.649999999999999 108.132 179.141 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ILE . . . . . 0.4 ' CD1' ' CG1' ' A' ' 102' ' ' ILE . 1.2 mp -137.95 126.44 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.218 0 O-C-N 125.851 1.969 . . . . 28.66 108.262 176.815 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASP . . . . . 0.509 ' OD1' ' NE2' ' A' ' 84' ' ' HIS . 55.9 m-20 -70.91 135.16 47.81 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 105.109 -2.182 . . . . 39.590000000000003 105.109 -173.979 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.2 p -122.55 -12.39 8.15 Favored 'General case' 0 CA--C 1.501 -0.905 0 O-C-N 125.333 1.646 . . . . 32.259999999999998 114.274 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -162.98 166.22 24.04 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 117.842 -1.543 . . . . 18.16 113.701 -178.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 41.9 t -126.63 102.86 7.27 Favored 'General case' 0 CA--C 1.474 -1.944 0 N-CA-C 105.568 -2.012 . . . . 16.989999999999998 105.568 179.949 -176.389 77.899 104.937 102.303 1.967 102.522 -59.023 -75.078 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 9.3 m -113.53 164.01 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.442 0 N-CA-C 107.609 -1.256 . . . . 15.83 107.609 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 48.8 t -101.47 124.05 46.51 Favored 'General case' 0 CA--C 1.488 -1.407 0 C-N-CA 125.693 1.597 . . . . 17.190000000000001 111.707 -176.998 -174.266 77.244 101.211 104.494 2.025 101.606 153.505 -39.48 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -104.41 141.4 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 C-N-CA 118.326 -1.35 . . . . 22.559999999999999 107.615 176.48 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.319 0.0 OUTLIER -107.18 162.03 14.25 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 113.912 -1.494 . . . . 28.75 113.482 -174.342 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -156.06 128.53 7.72 Favored 'General case' 0 C--O 1.266 1.953 0 N-CA-C 108.288 -1.004 . . . . 62.740000000000002 108.288 172.415 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 1.5 mtp180 -64.9 131.28 46.27 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 112.76 -2.018 . . . . 79.340000000000003 112.554 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.89 130.1 44.07 Favored 'General case' 0 N--CA 1.419 -1.999 0 O-C-N 125.27 1.606 . . . . 80.0 108.304 177.383 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -74.43 118.46 17.41 Favored 'General case' 0 C--N 1.349 0.579 0 O-C-N 124.999 1.437 . . . . 80.0 111.38 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 33.0 m . . . . . 0 C--O 1.245 0.821 0 CA-C-O 122.871 1.32 . . . . 80.0 112.591 -178.555 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.309 0 N-CA-C 110.177 -1.169 . . . . 60.409999999999997 110.177 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . 0.322 0.6 OUTLIER -113.7 133.0 55.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 124.011 1.863 . . . . 80.0 115.239 -177.215 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -113.87 158.49 20.98 Favored 'General case' 0 N--CA 1.413 -2.289 0 N-CA-C 104.326 -2.472 . . . . 30.02 104.326 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 4.2 p -115.52 157.35 24.18 Favored 'General case' 0 N--CA 1.42 -1.952 0 CA-C-O 122.135 0.969 . . . . 67.170000000000002 110.662 -175.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 20.5 t -80.4 -30.76 12.6 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-O 122.931 1.348 . . . . 19.129999999999999 112.946 -177.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' CYS . . . . . . . . . . . . . 57.1 m -138.37 139.02 38.81 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.15 -0.932 . . . . 31.23 109.026 179.284 -74.856 -80.078 -83.362 107.186 2.023 104.937 -79.172 -57.897 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ASP . . . . . 0.463 ' O ' ' N ' ' B' ' 59' ' ' ARG . 73.3 m-20 -90.38 123.67 34.31 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 123.554 1.645 . . . . 35.969999999999999 112.2 -178.16 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 26.8 p -116.63 167.03 11.44 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 118.76 -1.176 . . . . 26.170000000000002 110.966 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . 0.53 ' N ' ' O ' ' B' ' 57' ' ' LYS . 0.2 OUTLIER -136.35 126.41 40.31 Favored 'Isoleucine or valine' 0 C--O 1.245 0.824 0 CA-C-N 115.298 -0.865 . . . . 51.340000000000003 108.883 176.894 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' SER . . . . . . . . . . . . . 1.5 m -110.12 139.42 45.28 Favored 'General case' 0 C--O 1.244 0.806 0 N-CA-C 115.956 1.836 . . . . 30.370000000000001 115.956 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 10.5 m -150.3 176.64 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.939 0 O-C-N 121.134 -0.979 . . . . 24.77 111.564 -177.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -118.99 124.47 47.09 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.767 -1.197 . . . . 22.120000000000001 107.767 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 39.1 t -105.28 125.36 60.44 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.98 0 CA-C-N 115.566 -0.743 . . . . 25.420000000000002 109.334 -176.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -118.33 1.7 16.37 Favored Glycine 0 C--N 1.337 0.627 0 C-N-CA 118.607 -1.759 . . . . 29.039999999999999 114.466 -177.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 40.5 p-10 -124.75 28.16 6.6 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 115.24 1.57 . . . . 40.899999999999999 115.24 -178.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 3.1 ttmm -59.54 135.04 57.55 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 108.171 -1.048 . . . . 36.640000000000001 108.171 178.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 67.1 p -122.22 -22.03 5.7 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 118.203 -1.399 . . . . 25.68 111.621 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.37 153.66 42.19 Favored 'General case' 0 N--CA 1.409 -2.524 0 CA-C-O 123.6 1.667 . . . . 33.07 113.801 177.963 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.0 171.76 18.77 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 118.587 -1.245 . . . . 22.690000000000001 112.077 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . 0.432 0.2 OUTLIER -104.93 128.62 53.26 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 123.257 1.503 . . . . 50.130000000000003 111.422 174.528 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . 0.277 24.9 p-10 -83.3 -175.17 5.7 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 117.095 2.257 . . . . 37.5 117.095 -176.259 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ILE . . . . . . . . . . . . . 7.7 tt -61.22 -34.95 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.778 0 CA-C-N 113.342 -1.754 . . . . 80.0 111.694 -178.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -75.79 -10.01 59.08 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 121.865 0.84 . . . . 80.0 111.782 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.83 14.16 56.91 Favored Glycine 0 N--CA 1.441 -1.025 0 O-C-N 121.18 -0.95 . . . . 37.100000000000001 113.127 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 10.5 ptmt -102.72 143.94 31.72 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 119.513 -0.875 . . . . 80.0 113.295 -177.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.58 118.74 13.76 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 114.435 -1.257 . . . . 42.130000000000003 112.763 -178.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.41 172.94 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 115.154 1.539 . . . . 35.100000000000001 115.154 -177.432 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' THR . . . . . 0.558 ' O ' ' N ' ' B' ' 92' ' ' THR . 52.5 m -113.02 127.62 56.28 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-O 122.798 1.285 . . . . 49.329999999999998 111.51 -178.168 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 76.1 t -92.6 120.06 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.775 0 CA-C-N 111.815 -2.448 . . . . 36.990000000000002 110.907 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LEU . . . . . 0.67 ' O ' ' NE2' ' B' ' 51' ' ' GLN . 0.0 OUTLIER -68.01 126.01 28.13 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 122.5 1.143 . . . . 46.549999999999997 110.719 178.388 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.09 -50.63 73.33 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 114.087 -1.415 . . . . 48.399999999999999 112.593 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . . . -105.42 166.52 10.37 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 114.593 1.331 . . . . 66.180000000000007 114.593 -177.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' VAL . . . . . 0.653 ' N ' ' O ' ' B' ' 49' ' ' PHE 0.345 0.4 OUTLIER -155.2 122.68 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 118.299 2.703 . . . . 69.890000000000001 118.299 178.28 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -108.17 109.9 21.41 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.044 -1.889 . . . . 80.0 111.139 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . . . -134.62 119.78 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.754 0 C-N-CA 126.171 1.788 . . . . 80.0 108.382 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ASN . . . . . 0.757 ' ND2' ' N ' ' C' ' 45' ' ' ASN 0.348 9.2 m120 57.17 58.79 3.72 Favored 'General case' 0 CA--C 1.554 1.111 0 O-C-N 125.126 1.516 . . . . 80.0 113.653 -175.948 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . . . 51.13 55.12 10.01 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 114.349 1.24 . . . . 80.0 114.349 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' SER . . . . . 0.442 ' CB ' ' CZ ' ' B' ' 49' ' ' PHE . . . -156.41 161.9 40.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 122.105 -0.372 . . . . 80.0 110.747 177.335 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.314 2.5 t -132.59 125.23 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 C-N-CA 115.181 -2.608 . . . . 80.0 116.594 -177.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' PHE . . . . . 0.653 ' O ' ' N ' ' B' ' 42' ' ' VAL . 1.4 m-85 -138.69 162.48 34.57 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 112.872 -1.967 . . . . 65.200000000000003 114.585 -176.861 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.97 145.46 28.64 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 110.519 -3.037 . . . . 80.0 107.585 179.099 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLN . . . . . 0.67 ' NE2' ' O ' ' B' ' 39' ' ' LEU . 16.3 mt-30 -86.0 121.85 29.2 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.012 -1.449 . . . . 33.0 109.985 -179.583 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -118.71 142.8 47.34 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.352 -0.981 . . . . 27.510000000000002 108.352 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -137.53 130.37 30.2 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 126.185 2.178 . . . . 25.27 109.629 -176.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -91.34 116.54 28.92 Favored 'General case' 0 N--CA 1.416 -2.131 0 CA-C-N 114.571 -1.195 . . . . 22.739999999999998 108.351 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -118.03 147.43 43.23 Favored 'General case' 0 CA--C 1.489 -1.396 0 N-CA-C 114.85 1.426 . . . . 23.34 114.85 -175.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 40.1 m -130.49 136.2 48.73 Favored 'General case' 0 CA--C 1.48 -1.713 0 O-C-N 123.81 0.694 . . . . 18.68 110.514 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LYS . . . . . 0.53 ' O ' ' N ' ' B' ' 18' ' ' VAL . 8.9 mtpp -140.43 167.76 21.39 Favored 'General case' 0 N--CA 1.439 -1.002 0 O-C-N 126.328 2.268 . . . . 80.0 110.449 -177.47 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 98.0 m -75.62 136.51 40.47 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 114.187 -1.37 . . . . 24.969999999999999 110.389 177.047 -69.259 -54.219 97.358 102.447 2.034 107.569 77.139 -166.676 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' B' ' 16' ' ' ASP . 7.7 mtt180 -70.96 -31.73 68.39 Favored 'General case' 0 CA--C 1.482 -1.658 0 N-CA-C 102.027 -3.323 . . . . 80.0 102.027 175.874 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -163.41 153.59 15.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.911 -1.495 . . . . 44.68 113.673 -176.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 9.9 t -73.43 -33.19 64.8 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 113.002 -1.908 . . . . 80.0 112.216 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -127.18 71.74 76.35 Favored Pre-proline 0 C--O 1.215 -0.732 0 CA-C-O 121.733 0.777 . . . . 80.0 110.07 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -41.91 -39.6 5.5 Favored 'Trans proline' 0 C--N 1.319 -0.986 0 C-N-CA 123.792 2.995 . . . . 41.07 113.03 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' VAL . . . . . 0.458 ' CG1' ' N ' ' B' ' 65' ' ' GLU . 0.5 OUTLIER -118.56 174.58 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.622 0 CA-C-N 113.101 -1.863 . . . . 48.549999999999997 108.122 -178.894 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLU . . . . . 0.458 ' N ' ' CG1' ' B' ' 64' ' ' VAL . . . -59.44 -57.82 11.29 Favored 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 117.207 -1.797 . . . . 51.310000000000002 110.855 -179.139 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.9 -34.33 59.2 Favored 'General case' 0 C--N 1.346 0.424 0 O-C-N 127.044 2.715 . . . . 80.0 115.439 -178.447 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 144.63 -118.62 1.16 Allowed Glycine 0 C--O 1.218 -0.886 0 N-CA-C 108.021 -2.032 . . . . 39.25 108.021 -179.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' CYS . . . . . . . . . . . . 0.273 1.4 m -74.96 155.34 37.5 Favored 'General case' 0 C--O 1.213 -0.849 0 C-N-CA 117.303 -1.759 . . . . 26.289999999999999 112.632 176.94 -28.882 149.699 86.567 98.958 2.013 102.704 79.226 -178.255 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ARG . . . . . 0.455 ' NH2' ' OD1' ' B' ' 16' ' ' ASP . 17.5 ttp-105 -81.58 131.68 35.28 Favored 'General case' 0 N--CA 1.425 -1.724 0 C-N-CA 119.163 -1.015 . . . . 47.039999999999999 110.794 -175.196 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 98.2 -11.76 63.68 Favored Glycine 0 C--O 1.218 -0.857 0 CA-C-O 118.912 -0.938 . . . . 26.890000000000001 113.875 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ILE . . . . . 0.467 ' CG2' ' N ' ' B' ' 72' ' ' ASP . 7.0 mm -66.49 161.45 3.45 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-N 117.941 0.87 . . . . 33.869999999999997 110.78 -178.844 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ASP . . . . . 0.467 ' N ' ' CG2' ' B' ' 71' ' ' ILE . 14.1 t0 -100.63 74.28 1.67 Allowed 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.669 1.588 . . . . 40.409999999999997 107.357 178.065 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' SER . . . . . 0.557 ' O ' ' NZ ' ' B' ' 115' ' ' LYS . 79.7 p -61.2 -13.73 20.34 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 114.0 -1.454 . . . . 44.880000000000003 111.273 -176.773 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . . . -66.82 -21.76 66.02 Favored 'General case' 0 C--O 1.194 -1.863 0 C-N-CA 114.283 -2.967 . . . . 34.859999999999999 106.72 179.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' HIS . . . . . 0.65 ' NE2' ' O ' ' B' ' 904' ' ' HOH . 45.3 m80 -129.02 -2.73 5.15 Favored 'General case' 0 CA--C 1.493 -1.245 0 C-N-CA 118.466 -1.294 . . . . 70.799999999999997 111.572 -177.262 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' TRP . . . . . . . . . . . . 0.275 74.2 m95 -137.02 150.51 48.15 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 117.319 -1.752 . . . . 39.810000000000002 115.103 -177.326 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ASN . . . . . 0.41 ' N ' ' O ' ' B' ' 113' ' ' SER . 8.7 m120 -106.99 140.14 40.26 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.888 -1.152 . . . . 80.0 107.888 172.775 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . 0.294 89.2 p -156.63 154.67 30.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 115.707 1.743 . . . . 34.899999999999999 115.707 -179.688 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' TYR . . . . . 0.439 ' O ' ' N ' ' B' ' 111' ' ' VAL . 49.9 p90 -148.46 171.79 15.5 Favored 'General case' 0 N--CA 1.427 -1.599 0 C-N-CA 115.307 -2.557 . . . . 46.369999999999997 109.448 171.302 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 66.9 m -94.23 142.68 27.13 Favored 'General case' 0 C--N 1.359 0.995 0 O-C-N 125.981 2.05 . . . . 25.989999999999998 113.257 179.62 -57.897 -79.172 -83.362 104.937 2.023 107.186 -80.078 -74.856 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 5.1 t -150.83 155.17 38.66 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-O 123.572 1.653 . . . . 51.640000000000001 113.692 -178.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' THR . . . . . . . . . . . . . 5.0 t -91.86 132.77 36.22 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 113.972 -1.467 . . . . 26.449999999999999 110.738 -176.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 63.9 p -109.54 157.62 18.82 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 126.386 2.304 . . . . 21.359999999999999 111.888 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -114.53 170.27 8.43 Favored 'General case' 0 C--O 1.195 -1.784 0 N-CA-C 115.683 1.734 . . . . 30.43 115.683 -172.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' THR . . . . . . . . . . . . 0.257 0.2 OUTLIER -140.34 -177.65 5.12 Favored 'General case' 0 CA--C 1.47 -2.124 0 N-CA-C 101.163 -3.643 . . . . 42.869999999999997 101.163 174.376 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -127.07 142.12 51.61 Favored 'General case' 0 CA--C 1.47 -2.107 0 O-C-N 127.318 2.886 . . . . 34.920000000000002 107.393 179.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 74.5 t -144.29 145.62 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.652 0 O-C-N 126.272 2.233 . . . . 28.280000000000001 108.768 -177.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.43 132.47 40.87 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.253 -0.885 . . . . 80.0 110.076 179.637 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ALA . . . . . 0.403 ' CB ' ' CD1' ' B' ' 102' ' ' ILE . . . -144.06 152.04 40.45 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 119.609 -0.836 . . . . 28.870000000000001 112.022 177.831 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 8.4 tp -83.14 123.72 29.81 Favored 'General case' 0 CA--C 1.487 -1.454 0 C-N-CA 117.651 -1.62 . . . . 46.700000000000003 108.524 176.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . 0.255 72.2 p -134.48 -166.07 1.75 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.286 1.587 . . . . 34.359999999999999 115.286 -176.596 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' THR . . . . . 0.558 ' N ' ' O ' ' B' ' 37' ' ' THR . 6.1 t -163.87 123.77 2.1 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 113.797 -1.547 . . . . 53.020000000000003 114.572 174.83 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -86.5 39.51 0.84 Allowed 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 128.613 2.765 . . . . 80.0 110.012 179.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . 0.399 0.0 OUTLIER 82.51 -43.07 0.13 Allowed 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 110.687 -2.96 . . . . 80.0 110.874 -176.915 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . . . -109.31 -53.54 2.64 Favored 'General case' 0 C--O 1.252 1.196 0 C-N-CA 117.87 -1.532 . . . . 80.0 114.23 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -77.67 124.44 27.94 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 112.895 -1.957 . . . . 80.0 115.898 -176.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -98.9 102.5 14.25 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 106.593 -1.632 . . . . 68.430000000000007 106.593 174.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -141.48 150.06 41.73 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 115.292 1.59 . . . . 55.93 115.292 -174.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -71.62 142.77 49.95 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 117.702 -1.599 . . . . 44.090000000000003 107.684 172.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 4.7 mtm180 -152.08 157.76 42.07 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 109.597 -0.52 . . . . 63.340000000000003 109.597 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -92.67 121.24 33.88 Favored 'General case' 0 CA--C 1.479 -1.764 0 O-C-N 125.198 1.561 . . . . 40.07 107.076 177.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ILE . . . . . 0.403 ' CD1' ' CB ' ' B' ' 89' ' ' ALA . 0.6 OUTLIER -110.85 164.71 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 C-N-CA 117.291 -1.764 . . . . 33.039999999999999 110.579 179.49 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 20.9 ttt-85 -89.69 133.76 34.5 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.582 -1.247 . . . . 80.0 111.379 -176.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 49.3 mm -133.85 146.84 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.813 0.845 . . . . 43.100000000000001 110.314 -176.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.48 128.43 35.53 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.062 -1.459 . . . . 21.989999999999998 107.062 176.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 12.5 t -123.56 -14.61 7.28 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 113.922 1.082 . . . . 21.460000000000001 113.922 -175.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -175.94 165.85 2.98 Favored 'General case' 0 CA--C 1.487 -1.466 0 N-CA-C 117.019 2.229 . . . . 11.529999999999999 117.019 -178.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' CYS . . . . . . . . . . . . . 14.7 t -113.49 108.67 17.5 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 109.736 -3.393 . . . . 21.0 112.362 -178.698 -166.676 77.139 97.358 107.569 2.034 102.447 -54.219 -69.259 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 11.3 m -117.91 152.6 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 121.893 0.854 . . . . 22.010000000000002 113.063 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' CYS . . . . . . . . . . . . . 51.4 t -88.49 122.3 31.81 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.113 -0.949 . . . . 25.390000000000001 113.366 179.178 -178.255 79.226 86.567 102.704 2.013 98.958 149.699 -28.882 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' VAL . . . . . 0.439 ' N ' ' O ' ' B' ' 79' ' ' TYR . 2.2 t -101.38 144.7 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-O 122.499 1.142 . . . . 34.75 112.323 179.04 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.83 151.07 26.74 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 114.074 1.138 . . . . 34.710000000000001 114.074 -175.959 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' SER . . . . . 0.41 ' O ' ' N ' ' B' ' 77' ' ' ASN 0.277 4.4 p -150.27 123.61 8.97 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 112.03 -2.35 . . . . 70.409999999999997 110.449 173.842 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ARG . . . . . . . . . . . . . 2.8 tpt85 -65.63 161.09 21.18 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-N 112.607 -2.088 . . . . 80.0 112.323 -179.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' LYS . . . . . 0.557 ' NZ ' ' O ' ' B' ' 73' ' ' SER 0.314 3.0 ptmt -135.01 141.44 46.2 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 117.59 -1.644 . . . . 80.0 110.728 174.089 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -84.68 94.82 8.73 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.477 -0.764 . . . . 80.0 109.277 177.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' THR . . . . . . . . . . . . . 40.2 p -79.59 -156.26 0.11 Allowed 'General case' 0 C--O 1.24 0.589 0 N-CA-C 119.037 2.977 . . . . 80.0 119.037 -172.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 7.9 ptt85 . . . . . 0 C--N 1.363 1.171 0 C-N-CA 127.072 2.149 . . . . 80.0 111.542 178.47 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.709 0 CA-C-O 120.16 -0.245 . . . . 80.0 113.185 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -129.42 119.34 23.65 Favored 'General case' 0 CA--C 1.498 -1.04 0 N-CA-C 112.669 0.618 . . . . 80.0 112.669 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' C' ' 13' ' ' SER . 0.1 OUTLIER -90.52 165.96 13.49 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 118.561 -1.256 . . . . 80.0 111.614 177.797 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' SER . . . . . 0.493 ' N ' ' CD1' ' C' ' 12' ' ' PHE . 31.9 p -105.58 150.71 25.15 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 103.072 -2.936 . . . . 61.810000000000002 103.072 175.377 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -75.95 -33.26 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 CA-C-O 122.569 1.176 . . . . 29.010000000000002 111.189 -176.972 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' CYS . . . . . . . . . . . . . 94.0 m -129.52 156.67 43.78 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-N 114.19 -1.368 . . . . 21.23 107.497 177.378 -69.952 -78.515 -86.773 102.328 2.011 104.233 -90.398 -51.533 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -113.83 146.32 40.14 Favored 'General case' 0 N--CA 1.44 -0.928 0 O-C-N 124.632 1.207 . . . . 37.609999999999999 110.905 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 12.1 p -139.2 171.76 13.81 Favored 'General case' 0 C--O 1.207 -1.139 0 C-N-CA 119.6 -0.84 . . . . 21.52 111.084 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' VAL . . . . . 0.416 ' CG1' ' CG ' ' C' ' 59' ' ' ARG . 3.7 m -134.01 131.9 55.97 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.844 0 C-N-CA 126.594 1.957 . . . . 28.539999999999999 110.31 179.641 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' SER . . . . . . . . . . . . . 51.8 m -100.09 162.66 12.83 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 107.921 -1.14 . . . . 28.32 107.921 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -168.97 133.11 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.405 -2.724 0 C-N-CA 115.458 -2.497 . . . . 27.68 108.518 -177.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -84.37 113.74 21.38 Favored 'General case' 0 C--O 1.204 -1.301 0 N-CA-C 107.965 -1.124 . . . . 27.809999999999999 107.965 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 58.9 t -103.4 117.72 49.3 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.703 0 N-CA-C 114.486 1.291 . . . . 24.469999999999999 114.486 -175.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' GLY . . . . . . . . . . . . . . . -118.05 3.46 16.61 Favored Glycine 0 C--N 1.346 1.108 0 O-C-N 125.806 1.941 . . . . 20.280000000000001 111.114 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 41.1 p-10 -126.02 37.0 4.42 Favored 'General case' 0 CA--C 1.478 -1.806 0 CA-C-O 116.467 -1.73 . . . . 28.100000000000001 112.332 -175.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' LYS . . . . . 0.636 ' NZ ' ' OE2' ' C' ' 55' ' ' GLU . 15.5 ttmm -85.01 144.39 28.32 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 125.822 1.951 . . . . 80.0 107.487 177.82 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' THR . . . . . . . . . . . . . 74.8 p -128.15 -23.81 3.24 Favored 'General case' 0 CA--C 1.482 -1.659 0 C-N-CA 117.888 -1.525 . . . . 79.420000000000002 111.216 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' THR . . . . . . . . . . . . . 52.5 m -131.6 150.28 52.21 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 117.882 -1.527 . . . . 55.490000000000002 112.213 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -151.65 171.4 17.7 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 118.663 -1.215 . . . . 28.079999999999998 113.589 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 17.3 m -115.33 123.22 48.19 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 105.56 -2.015 . . . . 78.049999999999997 105.56 174.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' ASP . . . . . . . . . . . . 0.275 38.1 p30 -78.09 -171.51 2.37 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 118.175 -1.41 . . . . 34.390000000000001 112.919 -177.013 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 8.3 tt -69.46 -27.33 33.78 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 N-CA-C 115.647 1.721 . . . . 26.690000000000001 115.647 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' LYS . . . . . . . . . . . . . . . -78.35 -21.92 48.79 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 108.822 -0.807 . . . . 43.299999999999997 108.822 177.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.77 10.21 23.38 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 114.686 0.634 . . . . 41.119999999999997 114.686 174.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' LYS . . . . . . . . . . . . . . . -90.7 146.55 23.91 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 124.534 1.134 . . . . 41.009999999999998 112.592 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -75.87 133.22 40.63 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 106.249 -1.76 . . . . 67.430000000000007 106.249 175.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 1.2 t -145.11 156.48 13.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 O-C-N 120.184 -1.573 . . . . 42.93 108.901 -173.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' THR . . . . . . . . . . . . 0.404 1.1 p -108.58 134.64 51.06 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 115.207 -2.597 . . . . 52.409999999999997 112.91 179.603 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 19.1 t -85.66 123.19 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.861 0 N-CA-C 107.64 -1.244 . . . . 30.300000000000001 107.64 -176.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' LEU . . . . . 0.519 ' O ' ' NE2' ' C' ' 51' ' ' GLN . 12.9 mt -72.98 151.82 41.64 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.914 -0.772 . . . . 40.119999999999997 108.914 179.197 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.66 -61.09 1.93 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 116.861 2.171 . . . . 43.630000000000003 116.861 -175.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.23 152.91 22.88 Favored 'General case' 0 C--N 1.299 -1.625 0 C-N-CA 114.845 -2.742 . . . . 80.0 108.862 -179.868 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' VAL . . . . . 0.66 ' N ' ' O ' ' C' ' 49' ' ' PHE 0.335 0.3 OUTLIER -108.7 116.45 51.85 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.696 0 C-N-CA 117.088 -1.845 . . . . 63.689999999999998 112.488 177.093 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' ASN . . . . . . . . . . . . . . . -101.89 138.28 39.07 Favored 'General case' 0 C--O 1.25 1.098 0 CA-C-N 110.455 -3.066 . . . . 80.0 107.339 173.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . . . 172.05 131.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.249 1.03 0 C-N-CA 124.161 0.984 . . . . 80.0 109.609 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' ASN . . . . . 0.757 ' N ' ' ND2' ' B' ' 45' ' ' ASN . 0.1 OUTLIER 64.61 42.73 4.66 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 119.359 -0.936 . . . . 80.0 110.425 -178.221 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' C' ' 46' ' ' ASN . 2.6 p-10 47.24 54.05 9.98 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.484 -1.689 . . . . 80.0 115.17 -178.443 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' SER . . . . . . . . . . . . . . . -158.21 153.57 25.89 Favored 'General case' 0 C--N 1.319 -0.719 0 O-C-N 120.545 -1.347 . . . . 80.0 110.378 179.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' VAL . . . . . . . . . . . . . 46.7 t -121.25 117.4 52.68 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 0 N-CA-C 115.681 1.734 . . . . 76.480000000000004 115.681 -175.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' PHE . . . . . 0.66 ' O ' ' N ' ' C' ' 42' ' ' VAL . 29.0 m-85 -113.39 178.26 4.34 Favored 'General case' 0 CA--C 1.49 -1.363 0 C-N-CA 119.563 -0.855 . . . . 80.0 110.922 177.113 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -121.1 130.26 53.67 Favored 'General case' 0 CA--C 1.496 -1.108 0 C-N-CA 119.559 -0.857 . . . . 80.0 110.206 174.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' C' ' 39' ' ' LEU . 34.7 mt-30 -68.02 122.27 17.87 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 115.799 1.778 . . . . 32.630000000000003 115.799 -175.763 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -119.42 141.3 49.22 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.777 -0.647 . . . . 50.369999999999997 112.072 174.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -130.39 133.42 46.36 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 108.308 -0.997 . . . . 38.979999999999997 108.308 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -87.26 122.52 31.15 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.269 -1.012 . . . . 23.210000000000001 108.269 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' GLU . . . . . 0.636 ' OE2' ' NZ ' ' C' ' 25' ' ' LYS . 31.0 mt-10 -127.56 150.83 49.52 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 119.563 1.074 . . . . 29.760000000000002 112.072 -176.54 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' THR . . . . . . . . . . . . . 18.7 m -135.91 138.92 42.89 Favored 'General case' 0 CA--C 1.488 -1.414 0 N-CA-C 108.074 -1.084 . . . . 25.710000000000001 108.074 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -155.53 171.79 19.35 Favored 'General case' 0 N--CA 1.427 -1.587 0 C-N-CA 118.556 -1.258 . . . . 17.960000000000001 109.573 -176.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' CYS . . . . . . . . . . . . . 94.9 m -70.81 132.89 45.98 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 117.562 -1.209 . . . . 19.859999999999999 111.782 -178.122 -66.133 -54.771 96.183 104.636 2.024 102.646 72.373 179.732 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' ARG . . . . . 0.416 ' CG ' ' CG1' ' C' ' 18' ' ' VAL 0.285 4.6 mtp85 -68.15 -43.73 77.6 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 123.567 1.651 . . . . 61.450000000000003 108.531 175.086 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' ALA . . . . . . . . . . . . 0.255 . . -148.08 161.53 41.21 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-N 112.699 -2.046 . . . . 19.670000000000002 109.938 179.203 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' SER . . . . . . . . . . . . . 1.7 p -82.46 -22.59 35.13 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 114.579 1.326 . . . . 26.620000000000001 114.579 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -136.11 75.82 52.9 Favored Pre-proline 0 CA--C 1.493 -1.223 0 O-C-N 119.537 -1.977 . . . . 45.289999999999999 111.365 -175.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -45.14 -35.73 11.13 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.52 2.147 . . . . 34.079999999999998 110.762 176.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' VAL . . . . . . . . . . . . . 31.5 m -129.62 173.28 14.31 Favored 'Isoleucine or valine' 0 CA--C 1.444 -3.103 0 N-CA-C 103.755 -2.683 . . . . 27.989999999999998 103.755 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.22 -40.81 82.62 Favored 'General case' 0 C--N 1.285 -2.208 0 N-CA-C 116.246 1.943 . . . . 80.0 116.246 -173.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' SER . . . . . . . . . . . . . 6.7 p -82.19 -10.56 59.11 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 113.395 -1.729 . . . . 39.5 112.624 -175.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.5 -123.82 4.68 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 108.823 -1.711 . . . . 30.100000000000001 108.823 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.23 159.65 33.12 Favored 'General case' 0 N--CA 1.424 -1.728 0 CA-C-O 123.194 1.473 . . . . 24.25 111.259 -179.258 -22.293 155.094 93.489 101.77 2.03 106.643 69.582 -170.943 2 2 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 42.5 mtm-85 -77.78 146.17 36.0 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.975 -1.466 . . . . 64.409999999999997 110.514 179.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.44 -13.3 28.8 Favored Glycine 0 C--N 1.354 1.57 0 CA-C-O 122.251 0.917 . . . . 23.23 114.932 175.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.29 139.65 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.75 0 C-N-CA 118.057 -1.457 . . . . 31.32 113.696 -178.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' ASP . . . . . 0.656 ' OD2' ' ND1' ' C' ' 75' ' ' HIS . 7.5 t0 -73.69 105.37 4.97 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 105.281 -2.118 . . . . 80.0 105.281 170.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' SER . . . . . 0.675 ' O ' ' NZ ' ' C' ' 115' ' ' LYS 0.331 0.1 OUTLIER -78.04 -15.37 58.98 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 116.576 2.065 . . . . 80.0 116.576 -177.483 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' LYS . . . . . 0.465 ' CG ' ' OD1' ' C' ' 72' ' ' ASP . . . -65.99 -53.2 41.84 Favored 'General case' 0 CA--C 1.493 -1.231 0 C-N-CA 117.094 -1.842 . . . . 80.0 108.305 177.813 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' HIS . . . . . 0.656 ' ND1' ' OD2' ' C' ' 72' ' ' ASP . 29.4 m80 -82.11 -30.49 31.15 Favored 'General case' 0 CA--C 1.492 -1.288 0 N-CA-C 113.76 1.022 . . . . 43.759999999999998 113.76 -178.789 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -118.87 158.14 26.26 Favored 'General case' 0 C--O 1.21 -0.993 0 C-N-CA 113.034 -3.466 . . . . 42.329999999999998 119.258 -175.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -114.39 139.07 49.79 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 103.699 -2.704 . . . . 60.43 103.699 170.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' SER . . . . . . . . . . . . . 81.5 p -152.06 164.29 37.56 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 113.366 0.876 . . . . 31.75 113.366 -177.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -165.06 160.3 18.74 Favored 'General case' 0 N--CA 1.424 -1.76 0 CA-C-O 116.894 -1.527 . . . . 34.299999999999997 108.491 173.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' CYS . . . . . . . . . . . . . 35.6 m -89.31 144.01 26.4 Favored 'General case' 0 C--O 1.238 0.469 0 O-C-N 125.156 1.535 . . . . 22.75 111.894 178.937 -51.533 -90.398 -86.773 104.233 2.011 102.328 -78.515 -69.952 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 4.6 t -146.32 152.38 39.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 113.213 -1.812 . . . . 55.880000000000003 112.571 -178.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' THR . . . . . . . . . . . . . 84.2 m -87.35 140.76 29.21 Favored 'General case' 0 N--CA 1.425 -1.697 0 CA-C-N 113.355 -1.748 . . . . 21.199999999999999 108.933 -178.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -114.18 148.94 36.47 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 127.106 2.754 . . . . 24.710000000000001 108.08 -178.95 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -108.26 157.95 17.89 Favored 'General case' 0 CA--C 1.56 1.352 0 N-CA-C 116.899 2.185 . . . . 29.359999999999999 116.899 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' THR . . . . . . . . . . . . . 8.9 t -134.05 168.32 19.03 Favored 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 104.466 -2.42 . . . . 23.239999999999998 104.466 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -116.57 140.2 49.65 Favored 'General case' 0 CA--C 1.458 -2.56 0 CA-C-O 117.015 -1.469 . . . . 22.649999999999999 107.38 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' VAL . . . . . . . . . . . . . 1.5 t -139.43 147.77 24.03 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.36 0 O-C-N 127.161 2.788 . . . . 21.34 109.45 -175.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.14 143.03 31.73 Favored 'General case' 0 C--O 1.205 -1.274 0 C-N-CA 118.563 -1.255 . . . . 80.0 108.64 -175.621 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.18 144.61 17.45 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 119.798 -0.761 . . . . 28.039999999999999 112.632 -179.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.24 119.0 16.87 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 108.341 -0.985 . . . . 45.390000000000001 108.341 177.308 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' THR . . . . . 0.646 ' OG1' ' NH1' ' C' ' 100' ' ' ARG 0.266 63.2 p -141.88 171.32 14.21 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 123.726 0.641 . . . . 41.789999999999999 112.527 -174.806 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' THR . . . . . . . . . . . . . 38.0 p -142.85 129.46 20.27 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 114.769 -1.105 . . . . 58.990000000000002 112.481 177.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' ASP . . . . . 0.487 ' N ' ' OD1' ' C' ' 93' ' ' ASP . 21.1 p-10 -91.49 161.38 14.99 Favored 'General case' 0 N--CA 1.426 -1.625 1 N-CA-C 94.385 -6.154 . . . . 80.0 94.385 167.668 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' GLU . . . . . 0.674 ' OE1' ' N ' ' C' ' 95' ' ' LYS . 0.0 OUTLIER -37.99 -34.22 0.11 Allowed 'General case' 0 C--N 1.301 -1.516 0 O-C-N 125.808 1.942 . . . . 80.0 113.259 -179.786 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' LYS . . . . . 0.674 ' N ' ' OE1' ' C' ' 94' ' ' GLU 0.339 . . -59.8 -85.31 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 113.888 -1.505 . . . . 78.510000000000005 110.771 -179.839 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -135.17 151.99 51.18 Favored 'General case' 0 C--O 1.245 0.845 0 O-C-N 127.887 3.242 . . . . 80.0 118.054 -172.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.45 155.92 31.12 Favored 'General case' 0 CA--C 1.494 -1.18 0 N-CA-C 103.848 -2.649 . . . . 63.149999999999999 103.848 177.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' ALA . . . . . . . . . . . . . . . 174.88 140.13 0.05 OUTLIER 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 124.026 0.829 . . . . 53.939999999999998 110.516 -177.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -76.72 142.28 40.55 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 106.741 -1.577 . . . . 49.609999999999999 106.741 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' ARG . . . . . 0.646 ' NH1' ' OG1' ' C' ' 91' ' ' THR . 60.3 mtt85 -148.03 159.46 43.88 Favored 'General case' 0 CA--C 1.479 -1.766 0 CA-C-N 114.657 -1.156 . . . . 58.289999999999999 108.094 -179.312 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -91.3 135.64 33.67 Favored 'General case' 0 N--CA 1.397 -3.09 0 C-N-CA 114.109 -3.036 . . . . 23.760000000000002 103.048 175.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' ILE . . . . . . . . . . . . . 33.2 pt -121.77 161.73 21.93 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.016 0 C-N-CA 117.977 -1.489 . . . . 22.469999999999999 108.788 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -93.71 129.17 40.13 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 125.039 1.462 . . . . 80.0 111.127 -178.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' ILE . . . . . . . . . . . . . 8.5 pt -135.61 151.15 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 N-CA-C 113.713 1.005 . . . . 39.619999999999997 113.713 178.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -62.47 125.85 25.32 Favored 'General case' 0 C--O 1.203 -1.382 0 N-CA-C 107.657 -1.238 . . . . 25.07 107.657 -178.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -122.74 -19.3 6.28 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 115.053 1.501 . . . . 18.870000000000001 115.053 -175.109 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' ALA . . . . . . . . . . . . . . . -171.29 171.88 5.46 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 120.627 -1.295 . . . . 15.039999999999999 110.831 -176.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' CYS . . . . . 0.64 ' N ' ' O ' ' C' ' 952' ' ' HOH . 51.2 t -128.71 118.1 22.28 Favored 'General case' 0 CA--C 1.487 -1.475 0 N-CA-C 107.508 -1.293 . . . . 17.100000000000001 107.508 -178.202 179.732 72.373 96.183 102.646 2.024 104.636 -54.771 -66.133 2 2 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' VAL . . . . . . . . . . . . . 31.8 m -130.22 161.58 39.7 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.404 0 C-N-CA 118.521 -1.272 . . . . 22.039999999999999 110.429 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' CYS . . . . . . . . . . . . . 34.7 t -84.66 136.32 33.8 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 127.679 3.112 . . . . 25.390000000000001 112.427 178.226 -170.943 69.582 93.489 106.643 2.03 101.77 155.094 -22.293 1 1 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -132.23 116.4 29.11 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.196 0 N-CA-C 114.581 1.326 . . . . 20.43 114.581 -178.509 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.57 158.98 27.02 Favored 'General case' 0 C--O 1.197 -1.67 0 N-CA-C 114.646 1.35 . . . . 38.780000000000001 114.646 -176.518 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' SER . . . . . . . . . . . . . 1.1 t -147.27 124.22 11.33 Favored 'General case' 0 C--N 1.312 -1.056 0 C-N-CA 126.96 2.104 . . . . 42.039999999999999 106.243 174.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -75.71 131.81 40.11 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 114.903 1.446 . . . . 35.659999999999997 114.903 -175.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' LYS . . . . . 0.675 ' NZ ' ' O ' ' C' ' 73' ' ' SER . 0.0 OUTLIER -72.91 134.71 44.9 Favored 'General case' 0 CA--C 1.498 -1.054 0 C-N-CA 118.001 -1.479 . . . . 56.960000000000001 109.3 175.252 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.94 50.54 0.04 OUTLIER 'General case' 0 CA--C 1.477 -1.858 0 N-CA-C 120.314 3.45 . . . . 68.049999999999997 120.314 -172.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' THR . . . . . 0.41 ' N ' ' OG ' ' A' ' 61' ' ' SER . 0.2 OUTLIER -171.92 157.89 4.61 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 121.192 1.814 . . . . 80.0 110.444 179.721 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.784 0 C-N-CA 128.603 2.761 . . . . 80.0 111.191 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 902' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 900' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 901' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 903' ' ' HOH . . . . . 0.681 ' O ' ' NE2' ' A' ' 75' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 921' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 922' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 923' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 924' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 925' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 926' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 941' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 904' ' ' HOH . . . . . 0.65 ' O ' ' NE2' ' B' ' 75' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 927' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 928' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 930' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 931' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 933' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 934' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 935' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 936' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 937' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 938' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 939' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 940' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 942' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 943' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 944' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 954' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 961' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 962' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 929' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 932' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 949' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 950' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 951' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 952' ' ' HOH . . . . . 0.64 ' O ' ' N ' ' C' ' 108' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 953' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 955' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 956' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 957' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 958' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 959' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 960' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.202 0 N-CA-C 110.691 -0.964 . . . . 80.0 110.691 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.313 4.0 mm-40 -82.71 138.77 33.98 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 114.754 1.39 . . . . 80.0 114.754 -178.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -50.62 123.67 9.33 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 113.267 -1.788 . . . . 63.99 107.61 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 t -128.83 172.49 11.25 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.238 1.199 . . . . 45.69 114.238 -174.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 28.3 m -73.35 -9.83 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 C-N-CA 120.159 -0.617 . . . . 19.91 111.454 173.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.0 m -141.9 130.68 22.87 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.361 1.064 . . . . 24.55 112.816 178.261 -64.442 -76.382 -85.511 103.511 1.99 105.504 -87.576 -60.194 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -86.89 128.55 35.06 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 123.007 1.384 . . . . 34.96 114.04 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.8 p -123.24 170.19 10.52 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 120.149 -1.594 . . . . 32.95 114.277 -175.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 18' ' ' VAL . 4.0 p -139.85 128.46 26.96 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.51 -0.922 . . . . 42.31 108.51 -178.121 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.1 m -118.15 148.74 42.04 Favored 'General case' 0 CA--C 1.484 -1.583 0 CA-C-O 122.337 1.065 . . . . 23.7 112.389 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . 0.475 HG22 ' N ' ' A' ' 21' ' ' TRP . 8.1 p -163.78 159.28 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.285 -2.217 0 C-N-CA 115.812 -2.355 . . . . 61.16 109.747 178.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' TRP . . . . . 0.475 ' N ' HG22 ' A' ' 20' ' ' VAL . 88.8 m95 -93.18 122.72 35.86 Favored 'General case' 0 C--N 1.347 0.487 0 O-C-N 123.831 0.707 . . . . 21.64 109.402 176.049 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.0 m -110.77 120.89 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.452 0 C-N-CA 123.113 0.565 . . . . 18.12 110.864 177.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -111.66 9.94 27.99 Favored Glycine 0 CA--C 1.523 0.576 0 CA-C-O 121.561 0.534 . . . . 28.54 112.818 -177.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -128.74 19.12 6.16 Favored 'General case' 0 C--O 1.209 -1.062 0 N-CA-C 114.758 1.392 . . . . 52.89 114.758 -179.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.9 ttmm -55.64 135.33 51.26 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 106.324 -1.732 . . . . 75.24 106.324 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . 0.506 ' OG1' HG22 ' A' ' 27' ' ' THR . 76.9 p -124.36 -23.73 4.42 Favored 'General case' 0 CA--C 1.48 -1.738 0 C-N-CA 116.997 -1.881 . . . . 25.83 107.559 179.309 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' THR . . . . . 0.506 HG22 ' OG1' ' A' ' 26' ' ' THR 0.317 0.6 OUTLIER -122.81 145.2 48.64 Favored 'General case' 0 N--CA 1.419 -2.009 0 C-N-CA 114.222 -2.991 . . . . 31.49 111.703 -175.977 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -162.59 172.65 15.07 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 118.603 -1.239 . . . . 21.6 112.829 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 87.3 m -113.32 122.84 48.61 Favored 'General case' 0 C--O 1.245 0.839 0 O-C-N 125.386 1.679 . . . . 36.84 109.211 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . 0.43 ' HA ' ' HA ' ' A' ' 102' ' ' ILE . 5.3 p-10 -73.55 176.18 6.38 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 114.659 -1.155 . . . . 29.74 108.412 -179.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . 0.453 HG23 ' N ' ' A' ' 32' ' ' LYS . 10.2 tt -60.34 -30.57 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.554 0 O-C-N 124.342 1.026 . . . . 36.53 113.27 -178.493 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . 0.453 ' N ' HG23 ' A' ' 31' ' ' ILE . 3.7 mtpt -80.57 -3.19 49.35 Favored 'General case' 0 CA--C 1.494 -1.178 0 O-C-N 123.545 0.528 . . . . 80.0 111.197 -179.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.66 6.8 76.27 Favored Glycine 0 CA--C 1.541 1.672 0 CA-C-O 122.481 1.045 . . . . 33.2 114.368 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.5 mtmp? -90.64 139.46 30.69 Favored 'General case' 0 N--CA 1.419 -1.979 0 O-C-N 121.951 -0.735 . . . . 80.0 109.653 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 36' ' ' VAL . 4.3 tt0 -75.07 145.78 42.04 Favored 'General case' 0 C--O 1.196 -1.743 0 O-C-N 121.61 -0.681 . . . . 80.0 112.51 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . 0.449 ' N ' ' HG3' ' A' ' 35' ' ' GLU . 26.3 m -147.34 167.56 5.29 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 C-N-CA 118.857 -1.137 . . . . 21.16 110.024 -179.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 45.7 m -100.67 137.64 38.8 Favored 'General case' 0 N--CA 1.425 -1.707 0 CA-C-O 122.33 1.062 . . . . 22.01 110.493 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.0 t -93.81 116.59 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.202 0 CA-C-N 115.152 -0.931 . . . . 19.0 112.678 179.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 39' ' ' LEU 0.293 10.4 mp -56.95 135.38 56.11 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 122.59 1.186 . . . . 26.55 112.282 178.306 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.58 -35.68 67.99 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 115.448 1.647 . . . . 38.77 115.448 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -123.89 132.94 53.83 Favored 'General case' 0 CA--C 1.481 -1.699 0 N-CA-C 107.172 -1.418 . . . . 80.0 107.172 -176.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 49' ' ' PHE . 12.0 p -112.03 138.59 40.28 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.118 0 C-N-CA 116.93 -1.908 . . . . 62.15 107.35 175.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . 0.737 ' C ' HD13 ' A' ' 44' ' ' ILE . 11.7 t30 -112.92 106.1 14.31 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 123.369 1.556 . . . . 80.0 114.67 -179.222 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . 0.737 HD13 ' C ' ' A' ' 43' ' ' ASN . 1.5 mm -106.45 125.07 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 118.574 -1.251 . . . . 72.09 112.455 180.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 51.1 m-20 51.8 42.67 30.14 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 122.159 0.981 . . . . 80.0 111.143 179.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 66.49 25.42 10.16 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 122.368 1.08 . . . . 80.0 112.972 179.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' SER . . . . . 0.883 ' HB3' ' CZ ' ' A' ' 49' ' ' PHE . 0.3 OUTLIER -125.52 129.98 50.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 112.69 -2.05 . . . . 80.0 106.18 175.402 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 42' ' ' VAL . 0.3 OUTLIER -109.25 132.26 57.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 113.616 0.969 . . . . 54.66 113.616 -177.689 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . 0.883 ' CZ ' ' HB3' ' A' ' 47' ' ' SER . 0.1 OUTLIER -133.77 159.58 40.16 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 114.609 1.337 . . . . 75.17 114.609 -179.445 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -79.03 148.21 32.58 Favored 'General case' 0 C--N 1.354 0.785 0 CA-C-N 114.546 -1.207 . . . . 80.0 109.711 176.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -96.23 117.63 31.17 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 120.873 -1.142 . . . . 25.55 109.855 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -109.04 142.25 40.02 Favored 'General case' 0 CA--C 1.485 -1.537 0 O-C-N 120.885 -1.134 . . . . 39.62 113.658 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -130.84 143.4 50.71 Favored 'General case' 0 CA--C 1.505 -0.772 0 O-C-N 126.048 2.092 . . . . 20.07 110.67 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -107.46 108.9 20.44 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 105.102 -2.184 . . . . 21.3 105.102 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . 0.444 ' HG2' HG23 ' A' ' 104' ' ' ILE . 26.5 mt-10 -109.92 142.46 41.23 Favored 'General case' 0 C--N 1.363 1.155 0 N-CA-C 114.261 1.208 . . . . 47.55 114.261 -175.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 89.5 m -129.97 121.23 26.15 Favored 'General case' 0 CA--C 1.483 -1.611 0 O-C-N 124.707 1.255 . . . . 28.34 107.936 178.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . 0.437 ' O ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -114.92 157.6 23.14 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 126.601 2.438 . . . . 80.0 112.207 -179.792 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.275 56.6 m -75.65 149.94 38.07 Favored 'General case' 0 N--CA 1.421 -1.9 0 N-CA-C 106.568 -1.641 . . . . 25.32 106.568 174.668 -75.078 -59.023 104.937 102.522 1.967 102.303 77.899 -176.389 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ARG . . . . . 0.416 ' CZ ' ' HB3' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -76.72 -38.75 53.73 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.123 -0.631 . . . . 80.0 110.958 173.41 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.03 161.77 41.25 Favored 'General case' 0 CA--C 1.483 -1.634 0 N-CA-C 106.128 -1.804 . . . . 28.38 106.128 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' SER . . . . . 0.41 ' OG ' ' N ' ' C' ' 117' ' ' THR . 3.6 p -79.29 -14.63 58.89 Favored 'General case' 0 C--N 1.31 -1.133 0 C-N-CA 119.043 -1.063 . . . . 59.9 110.244 177.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . 0.429 ' OD1' ' HA2' ' A' ' 67' ' ' GLY . 4.3 m-80 -141.71 86.98 10.38 Favored Pre-proline 0 N--CA 1.439 -0.983 0 C-N-CA 119.654 -0.818 . . . . 70.05 111.091 -179.576 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -56.05 -13.02 8.33 Favored 'Trans proline' 0 CA--C 1.509 -0.727 0 C-N-CA 122.565 2.177 . . . . 39.45 111.126 179.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -151.33 153.68 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.814 0 N-CA-C 105.954 -1.869 . . . . 33.33 105.954 -176.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.389 0.6 OUTLIER -41.54 -54.39 3.19 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 116.582 2.068 . . . . 80.0 116.582 -173.412 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.1 p -69.42 -11.07 60.51 Favored 'General case' 0 N--CA 1.439 -0.979 0 N-CA-C 116.449 2.018 . . . . 80.0 116.449 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . 0.429 ' HA2' ' OD1' ' A' ' 62' ' ' ASN . . . 132.01 -125.45 4.29 Favored Glycine 0 CA--C 1.53 1.03 0 N-CA-C 110.828 -0.909 . . . . 26.98 110.828 -177.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 3.8 m -76.76 150.19 36.24 Favored 'General case' 0 C--O 1.209 -1.041 0 C-N-CA 118.537 -1.265 . . . . 20.79 112.413 176.092 -39.48 153.505 101.211 101.606 2.025 104.494 77.244 -174.266 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 10.7 ttm105 -73.98 135.93 43.18 Favored 'General case' 0 N--CA 1.437 -1.125 0 O-C-N 121.821 -0.55 . . . . 24.42 111.554 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 97.84 -10.54 64.3 Favored Glycine 0 C--O 1.253 1.298 0 N-CA-C 118.326 2.09 . . . . 25.68 118.326 177.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.3 mm -71.84 138.95 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.158 0 N-CA-C 117.443 2.386 . . . . 38.67 117.443 -175.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASP . . . . . 0.651 ' OD2' ' NE2' ' A' ' 75' ' ' HIS . 44.4 t0 -71.05 89.78 0.82 Allowed 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 103.838 -2.653 . . . . 44.31 103.838 173.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.3 p -75.43 13.44 0.76 Allowed 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 117.872 2.545 . . . . 80.0 117.872 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . . . -90.08 -24.73 21.05 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 119.701 -1.875 . . . . 48.67 106.722 175.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' HIS . . . . . 0.651 ' NE2' ' OD2' ' A' ' 72' ' ' ASP 0.253 0.0 OUTLIER -114.83 -7.09 12.65 Favored 'General case' 0 N--CA 1.413 -2.316 0 N-CA-C 116.194 1.924 . . . . 76.92 116.194 -178.2 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 76' ' ' TRP . . . . . 0.524 ' CZ3' ' HG2' ' A' ' 114' ' ' ARG . 11.8 m95 -140.88 156.93 46.01 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 121.447 1.93 . . . . 26.36 115.276 -179.884 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . 0.449 ' OD1' ' HE2' ' A' ' 115' ' ' LYS . 85.4 m-20 -104.14 154.93 19.15 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 103.761 -2.681 . . . . 25.52 103.761 168.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.6 p -161.76 160.51 28.47 Favored 'General case' 0 C--O 1.209 -1.058 0 C-N-CA 119.239 -0.984 . . . . 16.95 112.314 179.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' TYR . . . . . 0.436 ' HD1' ' CZ ' ' B' ' 12' ' ' PHE . 52.4 p90 -160.56 162.73 33.01 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-O 116.976 -1.488 . . . . 15.72 107.41 174.838 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 81.7 m -100.44 134.85 42.77 Favored 'General case' 0 CA--C 1.479 -1.786 0 O-C-N 125.643 1.84 . . . . 19.53 112.064 -176.734 -60.194 -87.576 -85.511 105.504 1.99 103.511 -76.382 -64.442 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 t -138.68 163.28 32.52 Favored 'General case' 0 N--CA 1.411 -2.404 0 CA-C-O 122.822 1.296 . . . . 27.68 110.065 -178.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . 0.504 ' HA ' ' O ' ' A' ' 107' ' ' ALA . 14.8 m -98.48 143.84 28.47 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 114.108 -1.405 . . . . 28.32 114.486 -177.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . 0.332 3.0 p -119.81 173.19 7.19 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 118.092 -1.443 . . . . 33.99 112.87 176.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HIS . . . . . 0.509 ' NE2' ' OD1' ' A' ' 105' ' ' ASP . 68.9 m80 -123.03 155.49 36.76 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 117.341 2.348 . . . . 27.14 117.341 -171.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.4 t -124.82 174.85 7.65 Favored 'General case' 0 C--O 1.209 -1.077 0 N-CA-C 104.57 -2.381 . . . . 20.78 104.57 167.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -121.89 126.42 48.63 Favored 'General case' 0 CA--C 1.474 -1.949 0 CA-C-N 121.181 1.81 . . . . 22.63 110.565 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . 0.496 HG22 HD13 ' A' ' 104' ' ' ILE . 1.0 OUTLIER -123.29 141.43 43.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 O-C-N 125.426 1.703 . . . . 29.49 112.695 176.265 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LYS . . . . . 0.581 ' HG3' ' CZ ' ' A' ' 101' ' ' PHE . 8.8 mttp -70.56 143.25 51.64 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 116.596 -2.041 . . . . 80.0 107.119 178.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -147.57 149.58 32.84 Favored 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 108.203 -1.036 . . . . 19.5 108.203 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 98' ' ' ALA . 2.2 tp -79.37 111.76 15.94 Favored 'General case' 0 C--O 1.256 1.435 0 N-CA-C 108.072 -1.084 . . . . 22.4 108.072 172.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . 0.341 67.3 p -127.76 -176.77 3.87 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 122.168 0.985 . . . . 21.02 112.336 179.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.297 14.2 t -152.98 141.77 21.07 Favored 'General case' 0 CA--C 1.484 -1.564 0 C-N-CA 124.815 1.246 . . . . 19.13 111.435 171.508 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . 0.475 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 34.6 p-10 -108.6 12.03 26.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 113.983 -1.462 . . . . 27.34 108.685 177.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 93' ' ' ASP 0.304 69.8 mt-10 89.29 -17.2 0.25 Allowed 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 113.66 0.985 . . . . 30.74 113.66 178.576 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -100.45 -52.34 3.39 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 123.317 0.647 . . . . 80.0 110.808 174.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -136.76 136.34 38.84 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 113.088 0.773 . . . . 80.0 113.088 177.605 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -97.51 124.28 41.69 Favored 'General case' 0 C--O 1.249 1.05 0 CA-C-O 121.88 0.848 . . . . 36.13 109.455 -179.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . 0.44 ' O ' HD12 ' A' ' 90' ' ' LEU 0.269 . . -160.55 -178.5 6.93 Favored 'General case' 0 CA--C 1.493 -1.218 0 C-N-CA 118.516 -1.273 . . . . 31.45 111.562 -177.283 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . 0.267 89.6 m95 -90.24 128.21 36.34 Favored 'General case' 0 CA--C 1.47 -2.117 0 N-CA-C 106.964 -1.495 . . . . 21.45 106.964 173.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 25.2 mtt85 -131.65 168.69 17.29 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.447 -1.316 . . . . 19.54 107.447 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' PHE . . . . . 0.581 ' CZ ' ' HG3' ' A' ' 88' ' ' LYS . 8.7 m-85 -95.07 122.33 37.61 Favored 'General case' 0 C--O 1.249 1.042 0 N-CA-C 105.27 -2.122 . . . . 33.96 105.27 177.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ILE . . . . . 0.494 HG12 HD12 ' A' ' 104' ' ' ILE . 0.1 OUTLIER -110.63 162.81 7.91 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.149 0 O-C-N 124.484 1.115 . . . . 20.45 110.577 -179.627 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.56 149.32 25.03 Favored 'General case' 0 N--CA 1.42 -1.938 0 C-N-CA 114.827 -2.749 . . . . 52.65 108.132 179.141 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ILE . . . . . 0.496 HD13 HG22 ' A' ' 87' ' ' VAL . 1.2 mp -137.95 126.44 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.218 0 O-C-N 125.851 1.969 . . . . 28.66 108.262 176.815 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASP . . . . . 0.509 ' OD1' ' NE2' ' A' ' 84' ' ' HIS . 55.9 m-20 -70.91 135.16 47.81 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 105.109 -2.182 . . . . 39.59 105.109 -173.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.2 p -122.55 -12.39 8.15 Favored 'General case' 0 CA--C 1.501 -0.905 0 O-C-N 125.333 1.646 . . . . 32.26 114.274 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . 0.504 ' O ' ' HA ' ' A' ' 82' ' ' THR . . . -162.98 166.22 24.04 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 117.842 -1.543 . . . . 18.16 113.701 -178.672 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 41.9 t -126.63 102.86 7.27 Favored 'General case' 0 CA--C 1.474 -1.944 0 N-CA-C 105.568 -2.012 . . . . 16.99 105.568 179.949 -176.389 77.899 104.937 102.303 1.967 102.522 -59.023 -75.078 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 9.3 m -113.53 164.01 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.442 0 N-CA-C 107.609 -1.256 . . . . 15.83 107.609 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 48.8 t -101.47 124.05 46.51 Favored 'General case' 0 CA--C 1.488 -1.407 0 C-N-CA 125.693 1.597 . . . . 17.19 111.707 -176.998 -174.266 77.244 101.211 104.494 2.025 101.606 153.505 -39.48 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -104.41 141.4 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 C-N-CA 118.326 -1.35 . . . . 22.56 107.615 176.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . 0.41 ' HA ' HD12 ' A' ' 112' ' ' LEU 0.319 0.0 OUTLIER -107.18 162.03 14.25 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 113.912 -1.494 . . . . 28.75 113.482 -174.342 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -156.06 128.53 7.72 Favored 'General case' 0 C--O 1.266 1.953 0 N-CA-C 108.288 -1.004 . . . . 62.74 108.288 172.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . 0.524 ' HG2' ' CZ3' ' A' ' 76' ' ' TRP . 1.5 mtp180 -64.9 131.28 46.27 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 112.76 -2.018 . . . . 79.34 112.554 -178.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . 0.449 ' HE2' ' OD1' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -61.89 130.1 44.07 Favored 'General case' 0 N--CA 1.419 -1.999 0 O-C-N 125.27 1.606 . . . . 80.0 108.304 177.383 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -74.43 118.46 17.41 Favored 'General case' 0 C--N 1.349 0.579 0 O-C-N 124.999 1.437 . . . . 80.0 111.38 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 33.0 m . . . . . 0 C--O 1.245 0.821 0 CA-C-O 122.871 1.32 . . . . 80.0 112.591 -178.555 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.309 0 N-CA-C 110.177 -1.169 . . . . 60.41 110.177 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . 0.322 0.6 OUTLIER -113.7 133.0 55.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 124.011 1.863 . . . . 80.0 115.239 -177.215 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 12' ' ' PHE . . . . . 0.436 ' CZ ' ' HD1' ' A' ' 79' ' ' TYR . 43.6 m-85 -113.87 158.49 20.98 Favored 'General case' 0 N--CA 1.413 -2.289 0 N-CA-C 104.326 -2.472 . . . . 30.02 104.326 176.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 4.2 p -115.52 157.35 24.18 Favored 'General case' 0 N--CA 1.42 -1.952 0 CA-C-O 122.135 0.969 . . . . 67.17 110.662 -175.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' VAL . . . . . 0.426 HG12 ' HB2' ' B' ' 110' ' ' CYS . 20.5 t -80.4 -30.76 12.6 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-O 122.931 1.348 . . . . 19.13 112.946 -177.045 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' CYS . . . . . . . . . . . . . 57.1 m -138.37 139.02 38.81 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.15 -0.932 . . . . 31.23 109.026 179.284 -74.856 -80.078 -83.362 107.186 2.023 104.937 -79.172 -57.897 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ASP . . . . . 0.48 ' CG ' HH22 ' B' ' 69' ' ' ARG . 73.3 m-20 -90.38 123.67 34.31 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 123.554 1.645 . . . . 35.97 112.2 -178.16 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 26.8 p -116.63 167.03 11.44 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 118.76 -1.176 . . . . 26.17 110.966 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.35 126.41 40.31 Favored 'Isoleucine or valine' 0 C--O 1.245 0.824 0 CA-C-N 115.298 -0.865 . . . . 51.34 108.883 176.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' SER . . . . . . . . . . . . . 1.5 m -110.12 139.42 45.28 Favored 'General case' 0 C--O 1.244 0.806 0 N-CA-C 115.956 1.836 . . . . 30.37 115.956 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 10.5 m -150.3 176.64 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.939 0 O-C-N 121.134 -0.979 . . . . 24.77 111.564 -177.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -118.99 124.47 47.09 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.767 -1.197 . . . . 22.12 107.767 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 39.1 t -105.28 125.36 60.44 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.98 0 CA-C-N 115.566 -0.743 . . . . 25.42 109.334 -176.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -118.33 1.7 16.37 Favored Glycine 0 C--N 1.337 0.627 0 C-N-CA 118.607 -1.759 . . . . 29.04 114.466 -177.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 40.5 p-10 -124.75 28.16 6.6 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 115.24 1.57 . . . . 40.9 115.24 -178.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 3.1 ttmm -59.54 135.04 57.55 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 108.171 -1.048 . . . . 36.64 108.171 178.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 67.1 p -122.22 -22.03 5.7 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 118.203 -1.399 . . . . 25.68 111.621 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.37 153.66 42.19 Favored 'General case' 0 N--CA 1.409 -2.524 0 CA-C-O 123.6 1.667 . . . . 33.07 113.801 177.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.0 171.76 18.77 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 118.587 -1.245 . . . . 22.69 112.077 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . 0.432 0.2 OUTLIER -104.93 128.62 53.26 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 123.257 1.503 . . . . 50.13 111.422 174.528 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ASP . . . . . 0.505 ' OD1' ' HG2' ' B' ' 34' ' ' LYS 0.277 24.9 p-10 -83.3 -175.17 5.7 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 117.095 2.257 . . . . 37.5 117.095 -176.259 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ILE . . . . . 0.445 HD11 ' HZ2' ' C' ' 21' ' ' TRP . 7.7 tt -61.22 -34.95 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.778 0 CA-C-N 113.342 -1.754 . . . . 80.0 111.694 -178.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -75.79 -10.01 59.08 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 121.865 0.84 . . . . 80.0 111.782 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.83 14.16 56.91 Favored Glycine 0 N--CA 1.441 -1.025 0 O-C-N 121.18 -0.95 . . . . 37.1 113.127 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' LYS . . . . . 0.505 ' HG2' ' OD1' ' B' ' 30' ' ' ASP . 10.5 ptmt -102.72 143.94 31.72 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 119.513 -0.875 . . . . 80.0 113.295 -177.74 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.58 118.74 13.76 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 114.435 -1.257 . . . . 42.13 112.763 -178.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.41 172.94 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 115.154 1.539 . . . . 35.1 115.154 -177.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' THR . . . . . 0.558 ' O ' ' N ' ' B' ' 92' ' ' THR . 52.5 m -113.02 127.62 56.28 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-O 122.798 1.285 . . . . 49.33 111.51 -178.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 76.1 t -92.6 120.06 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.775 0 CA-C-N 111.815 -2.448 . . . . 36.99 110.907 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LEU . . . . . 0.67 ' O ' ' NE2' ' B' ' 51' ' ' GLN . 0.0 OUTLIER -68.01 126.01 28.13 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 122.5 1.143 . . . . 46.55 110.719 178.388 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.09 -50.63 73.33 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 114.087 -1.415 . . . . 48.4 112.593 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . . . -105.42 166.52 10.37 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 114.593 1.331 . . . . 66.18 114.593 -177.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' VAL . . . . . 0.653 ' N ' ' O ' ' B' ' 49' ' ' PHE 0.345 0.4 OUTLIER -155.2 122.68 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 118.299 2.703 . . . . 69.89 118.299 178.28 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ASN . . . . . 0.588 ' HA ' ' O ' ' B' ' 47' ' ' SER . 51.4 t-20 -108.17 109.9 21.41 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.044 -1.889 . . . . 80.0 111.139 178.271 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . . . -134.62 119.78 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.754 0 C-N-CA 126.171 1.788 . . . . 80.0 108.382 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ASN . . . . . 0.657 HD22 ' HA ' ' C' ' 44' ' ' ILE 0.348 40.4 m-20 57.17 58.79 3.72 Favored 'General case' 0 CA--C 1.554 1.111 0 O-C-N 125.126 1.516 . . . . 80.0 113.653 -175.948 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . . . 51.13 55.12 10.01 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 114.349 1.24 . . . . 80.0 114.349 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' SER . . . . . 0.588 ' O ' ' HA ' ' B' ' 43' ' ' ASN . . . -156.41 161.9 40.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 122.105 -0.372 . . . . 80.0 110.747 177.335 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.314 2.5 t -132.59 125.23 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 C-N-CA 115.181 -2.608 . . . . 80.0 116.594 -177.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' PHE . . . . . 0.653 ' O ' ' N ' ' B' ' 42' ' ' VAL . 1.4 m-85 -138.69 162.48 34.57 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 112.872 -1.967 . . . . 65.2 114.585 -176.861 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.97 145.46 28.64 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 110.519 -3.037 . . . . 80.0 107.585 179.099 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLN . . . . . 0.67 ' NE2' ' O ' ' B' ' 39' ' ' LEU . 16.3 mt-30 -86.0 121.85 29.2 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.012 -1.449 . . . . 33.0 109.985 -179.583 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -118.71 142.8 47.34 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.352 -0.981 . . . . 27.51 108.352 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -137.53 130.37 30.2 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 126.185 2.178 . . . . 25.27 109.629 -176.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -91.34 116.54 28.92 Favored 'General case' 0 N--CA 1.416 -2.131 0 CA-C-N 114.571 -1.195 . . . . 22.74 108.351 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -118.03 147.43 43.23 Favored 'General case' 0 CA--C 1.489 -1.396 0 N-CA-C 114.85 1.426 . . . . 23.34 114.85 -175.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 40.1 m -130.49 136.2 48.73 Favored 'General case' 0 CA--C 1.48 -1.713 0 O-C-N 123.81 0.694 . . . . 18.68 110.514 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -140.43 167.76 21.39 Favored 'General case' 0 N--CA 1.439 -1.002 0 O-C-N 126.328 2.268 . . . . 80.0 110.449 -177.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 98.0 m -75.62 136.51 40.47 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 114.187 -1.37 . . . . 24.97 110.389 177.047 -69.259 -54.219 97.358 102.447 2.034 107.569 77.139 -166.676 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -70.96 -31.73 68.39 Favored 'General case' 0 CA--C 1.482 -1.658 0 N-CA-C 102.027 -3.323 . . . . 80.0 102.027 175.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -163.41 153.59 15.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.911 -1.495 . . . . 44.68 113.673 -176.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 9.9 t -73.43 -33.19 64.8 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 113.002 -1.908 . . . . 80.0 112.216 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -127.18 71.74 76.35 Favored Pre-proline 0 C--O 1.215 -0.732 0 CA-C-O 121.733 0.777 . . . . 80.0 110.07 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -41.91 -39.6 5.5 Favored 'Trans proline' 0 C--N 1.319 -0.986 0 C-N-CA 123.792 2.995 . . . . 41.07 113.03 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' VAL . . . . . 0.608 HG12 ' H ' ' B' ' 67' ' ' GLY . 0.5 OUTLIER -118.56 174.58 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.622 0 CA-C-N 113.101 -1.863 . . . . 48.55 108.122 -178.894 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLU . . . . . 0.586 ' N ' HG13 ' B' ' 64' ' ' VAL . . . -59.44 -57.82 11.29 Favored 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 117.207 -1.797 . . . . 51.31 110.855 -179.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.9 -34.33 59.2 Favored 'General case' 0 C--N 1.346 0.424 0 O-C-N 127.044 2.715 . . . . 80.0 115.439 -178.447 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . 0.608 ' H ' HG12 ' B' ' 64' ' ' VAL . . . 144.63 -118.62 1.16 Allowed Glycine 0 C--O 1.218 -0.886 0 N-CA-C 108.021 -2.032 . . . . 39.25 108.021 -179.204 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' CYS . . . . . . . . . . . . 0.273 1.4 m -74.96 155.34 37.5 Favored 'General case' 0 C--O 1.213 -0.849 0 C-N-CA 117.303 -1.759 . . . . 26.29 112.632 176.94 -28.882 149.699 86.567 98.958 2.013 102.704 79.226 -178.255 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ARG . . . . . 0.48 HH22 ' CG ' ' B' ' 16' ' ' ASP . 17.5 ttp-105 -81.58 131.68 35.28 Favored 'General case' 0 N--CA 1.425 -1.724 0 C-N-CA 119.163 -1.015 . . . . 47.04 110.794 -175.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' GLY . . . . . 0.461 ' HA3' HD21 ' C' ' 112' ' ' LEU . . . 98.2 -11.76 63.68 Favored Glycine 0 C--O 1.218 -0.857 0 CA-C-O 118.912 -0.938 . . . . 26.89 113.875 175.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ILE . . . . . 0.58 HG22 ' N ' ' B' ' 72' ' ' ASP . 7.0 mm -66.49 161.45 3.45 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-N 117.941 0.87 . . . . 33.87 110.78 -178.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ASP . . . . . 0.58 ' N ' HG22 ' B' ' 71' ' ' ILE . 14.1 t0 -100.63 74.28 1.67 Allowed 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.669 1.588 . . . . 40.41 107.357 178.065 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' SER . . . . . 0.494 ' O ' ' NZ ' ' B' ' 115' ' ' LYS . 79.7 p -61.2 -13.73 20.34 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 114.0 -1.454 . . . . 44.88 111.273 -176.773 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . . . -66.82 -21.76 66.02 Favored 'General case' 0 C--O 1.194 -1.863 0 C-N-CA 114.283 -2.967 . . . . 34.86 106.72 179.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' HIS . . . . . 0.65 ' NE2' ' O ' ' B' ' 904' ' ' HOH . 45.3 m80 -129.02 -2.73 5.15 Favored 'General case' 0 CA--C 1.493 -1.245 0 C-N-CA 118.466 -1.294 . . . . 70.8 111.572 -177.262 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' TRP . . . . . 0.585 ' CH2' ' HD2' ' B' ' 114' ' ' ARG 0.275 74.2 m95 -137.02 150.51 48.15 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 117.319 -1.752 . . . . 39.81 115.103 -177.326 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ASN . . . . . 0.65 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 66.0 m-20 -106.99 140.14 40.26 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.888 -1.152 . . . . 80.0 107.888 172.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . 0.294 89.2 p -156.63 154.67 30.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 115.707 1.743 . . . . 34.9 115.707 -179.688 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -148.46 171.79 15.5 Favored 'General case' 0 N--CA 1.427 -1.599 0 C-N-CA 115.307 -2.557 . . . . 46.37 109.448 171.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 66.9 m -94.23 142.68 27.13 Favored 'General case' 0 C--N 1.359 0.995 0 O-C-N 125.981 2.05 . . . . 25.99 113.257 179.62 -57.897 -79.172 -83.362 104.937 2.023 107.186 -80.078 -74.856 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 5.1 t -150.83 155.17 38.66 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-O 123.572 1.653 . . . . 51.64 113.692 -178.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' B' ' 107' ' ' ALA . 5.0 t -91.86 132.77 36.22 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 113.972 -1.467 . . . . 26.45 110.738 -176.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 63.9 p -109.54 157.62 18.82 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 126.386 2.304 . . . . 21.36 111.888 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -114.53 170.27 8.43 Favored 'General case' 0 C--O 1.195 -1.784 0 N-CA-C 115.683 1.734 . . . . 30.43 115.683 -172.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' THR . . . . . 0.552 HG22 ' HD2' ' C' ' 54' ' ' PHE 0.257 0.2 OUTLIER -140.34 -177.65 5.12 Favored 'General case' 0 CA--C 1.47 -2.124 0 N-CA-C 101.163 -3.643 . . . . 42.87 101.163 174.376 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 86' ' ' PHE . . . . . 0.479 ' H ' HG22 ' B' ' 85' ' ' THR . 49.2 m-85 -127.07 142.12 51.61 Favored 'General case' 0 CA--C 1.47 -2.107 0 O-C-N 127.318 2.886 . . . . 34.92 107.393 179.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' B' ' 101' ' ' PHE . 74.5 t -144.29 145.62 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.652 0 O-C-N 126.272 2.233 . . . . 28.28 108.768 -177.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.43 132.47 40.87 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.253 -0.885 . . . . 80.0 110.076 179.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ALA . . . . . 0.766 ' HB3' HD13 ' B' ' 102' ' ' ILE . . . -144.06 152.04 40.45 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 119.609 -0.836 . . . . 28.87 112.022 177.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 8.4 tp -83.14 123.72 29.81 Favored 'General case' 0 CA--C 1.487 -1.454 0 C-N-CA 117.651 -1.62 . . . . 46.7 108.524 176.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . 0.255 72.2 p -134.48 -166.07 1.75 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.286 1.587 . . . . 34.36 115.286 -176.596 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' THR . . . . . 0.558 ' N ' ' O ' ' B' ' 37' ' ' THR . 6.1 t -163.87 123.77 2.1 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 113.797 -1.547 . . . . 53.02 114.572 174.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -86.5 39.51 0.84 Allowed 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 128.613 2.765 . . . . 80.0 110.012 179.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLU . . . . . 0.698 ' HA ' ' OE1' ' B' ' 94' ' ' GLU 0.399 0.0 OUTLIER 82.51 -43.07 0.13 Allowed 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 110.687 -2.96 . . . . 80.0 110.874 -176.915 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . . . -109.31 -53.54 2.64 Favored 'General case' 0 C--O 1.252 1.196 0 C-N-CA 117.87 -1.532 . . . . 80.0 114.23 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' GLN . . . . . 0.529 ' O ' ' HA ' ' B' ' 92' ' ' THR . 2.0 tt0 -77.67 124.44 27.94 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 112.895 -1.957 . . . . 80.0 115.898 -176.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -98.9 102.5 14.25 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 106.593 -1.632 . . . . 68.43 106.593 174.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -141.48 150.06 41.73 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 115.292 1.59 . . . . 55.93 115.292 -174.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -71.62 142.77 49.95 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 117.702 -1.599 . . . . 44.09 107.684 172.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 4.7 mtm180 -152.08 157.76 42.07 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 109.597 -0.52 . . . . 63.34 109.597 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' PHE . . . . . 0.451 ' HA ' ' O ' ' B' ' 87' ' ' VAL . 43.1 m-85 -92.67 121.24 33.88 Favored 'General case' 0 CA--C 1.479 -1.764 0 O-C-N 125.198 1.561 . . . . 40.07 107.076 177.914 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ILE . . . . . 0.766 HD13 ' HB3' ' B' ' 89' ' ' ALA . 0.6 OUTLIER -110.85 164.71 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 C-N-CA 117.291 -1.764 . . . . 33.04 110.579 179.49 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 20.9 ttt-85 -89.69 133.76 34.5 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.582 -1.247 . . . . 80.0 111.379 -176.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 49.3 mm -133.85 146.84 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.813 0.845 . . . . 43.1 110.314 -176.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.48 128.43 35.53 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.062 -1.459 . . . . 21.99 107.062 176.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' B' ' 936' ' ' HOH . 12.5 t -123.56 -14.61 7.28 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 113.922 1.082 . . . . 21.46 113.922 -175.149 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ALA . . . . . 0.531 ' O ' ' HA ' ' B' ' 82' ' ' THR . . . -175.94 165.85 2.98 Favored 'General case' 0 CA--C 1.487 -1.466 0 N-CA-C 117.019 2.229 . . . . 11.53 117.019 -178.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' CYS . . . . . . . . . . . . . 14.7 t -113.49 108.67 17.5 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 109.736 -3.393 . . . . 21.0 112.362 -178.698 -166.676 77.139 97.358 107.569 2.034 102.447 -54.219 -69.259 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 11.3 m -117.91 152.6 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 121.893 0.854 . . . . 22.01 113.063 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' CYS . . . . . 0.426 ' HB2' HG12 ' B' ' 14' ' ' VAL . 51.4 t -88.49 122.3 31.81 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.113 -0.949 . . . . 25.39 113.366 179.178 -178.255 79.226 86.567 102.704 2.013 98.958 149.699 -28.882 2 2 . 1 . 001 ecloud build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 2.2 t -101.38 144.7 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-O 122.499 1.142 . . . . 34.75 112.323 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' B' ' 112' ' ' LEU . 0.2 OUTLIER -108.83 151.07 26.74 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 114.074 1.138 . . . . 34.71 114.074 -175.959 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 113' ' ' SER . . . . . 0.65 ' OG ' ' HB2' ' B' ' 77' ' ' ASN 0.277 4.4 p -150.27 123.61 8.97 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 112.03 -2.35 . . . . 70.41 110.449 173.842 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ARG . . . . . 0.585 ' HD2' ' CH2' ' B' ' 76' ' ' TRP . 2.8 tpt85 -65.63 161.09 21.18 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-N 112.607 -2.088 . . . . 80.0 112.323 -179.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 115' ' ' LYS . . . . . 0.564 ' N ' ' HG3' ' B' ' 114' ' ' ARG 0.314 3.0 ptmt -135.01 141.44 46.2 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 117.59 -1.644 . . . . 80.0 110.728 174.089 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -84.68 94.82 8.73 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.477 -0.764 . . . . 80.0 109.277 177.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' THR . . . . . . . . . . . . . 40.2 p -79.59 -156.26 0.11 Allowed 'General case' 0 C--O 1.24 0.589 0 N-CA-C 119.037 2.977 . . . . 80.0 119.037 -172.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 7.9 ptt85 . . . . . 0 C--N 1.363 1.171 0 C-N-CA 127.072 2.149 . . . . 80.0 111.542 178.47 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.709 0 CA-C-O 120.16 -0.245 . . . . 80.0 113.185 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -129.42 119.34 23.65 Favored 'General case' 0 CA--C 1.498 -1.04 0 N-CA-C 112.669 0.618 . . . . 80.0 112.669 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' PHE . . . . . 0.866 ' HD1' ' H ' ' C' ' 13' ' ' SER . 0.1 OUTLIER -90.52 165.96 13.49 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 118.561 -1.256 . . . . 80.0 111.614 177.797 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 13' ' ' SER . . . . . 0.866 ' H ' ' HD1' ' C' ' 12' ' ' PHE . 31.9 p -105.58 150.71 25.15 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 103.072 -2.936 . . . . 61.81 103.072 175.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 14' ' ' VAL . . . . . 0.592 HG13 ' HB3' ' C' ' 68' ' ' CYS . 0.9 OUTLIER -75.95 -33.26 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 CA-C-O 122.569 1.176 . . . . 29.01 111.189 -176.972 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 15' ' ' CYS . . . . . . . . . . . . . 94.0 m -129.52 156.67 43.78 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-N 114.19 -1.368 . . . . 21.23 107.497 177.378 -69.952 -78.515 -86.773 102.328 2.011 104.233 -90.398 -51.533 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -113.83 146.32 40.14 Favored 'General case' 0 N--CA 1.44 -0.928 0 O-C-N 124.632 1.207 . . . . 37.61 110.905 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 12.1 p -139.2 171.76 13.81 Favored 'General case' 0 C--O 1.207 -1.139 0 C-N-CA 119.6 -0.84 . . . . 21.52 111.084 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' VAL . . . . . 0.519 ' CG1' ' HG3' ' C' ' 59' ' ' ARG . 3.7 m -134.01 131.9 55.97 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.844 0 C-N-CA 126.594 1.957 . . . . 28.54 110.31 179.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 19' ' ' SER . . . . . . . . . . . . . 51.8 m -100.09 162.66 12.83 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 107.921 -1.14 . . . . 28.32 107.921 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -168.97 133.11 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.405 -2.724 0 C-N-CA 115.458 -2.497 . . . . 27.68 108.518 -177.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 21' ' ' TRP . . . . . 0.445 ' HZ2' HD11 ' B' ' 31' ' ' ILE . 89.3 m95 -84.37 113.74 21.38 Favored 'General case' 0 C--O 1.204 -1.301 0 N-CA-C 107.965 -1.124 . . . . 27.81 107.965 177.745 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 58.9 t -103.4 117.72 49.3 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.703 0 N-CA-C 114.486 1.291 . . . . 24.47 114.486 -175.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' GLY . . . . . . . . . . . . . . . -118.05 3.46 16.61 Favored Glycine 0 C--N 1.346 1.108 0 O-C-N 125.806 1.941 . . . . 20.28 111.114 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 41.1 p-10 -126.02 37.0 4.42 Favored 'General case' 0 CA--C 1.478 -1.806 0 CA-C-O 116.467 -1.73 . . . . 28.1 112.332 -175.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' LYS . . . . . 0.498 ' NZ ' ' OE2' ' C' ' 55' ' ' GLU . 15.5 ttmm -85.01 144.39 28.32 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 125.822 1.951 . . . . 80.0 107.487 177.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 26' ' ' THR . . . . . 0.57 ' O ' ' HB ' ' C' ' 37' ' ' THR . 74.8 p -128.15 -23.81 3.24 Favored 'General case' 0 CA--C 1.482 -1.659 0 C-N-CA 117.888 -1.525 . . . . 79.42 111.216 -178.438 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 27' ' ' THR . . . . . . . . . . . . . 52.5 m -131.6 150.28 52.21 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 117.882 -1.527 . . . . 55.49 112.213 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -151.65 171.4 17.7 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 118.663 -1.215 . . . . 28.08 113.589 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 17.3 m -115.33 123.22 48.19 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 105.56 -2.015 . . . . 78.05 105.56 174.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' ASP . . . . . . . . . . . . 0.275 38.1 p30 -78.09 -171.51 2.37 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 118.175 -1.41 . . . . 34.39 112.919 -177.013 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 8.3 tt -69.46 -27.33 33.78 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 N-CA-C 115.647 1.721 . . . . 26.69 115.647 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' LYS . . . . . . . . . . . . . . . -78.35 -21.92 48.79 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 108.822 -0.807 . . . . 43.3 108.822 177.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.77 10.21 23.38 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 114.686 0.634 . . . . 41.12 114.686 174.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' LYS . . . . . . . . . . . . . . . -90.7 146.55 23.91 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 124.534 1.134 . . . . 41.01 112.592 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -75.87 133.22 40.63 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 106.249 -1.76 . . . . 67.43 106.249 175.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' VAL . . . . . 0.454 HG13 ' HB ' ' C' ' 91' ' ' THR . 1.2 t -145.11 156.48 13.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 O-C-N 120.184 -1.573 . . . . 42.93 108.901 -173.684 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 37' ' ' THR . . . . . 0.57 ' HB ' ' O ' ' C' ' 26' ' ' THR 0.404 1.1 p -108.58 134.64 51.06 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 115.207 -2.597 . . . . 52.41 112.91 179.603 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 19.1 t -85.66 123.19 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.861 0 N-CA-C 107.64 -1.244 . . . . 30.3 107.64 -176.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 12.9 mt -72.98 151.82 41.64 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.914 -0.772 . . . . 40.12 108.914 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' C' ' 50' ' ' ARG . . . -72.66 -61.09 1.93 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 116.861 2.171 . . . . 43.63 116.861 -175.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 41' ' ' GLU . . . . . 0.582 ' HB3' ' O ' ' C' ' 49' ' ' PHE . 0.7 OUTLIER -106.23 152.91 22.88 Favored 'General case' 0 C--N 1.299 -1.625 0 C-N-CA 114.845 -2.742 . . . . 80.0 108.862 -179.868 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 42' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' C' ' 49' ' ' PHE 0.335 0.3 OUTLIER -108.7 116.45 51.85 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.696 0 C-N-CA 117.088 -1.845 . . . . 63.69 112.488 177.093 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' C' C ' 43' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' C' ' 47' ' ' SER . . . -101.89 138.28 39.07 Favored 'General case' 0 C--O 1.25 1.098 0 CA-C-N 110.455 -3.066 . . . . 80.0 107.339 173.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 44' ' ' ILE . . . . . 0.657 ' HA ' HD22 ' B' ' 45' ' ' ASN . . . 172.05 131.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.249 1.03 0 C-N-CA 124.161 0.984 . . . . 80.0 109.609 -179.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 45' ' ' ASN . . . . . 0.538 ' N ' ' OD1' ' B' ' 45' ' ' ASN . 0.1 OUTLIER 64.61 42.73 4.66 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 119.359 -0.936 . . . . 80.0 110.425 -178.221 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 46' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' C' ' 46' ' ' ASN . 2.6 p-10 47.24 54.05 9.98 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.484 -1.689 . . . . 80.0 115.17 -178.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 47' ' ' SER . . . . . 0.513 ' O ' ' HA ' ' C' ' 43' ' ' ASN . . . -158.21 153.57 25.89 Favored 'General case' 0 C--N 1.319 -0.719 0 O-C-N 120.545 -1.347 . . . . 80.0 110.378 179.002 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 48' ' ' VAL . . . . . 0.516 HG11 ' OE1' ' C' ' 41' ' ' GLU . 46.7 t -121.25 117.4 52.68 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 0 N-CA-C 115.681 1.734 . . . . 76.48 115.681 -175.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 49' ' ' PHE . . . . . 0.744 ' HB2' HG12 ' C' ' 42' ' ' VAL . 29.0 m-85 -113.39 178.26 4.34 Favored 'General case' 0 CA--C 1.49 -1.363 0 C-N-CA 119.563 -0.855 . . . . 80.0 110.922 177.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 50' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' C' ' 40' ' ' ALA . 4.1 ttp180 -121.1 130.26 53.67 Favored 'General case' 0 CA--C 1.496 -1.108 0 C-N-CA 119.559 -0.857 . . . . 80.0 110.206 174.875 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 51' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -68.02 122.27 17.87 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 115.799 1.778 . . . . 32.63 115.799 -175.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -119.42 141.3 49.22 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.777 -0.647 . . . . 50.37 112.072 174.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -130.39 133.42 46.36 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 108.308 -0.997 . . . . 38.98 108.308 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' PHE . . . . . 0.552 ' HD2' HG22 ' B' ' 85' ' ' THR . 88.9 t80 -87.26 122.52 31.15 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.269 -1.012 . . . . 23.21 108.269 176.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 55' ' ' GLU . . . . . 0.498 ' OE2' ' NZ ' ' C' ' 25' ' ' LYS . 31.0 mt-10 -127.56 150.83 49.52 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 119.563 1.074 . . . . 29.76 112.072 -176.54 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 56' ' ' THR . . . . . . . . . . . . . 18.7 m -135.91 138.92 42.89 Favored 'General case' 0 CA--C 1.488 -1.414 0 N-CA-C 108.074 -1.084 . . . . 25.71 108.074 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 57' ' ' LYS . . . . . 0.626 ' HE2' ' OD2' ' C' ' 105' ' ' ASP . 12.8 ptpt -155.53 171.79 19.35 Favored 'General case' 0 N--CA 1.427 -1.587 0 C-N-CA 118.556 -1.258 . . . . 17.96 109.573 -176.442 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 58' ' ' CYS . . . . . . . . . . . . . 94.9 m -70.81 132.89 45.98 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 117.562 -1.209 . . . . 19.86 111.782 -178.122 -66.133 -54.771 96.183 104.636 2.024 102.646 72.373 179.732 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' ARG . . . . . 0.519 ' HG3' ' CG1' ' C' ' 18' ' ' VAL 0.285 4.6 mtp85 -68.15 -43.73 77.6 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 123.567 1.651 . . . . 61.45 108.531 175.086 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 60' ' ' ALA . . . . . . . . . . . . 0.255 . . -148.08 161.53 41.21 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-N 112.699 -2.046 . . . . 19.67 109.938 179.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 61' ' ' SER . . . . . . . . . . . . . 1.7 p -82.46 -22.59 35.13 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 114.579 1.326 . . . . 26.62 114.579 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -136.11 75.82 52.9 Favored Pre-proline 0 CA--C 1.493 -1.223 0 O-C-N 119.537 -1.977 . . . . 45.29 111.365 -175.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 63' ' ' PRO . . . . . 0.412 ' HD2' ' O ' ' C' ' 67' ' ' GLY . 8.8 Cg_endo -45.14 -35.73 11.13 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.52 2.147 . . . . 34.08 110.762 176.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 64' ' ' VAL . . . . . . . . . . . . . 31.5 m -129.62 173.28 14.31 Favored 'Isoleucine or valine' 0 CA--C 1.444 -3.103 0 N-CA-C 103.755 -2.683 . . . . 27.99 103.755 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.22 -40.81 82.62 Favored 'General case' 0 C--N 1.285 -2.208 0 N-CA-C 116.246 1.943 . . . . 80.0 116.246 -173.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' SER . . . . . . . . . . . . . 6.7 p -82.19 -10.56 59.11 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 113.395 -1.729 . . . . 39.5 112.624 -175.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 67' ' ' GLY . . . . . 0.412 ' O ' ' HD2' ' C' ' 63' ' ' PRO . . . 127.5 -123.82 4.68 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 108.823 -1.711 . . . . 30.1 108.823 -179.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 68' ' ' CYS . . . . . 0.592 ' HB3' HG13 ' C' ' 14' ' ' VAL . 0.0 OUTLIER -73.23 159.65 33.12 Favored 'General case' 0 N--CA 1.424 -1.728 0 CA-C-O 123.194 1.473 . . . . 24.25 111.259 -179.258 -22.293 155.094 93.489 101.77 2.03 106.643 69.582 -170.943 3 3 . 1 . 001 ecloud build full ' C' C ' 69' ' ' ARG . . . . . 0.472 ' O ' HG22 ' C' ' 14' ' ' VAL . 42.5 mtm-85 -77.78 146.17 36.0 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.975 -1.466 . . . . 64.41 110.514 179.561 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.44 -13.3 28.8 Favored Glycine 0 C--N 1.354 1.57 0 CA-C-O 122.251 0.917 . . . . 23.23 114.932 175.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' ILE . . . . . 0.482 ' N ' HD13 ' C' ' 71' ' ' ILE . 0.2 OUTLIER -59.29 139.65 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.75 0 C-N-CA 118.057 -1.457 . . . . 31.32 113.696 -178.803 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 72' ' ' ASP . . . . . 0.655 ' OD2' ' ND1' ' C' ' 75' ' ' HIS . 7.5 t0 -73.69 105.37 4.97 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 105.281 -2.118 . . . . 80.0 105.281 170.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 73' ' ' SER . . . . . 0.669 ' O ' ' NZ ' ' C' ' 115' ' ' LYS 0.331 0.1 OUTLIER -78.04 -15.37 58.98 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 116.576 2.065 . . . . 80.0 116.576 -177.483 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' C' C ' 74' ' ' LYS . . . . . 0.528 ' O ' ' HG3' ' C' ' 115' ' ' LYS . . . -65.99 -53.2 41.84 Favored 'General case' 0 CA--C 1.493 -1.231 0 C-N-CA 117.094 -1.842 . . . . 80.0 108.305 177.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 75' ' ' HIS . . . . . 0.717 ' O ' ' HG2' ' C' ' 115' ' ' LYS . 29.4 m80 -82.11 -30.49 31.15 Favored 'General case' 0 CA--C 1.492 -1.288 0 N-CA-C 113.76 1.022 . . . . 43.76 113.76 -178.789 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 76' ' ' TRP . . . . . 0.509 ' C ' ' HD3' ' C' ' 115' ' ' LYS . 60.4 m95 -118.87 158.14 26.26 Favored 'General case' 0 C--O 1.21 -0.993 0 C-N-CA 113.034 -3.466 . . . . 42.33 119.258 -175.085 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 77' ' ' ASN . . . . . 0.523 ' HB2' ' HB3' ' C' ' 113' ' ' SER . 8.8 m120 -114.39 139.07 49.79 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 103.699 -2.704 . . . . 60.43 103.699 170.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 78' ' ' SER . . . . . . . . . . . . . 81.5 p -152.06 164.29 37.56 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 113.366 0.876 . . . . 31.75 113.366 -177.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 79' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -165.06 160.3 18.74 Favored 'General case' 0 N--CA 1.424 -1.76 0 CA-C-O 116.894 -1.527 . . . . 34.3 108.491 173.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' CYS . . . . . 0.431 ' HB3' ' SG ' ' C' ' 108' ' ' CYS . 35.6 m -89.31 144.01 26.4 Favored 'General case' 0 C--O 1.238 0.469 0 O-C-N 125.156 1.535 . . . . 22.75 111.894 178.937 -51.533 -90.398 -86.773 104.233 2.011 102.328 -78.515 -69.952 2 2 . 1 . 001 ecloud build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 4.6 t -146.32 152.38 39.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 113.213 -1.812 . . . . 55.88 112.571 -178.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' C' ' 107' ' ' ALA . 84.2 m -87.35 140.76 29.21 Favored 'General case' 0 N--CA 1.425 -1.697 0 CA-C-N 113.355 -1.748 . . . . 21.2 108.933 -178.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 83' ' ' THR . . . . . 0.676 HG22 HG22 ' C' ' 106' ' ' THR . 0.6 OUTLIER -114.18 148.94 36.47 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 127.106 2.754 . . . . 24.71 108.08 -178.95 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 84' ' ' HIS . . . . . 0.436 ' HB3' ' HG3' ' C' ' 103' ' ' ARG . 57.8 m80 -108.26 157.95 17.89 Favored 'General case' 0 CA--C 1.56 1.352 0 N-CA-C 116.899 2.185 . . . . 29.36 116.899 -177.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 85' ' ' THR . . . . . . . . . . . . . 8.9 t -134.05 168.32 19.03 Favored 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 104.466 -2.42 . . . . 23.24 104.466 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -116.57 140.2 49.65 Favored 'General case' 0 CA--C 1.458 -2.56 0 CA-C-O 117.015 -1.469 . . . . 22.65 107.38 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' VAL . . . . . . . . . . . . . 1.5 t -139.43 147.77 24.03 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.36 0 O-C-N 127.161 2.788 . . . . 21.34 109.45 -175.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.14 143.03 31.73 Favored 'General case' 0 C--O 1.205 -1.274 0 C-N-CA 118.563 -1.255 . . . . 80.0 108.64 -175.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 89' ' ' ALA . . . . . 0.444 ' O ' HG23 ' C' ' 91' ' ' THR . . . -158.18 144.61 17.45 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 119.798 -0.761 . . . . 28.04 112.632 -179.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 90' ' ' LEU . . . . . 0.747 HD12 ' N ' ' C' ' 91' ' ' THR . 0.2 OUTLIER -73.24 119.0 16.87 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 108.341 -0.985 . . . . 45.39 108.341 177.308 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 91' ' ' THR . . . . . 0.747 ' N ' HD12 ' C' ' 90' ' ' LEU 0.266 63.2 p -141.88 171.32 14.21 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 123.726 0.641 . . . . 41.79 112.527 -174.806 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 92' ' ' THR . . . . . 0.791 HG22 ' HA ' ' C' ' 97' ' ' ALA . 38.0 p -142.85 129.46 20.27 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 114.769 -1.105 . . . . 58.99 112.481 177.325 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 93' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' C' ' 93' ' ' ASP . 21.1 p-10 -91.49 161.38 14.99 Favored 'General case' 0 N--CA 1.426 -1.625 1 N-CA-C 94.385 -6.154 . . . . 80.0 94.385 167.668 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 94' ' ' GLU . . . . . 0.645 ' OE1' ' N ' ' C' ' 95' ' ' LYS . 0.0 OUTLIER -37.99 -34.22 0.11 Allowed 'General case' 0 C--N 1.301 -1.516 0 O-C-N 125.808 1.942 . . . . 80.0 113.259 -179.786 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 95' ' ' LYS . . . . . 0.645 ' N ' ' OE1' ' C' ' 94' ' ' GLU 0.339 . . -59.8 -85.31 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 113.888 -1.505 . . . . 78.51 110.771 -179.839 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -135.17 151.99 51.18 Favored 'General case' 0 C--O 1.245 0.845 0 O-C-N 127.887 3.242 . . . . 80.0 118.054 -172.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' ALA . . . . . 0.791 ' HA ' HG22 ' C' ' 92' ' ' THR . . . -64.45 155.92 31.12 Favored 'General case' 0 CA--C 1.494 -1.18 0 N-CA-C 103.848 -2.649 . . . . 63.15 103.848 177.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 98' ' ' ALA . . . . . 0.655 ' HB3' ' NH1' ' C' ' 100' ' ' ARG . . . 174.88 140.13 0.05 OUTLIER 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 124.026 0.829 . . . . 53.94 110.516 -177.485 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -76.72 142.28 40.55 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 106.741 -1.577 . . . . 49.61 106.741 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 100' ' ' ARG . . . . . 0.655 ' NH1' ' HB3' ' C' ' 98' ' ' ALA . 60.3 mtt85 -148.03 159.46 43.88 Favored 'General case' 0 CA--C 1.479 -1.766 0 CA-C-N 114.657 -1.156 . . . . 58.29 108.094 -179.312 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 101' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -91.3 135.64 33.67 Favored 'General case' 0 N--CA 1.397 -3.09 0 C-N-CA 114.109 -3.036 . . . . 23.76 103.048 175.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 102' ' ' ILE . . . . . . . . . . . . . 33.2 pt -121.77 161.73 21.93 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.016 0 C-N-CA 117.977 -1.489 . . . . 22.47 108.788 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 103' ' ' ARG . . . . . 0.436 ' HG3' ' HB3' ' C' ' 84' ' ' HIS . 21.2 ttt-85 -93.71 129.17 40.13 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 125.039 1.462 . . . . 80.0 111.127 -178.053 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 104' ' ' ILE . . . . . . . . . . . . . 8.5 pt -135.61 151.15 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 N-CA-C 113.713 1.005 . . . . 39.62 113.713 178.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 105' ' ' ASP . . . . . 0.626 ' OD2' ' HE2' ' C' ' 57' ' ' LYS . 20.9 m-20 -62.47 125.85 25.32 Favored 'General case' 0 C--O 1.203 -1.382 0 N-CA-C 107.657 -1.238 . . . . 25.07 107.657 -178.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 106' ' ' THR . . . . . 0.676 HG22 HG22 ' C' ' 83' ' ' THR . 0.6 OUTLIER -122.74 -19.3 6.28 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 115.053 1.501 . . . . 18.87 115.053 -175.109 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 107' ' ' ALA . . . . . 0.463 ' O ' ' HA ' ' C' ' 82' ' ' THR . . . -171.29 171.88 5.46 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 120.627 -1.295 . . . . 15.04 110.831 -176.465 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 108' ' ' CYS . . . . . 0.431 ' SG ' ' HB3' ' C' ' 80' ' ' CYS . 51.2 t -128.71 118.1 22.28 Favored 'General case' 0 CA--C 1.487 -1.475 0 N-CA-C 107.508 -1.293 . . . . 17.1 107.508 -178.202 179.732 72.373 96.183 102.646 2.024 104.636 -54.771 -66.133 2 2 . 1 . 001 ecloud build full ' C' C ' 109' ' ' VAL . . . . . . . . . . . . . 31.8 m -130.22 161.58 39.7 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.404 0 C-N-CA 118.521 -1.272 . . . . 22.04 110.429 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 110' ' ' CYS . . . . . 0.526 ' HB2' HG11 ' C' ' 14' ' ' VAL . 34.7 t -84.66 136.32 33.8 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 127.679 3.112 . . . . 25.39 112.427 178.226 -170.943 69.582 93.489 106.643 2.03 101.77 155.094 -22.293 2 2 . 1 . 001 ecloud build full ' C' C ' 111' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -132.23 116.4 29.11 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.196 0 N-CA-C 114.581 1.326 . . . . 20.43 114.581 -178.509 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 112' ' ' LEU . . . . . 0.461 HD21 ' HA3' ' B' ' 70' ' ' GLY . 0.0 OUTLIER -79.57 158.98 27.02 Favored 'General case' 0 C--O 1.197 -1.67 0 N-CA-C 114.646 1.35 . . . . 38.78 114.646 -176.518 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 113' ' ' SER . . . . . 0.642 ' HB2' ' O ' ' B' ' 954' ' ' HOH . 1.1 t -147.27 124.22 11.33 Favored 'General case' 0 C--N 1.312 -1.056 0 C-N-CA 126.96 2.104 . . . . 42.04 106.243 174.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 114' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -75.71 131.81 40.11 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 114.903 1.446 . . . . 35.66 114.903 -175.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 115' ' ' LYS . . . . . 0.717 ' HG2' ' O ' ' C' ' 75' ' ' HIS . 0.0 OUTLIER -72.91 134.71 44.9 Favored 'General case' 0 CA--C 1.498 -1.054 0 C-N-CA 118.001 -1.479 . . . . 56.96 109.3 175.252 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 116' ' ' ALA . . . . . 0.501 ' O ' HG23 ' C' ' 117' ' ' THR . . . -66.94 50.54 0.04 OUTLIER 'General case' 0 CA--C 1.477 -1.858 0 N-CA-C 120.314 3.45 . . . . 68.05 120.314 -172.062 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 117' ' ' THR . . . . . 0.501 HG23 ' O ' ' C' ' 116' ' ' ALA . 0.2 OUTLIER -171.92 157.89 4.61 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 121.192 1.814 . . . . 80.0 110.444 179.721 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 118' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.784 0 C-N-CA 128.603 2.761 . . . . 80.0 111.191 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 902' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 900' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 901' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 903' ' ' HOH . . . . . 0.57 ' O ' ' NE2' ' A' ' 75' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 921' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 922' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 923' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 924' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 925' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 926' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 941' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 904' ' ' HOH . . . . . 0.65 ' O ' ' NE2' ' B' ' 75' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 927' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 928' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 930' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 931' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 933' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 934' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 935' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 936' ' ' HOH . . . . . 0.44 ' O ' ' HA ' ' B' ' 106' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 937' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 938' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 939' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 940' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 942' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 943' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 944' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 954' ' ' HOH . . . . . 0.642 ' O ' ' HB2' ' C' ' 113' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 961' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 962' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 929' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 932' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 949' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 950' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 951' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 952' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 953' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 955' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 956' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 957' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 958' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 959' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 960' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.202 0 N-CA-C 110.691 -0.964 . . . . 80.0 110.691 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.313 4.0 mm-40 -82.71 138.77 33.98 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 114.754 1.39 . . . . 80.0 114.754 -178.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -50.62 123.67 9.33 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 113.267 -1.788 . . . . 63.99 107.61 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 t -128.83 172.49 11.25 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.238 1.199 . . . . 45.69 114.238 -174.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 28.3 m -73.35 -9.83 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 C-N-CA 120.159 -0.617 . . . . 19.91 111.454 173.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.0 m -141.9 130.68 22.87 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.361 1.064 . . . . 24.55 112.816 178.261 -64.442 -76.382 -85.511 103.511 1.99 105.504 -87.576 -60.194 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -86.89 128.55 35.06 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 123.007 1.384 . . . . 34.96 114.04 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.8 p -123.24 170.19 10.52 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 120.149 -1.594 . . . . 32.95 114.277 -175.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 18' ' ' VAL . 4.0 p -139.85 128.46 26.96 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.51 -0.922 . . . . 42.31 108.51 -178.121 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.1 m -118.15 148.74 42.04 Favored 'General case' 0 CA--C 1.484 -1.583 0 CA-C-O 122.337 1.065 . . . . 23.7 112.389 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.475 HG22 ' N ' ' A' ' 21' ' ' TRP . 8.1 p -163.78 159.28 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.285 -2.217 0 C-N-CA 115.812 -2.355 . . . . 61.16 109.747 178.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.475 ' N ' HG22 ' A' ' 20' ' ' VAL . 88.8 m95 -93.18 122.72 35.86 Favored 'General case' 0 C--N 1.347 0.487 0 O-C-N 123.831 0.707 . . . . 21.64 109.402 176.049 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.0 m -110.77 120.89 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.452 0 C-N-CA 123.113 0.565 . . . . 18.12 110.864 177.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -111.66 9.94 27.99 Favored Glycine 0 CA--C 1.523 0.576 0 CA-C-O 121.561 0.534 . . . . 28.54 112.818 -177.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -128.74 19.12 6.16 Favored 'General case' 0 C--O 1.209 -1.062 0 N-CA-C 114.758 1.392 . . . . 52.89 114.758 -179.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.9 ttmm -55.64 135.33 51.26 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 106.324 -1.732 . . . . 75.24 106.324 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . 0.506 ' OG1' HG22 ' A' ' 27' ' ' THR . 76.9 p -124.36 -23.73 4.42 Favored 'General case' 0 CA--C 1.48 -1.738 0 C-N-CA 116.997 -1.881 . . . . 25.83 107.559 179.309 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' THR . . . . . 0.506 HG22 ' OG1' ' A' ' 26' ' ' THR 0.317 0.6 OUTLIER -122.81 145.2 48.64 Favored 'General case' 0 N--CA 1.419 -2.009 0 C-N-CA 114.222 -2.991 . . . . 31.49 111.703 -175.977 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -162.59 172.65 15.07 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 118.603 -1.239 . . . . 21.6 112.829 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 87.3 m -113.32 122.84 48.61 Favored 'General case' 0 C--O 1.245 0.839 0 O-C-N 125.386 1.679 . . . . 36.84 109.211 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.43 ' HA ' ' HA ' ' A' ' 102' ' ' ILE . 5.3 p-10 -73.55 176.18 6.38 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 114.659 -1.155 . . . . 29.74 108.412 -179.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.453 HG23 ' N ' ' A' ' 32' ' ' LYS . 10.2 tt -60.34 -30.57 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.554 0 O-C-N 124.342 1.026 . . . . 36.53 113.27 -178.493 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.453 ' N ' HG23 ' A' ' 31' ' ' ILE . 3.7 mtpt -80.57 -3.19 49.35 Favored 'General case' 0 CA--C 1.494 -1.178 0 O-C-N 123.545 0.528 . . . . 80.0 111.197 -179.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.66 6.8 76.27 Favored Glycine 0 CA--C 1.541 1.672 0 CA-C-O 122.481 1.045 . . . . 33.2 114.368 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.5 mtmp? -90.64 139.46 30.69 Favored 'General case' 0 N--CA 1.419 -1.979 0 O-C-N 121.951 -0.735 . . . . 80.0 109.653 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 36' ' ' VAL . 4.3 tt0 -75.07 145.78 42.04 Favored 'General case' 0 C--O 1.196 -1.743 0 O-C-N 121.61 -0.681 . . . . 80.0 112.51 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.449 ' N ' ' HG3' ' A' ' 35' ' ' GLU . 26.3 m -147.34 167.56 5.29 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 C-N-CA 118.857 -1.137 . . . . 21.16 110.024 -179.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 45.7 m -100.67 137.64 38.8 Favored 'General case' 0 N--CA 1.425 -1.707 0 CA-C-O 122.33 1.062 . . . . 22.01 110.493 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.0 t -93.81 116.59 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.202 0 CA-C-N 115.152 -0.931 . . . . 19.0 112.678 179.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 39' ' ' LEU 0.293 10.4 mp -56.95 135.38 56.11 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 122.59 1.186 . . . . 26.55 112.282 178.306 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.58 -35.68 67.99 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 115.448 1.647 . . . . 38.77 115.448 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -123.89 132.94 53.83 Favored 'General case' 0 CA--C 1.481 -1.699 0 N-CA-C 107.172 -1.418 . . . . 80.0 107.172 -176.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 49' ' ' PHE . 12.0 p -112.03 138.59 40.28 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.118 0 C-N-CA 116.93 -1.908 . . . . 62.15 107.35 175.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.737 ' C ' HD13 ' A' ' 44' ' ' ILE . 2.1 t-20 -112.92 106.1 14.31 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 123.369 1.556 . . . . 80.0 114.67 -179.222 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.737 HD13 ' C ' ' A' ' 43' ' ' ASN . 1.5 mm -106.45 125.07 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 118.574 -1.251 . . . . 72.09 112.455 180.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 51.1 m-20 51.8 42.67 30.14 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 122.159 0.981 . . . . 80.0 111.143 179.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.593 ' CA ' HD21 ' A' ' 43' ' ' ASN . 1.8 m-20 66.49 25.42 10.16 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 122.368 1.08 . . . . 80.0 112.972 179.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' SER . . . . . 0.883 ' HB3' ' CZ ' ' A' ' 49' ' ' PHE . 0.3 OUTLIER -125.52 129.98 50.83 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 112.69 -2.05 . . . . 80.0 106.18 175.402 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 42' ' ' VAL . 0.3 OUTLIER -109.25 132.26 57.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 113.616 0.969 . . . . 54.66 113.616 -177.689 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.883 ' CZ ' ' HB3' ' A' ' 47' ' ' SER . 0.1 OUTLIER -133.77 159.58 40.16 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 114.609 1.337 . . . . 75.17 114.609 -179.445 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -79.03 148.21 32.58 Favored 'General case' 0 C--N 1.354 0.785 0 CA-C-N 114.546 -1.207 . . . . 80.0 109.711 176.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -96.23 117.63 31.17 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 120.873 -1.142 . . . . 25.55 109.855 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -109.04 142.25 40.02 Favored 'General case' 0 CA--C 1.485 -1.537 0 O-C-N 120.885 -1.134 . . . . 39.62 113.658 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -130.84 143.4 50.71 Favored 'General case' 0 CA--C 1.505 -0.772 0 O-C-N 126.048 2.092 . . . . 20.07 110.67 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -107.46 108.9 20.44 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 105.102 -2.184 . . . . 21.3 105.102 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.444 ' HG2' HG23 ' A' ' 104' ' ' ILE . 26.5 mt-10 -109.92 142.46 41.23 Favored 'General case' 0 C--N 1.363 1.155 0 N-CA-C 114.261 1.208 . . . . 47.55 114.261 -175.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 89.5 m -129.97 121.23 26.15 Favored 'General case' 0 CA--C 1.483 -1.611 0 O-C-N 124.707 1.255 . . . . 28.34 107.936 178.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.437 ' O ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -114.92 157.6 23.14 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 126.601 2.438 . . . . 80.0 112.207 -179.792 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.275 56.6 m -75.65 149.94 38.07 Favored 'General case' 0 N--CA 1.421 -1.9 0 N-CA-C 106.568 -1.641 . . . . 25.32 106.568 174.668 -75.078 -59.023 104.937 102.522 1.967 102.303 77.899 -176.389 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.416 ' CZ ' ' HB3' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -76.72 -38.75 53.73 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.123 -0.631 . . . . 80.0 110.958 173.41 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.03 161.77 41.25 Favored 'General case' 0 CA--C 1.483 -1.634 0 N-CA-C 106.128 -1.804 . . . . 28.38 106.128 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' SER . . . . . 0.41 ' OG ' ' N ' ' C' ' 117' ' ' THR . 3.6 p -79.29 -14.63 58.89 Favored 'General case' 0 C--N 1.31 -1.133 0 C-N-CA 119.043 -1.063 . . . . 59.9 110.244 177.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.429 ' OD1' ' HA2' ' A' ' 67' ' ' GLY . 4.3 m-80 -141.71 86.98 10.38 Favored Pre-proline 0 N--CA 1.439 -0.983 0 C-N-CA 119.654 -0.818 . . . . 70.05 111.091 -179.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -56.05 -13.02 8.33 Favored 'Trans proline' 0 CA--C 1.509 -0.727 0 C-N-CA 122.565 2.177 . . . . 39.45 111.126 179.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -151.33 153.68 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.814 0 N-CA-C 105.954 -1.869 . . . . 33.33 105.954 -176.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.389 0.6 OUTLIER -41.54 -54.39 3.19 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 116.582 2.068 . . . . 80.0 116.582 -173.412 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.1 p -69.42 -11.07 60.51 Favored 'General case' 0 N--CA 1.439 -0.979 0 N-CA-C 116.449 2.018 . . . . 80.0 116.449 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.429 ' HA2' ' OD1' ' A' ' 62' ' ' ASN . . . 132.01 -125.45 4.29 Favored Glycine 0 CA--C 1.53 1.03 0 N-CA-C 110.828 -0.909 . . . . 26.98 110.828 -177.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 3.8 m -76.76 150.19 36.24 Favored 'General case' 0 C--O 1.209 -1.041 0 C-N-CA 118.537 -1.265 . . . . 20.79 112.413 176.092 -39.48 153.505 101.211 101.606 2.025 104.494 77.244 -174.266 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 10.7 ttm105 -73.98 135.93 43.18 Favored 'General case' 0 N--CA 1.437 -1.125 0 O-C-N 121.821 -0.55 . . . . 24.42 111.554 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 97.84 -10.54 64.3 Favored Glycine 0 C--O 1.253 1.298 0 N-CA-C 118.326 2.09 . . . . 25.68 118.326 177.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.3 mm -71.84 138.95 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.158 0 N-CA-C 117.443 2.386 . . . . 38.67 117.443 -175.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.651 ' OD2' ' NE2' ' A' ' 75' ' ' HIS . 44.4 t0 -71.05 89.78 0.82 Allowed 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 103.838 -2.653 . . . . 44.31 103.838 173.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.3 p -75.43 13.44 0.76 Allowed 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 117.872 2.545 . . . . 80.0 117.872 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . . . -90.08 -24.73 21.05 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 119.701 -1.875 . . . . 48.67 106.722 175.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.651 ' NE2' ' OD2' ' A' ' 72' ' ' ASP 0.253 0.0 OUTLIER -114.83 -7.09 12.65 Favored 'General case' 0 N--CA 1.413 -2.316 0 N-CA-C 116.194 1.924 . . . . 76.92 116.194 -178.2 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' TRP . . . . . 0.524 ' CZ3' ' HG2' ' A' ' 114' ' ' ARG . 11.8 m95 -140.88 156.93 46.01 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 121.447 1.93 . . . . 26.36 115.276 -179.884 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.449 ' OD1' ' HE2' ' A' ' 115' ' ' LYS . 85.4 m-20 -104.14 154.93 19.15 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 103.761 -2.681 . . . . 25.52 103.761 168.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.6 p -161.76 160.51 28.47 Favored 'General case' 0 C--O 1.209 -1.058 0 C-N-CA 119.239 -0.984 . . . . 16.95 112.314 179.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.436 ' HD1' ' CZ ' ' B' ' 12' ' ' PHE . 52.4 p90 -160.56 162.73 33.01 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-O 116.976 -1.488 . . . . 15.72 107.41 174.838 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 81.7 m -100.44 134.85 42.77 Favored 'General case' 0 CA--C 1.479 -1.786 0 O-C-N 125.643 1.84 . . . . 19.53 112.064 -176.734 -60.194 -87.576 -85.511 105.504 1.99 103.511 -76.382 -64.442 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 t -138.68 163.28 32.52 Favored 'General case' 0 N--CA 1.411 -2.404 0 CA-C-O 122.822 1.296 . . . . 27.68 110.065 -178.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . 0.504 ' HA ' ' O ' ' A' ' 107' ' ' ALA . 14.8 m -98.48 143.84 28.47 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 114.108 -1.405 . . . . 28.32 114.486 -177.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . 0.332 3.0 p -119.81 173.19 7.19 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 118.092 -1.443 . . . . 33.99 112.87 176.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.509 ' NE2' ' OD1' ' A' ' 105' ' ' ASP . 68.9 m80 -123.03 155.49 36.76 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 117.341 2.348 . . . . 27.14 117.341 -171.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.4 t -124.82 174.85 7.65 Favored 'General case' 0 C--O 1.209 -1.077 0 N-CA-C 104.57 -2.381 . . . . 20.78 104.57 167.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -121.89 126.42 48.63 Favored 'General case' 0 CA--C 1.474 -1.949 0 CA-C-N 121.181 1.81 . . . . 22.63 110.565 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.496 HG22 HD13 ' A' ' 104' ' ' ILE . 1.0 OUTLIER -123.29 141.43 43.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 O-C-N 125.426 1.703 . . . . 29.49 112.695 176.265 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.581 ' HG3' ' CZ ' ' A' ' 101' ' ' PHE . 8.8 mttp -70.56 143.25 51.64 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 116.596 -2.041 . . . . 80.0 107.119 178.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -147.57 149.58 32.84 Favored 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 108.203 -1.036 . . . . 19.5 108.203 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 98' ' ' ALA . 2.2 tp -79.37 111.76 15.94 Favored 'General case' 0 C--O 1.256 1.435 0 N-CA-C 108.072 -1.084 . . . . 22.4 108.072 172.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . 0.341 67.3 p -127.76 -176.77 3.87 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 122.168 0.985 . . . . 21.02 112.336 179.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.297 14.2 t -152.98 141.77 21.07 Favored 'General case' 0 CA--C 1.484 -1.564 0 C-N-CA 124.815 1.246 . . . . 19.13 111.435 171.508 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.475 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 34.6 p-10 -108.6 12.03 26.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 113.983 -1.462 . . . . 27.34 108.685 177.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 93' ' ' ASP 0.304 69.8 mt-10 89.29 -17.2 0.25 Allowed 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 113.66 0.985 . . . . 30.74 113.66 178.576 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -100.45 -52.34 3.39 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 123.317 0.647 . . . . 80.0 110.808 174.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.76 136.34 38.84 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 113.088 0.773 . . . . 80.0 113.088 177.605 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -97.51 124.28 41.69 Favored 'General case' 0 C--O 1.249 1.05 0 CA-C-O 121.88 0.848 . . . . 36.13 109.455 -179.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.44 ' O ' HD12 ' A' ' 90' ' ' LEU 0.269 . . -160.55 -178.5 6.93 Favored 'General case' 0 CA--C 1.493 -1.218 0 C-N-CA 118.516 -1.273 . . . . 31.45 111.562 -177.283 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . 0.267 89.6 m95 -90.24 128.21 36.34 Favored 'General case' 0 CA--C 1.47 -2.117 0 N-CA-C 106.964 -1.495 . . . . 21.45 106.964 173.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 25.2 mtt85 -131.65 168.69 17.29 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.447 -1.316 . . . . 19.54 107.447 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.581 ' CZ ' ' HG3' ' A' ' 88' ' ' LYS . 8.7 m-85 -95.07 122.33 37.61 Favored 'General case' 0 C--O 1.249 1.042 0 N-CA-C 105.27 -2.122 . . . . 33.96 105.27 177.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.494 HG12 HD12 ' A' ' 104' ' ' ILE . 0.1 OUTLIER -110.63 162.81 7.91 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.149 0 O-C-N 124.484 1.115 . . . . 20.45 110.577 -179.627 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.56 149.32 25.03 Favored 'General case' 0 N--CA 1.42 -1.938 0 C-N-CA 114.827 -2.749 . . . . 52.65 108.132 179.141 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.496 HD13 HG22 ' A' ' 87' ' ' VAL . 1.2 mp -137.95 126.44 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.218 0 O-C-N 125.851 1.969 . . . . 28.66 108.262 176.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.509 ' OD1' ' NE2' ' A' ' 84' ' ' HIS . 55.9 m-20 -70.91 135.16 47.81 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 105.109 -2.182 . . . . 39.59 105.109 -173.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.2 p -122.55 -12.39 8.15 Favored 'General case' 0 CA--C 1.501 -0.905 0 O-C-N 125.333 1.646 . . . . 32.26 114.274 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.504 ' O ' ' HA ' ' A' ' 82' ' ' THR . . . -162.98 166.22 24.04 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 117.842 -1.543 . . . . 18.16 113.701 -178.672 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 41.9 t -126.63 102.86 7.27 Favored 'General case' 0 CA--C 1.474 -1.944 0 N-CA-C 105.568 -2.012 . . . . 16.99 105.568 179.949 -176.389 77.899 104.937 102.303 1.967 102.522 -59.023 -75.078 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 9.3 m -113.53 164.01 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.442 0 N-CA-C 107.609 -1.256 . . . . 15.83 107.609 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 48.8 t -101.47 124.05 46.51 Favored 'General case' 0 CA--C 1.488 -1.407 0 C-N-CA 125.693 1.597 . . . . 17.19 111.707 -176.998 -174.266 77.244 101.211 104.494 2.025 101.606 153.505 -39.48 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -104.41 141.4 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 C-N-CA 118.326 -1.35 . . . . 22.56 107.615 176.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.41 ' HA ' HD12 ' A' ' 112' ' ' LEU 0.319 0.0 OUTLIER -107.18 162.03 14.25 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 113.912 -1.494 . . . . 28.75 113.482 -174.342 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -156.06 128.53 7.72 Favored 'General case' 0 C--O 1.266 1.953 0 N-CA-C 108.288 -1.004 . . . . 62.74 108.288 172.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.524 ' HG2' ' CZ3' ' A' ' 76' ' ' TRP . 1.5 mtp180 -64.9 131.28 46.27 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 112.76 -2.018 . . . . 79.34 112.554 -178.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.449 ' HE2' ' OD1' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -61.89 130.1 44.07 Favored 'General case' 0 N--CA 1.419 -1.999 0 O-C-N 125.27 1.606 . . . . 80.0 108.304 177.383 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -74.43 118.46 17.41 Favored 'General case' 0 C--N 1.349 0.579 0 O-C-N 124.999 1.437 . . . . 80.0 111.38 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 33.0 m . . . . . 0 C--O 1.245 0.821 0 CA-C-O 122.871 1.32 . . . . 80.0 112.591 -178.555 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.309 0 N-CA-C 110.177 -1.169 . . . . 60.41 110.177 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . 0.322 0.6 OUTLIER -113.7 133.0 55.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 124.011 1.863 . . . . 80.0 115.239 -177.215 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' PHE . . . . . 0.436 ' CZ ' ' HD1' ' A' ' 79' ' ' TYR . 43.6 m-85 -113.87 158.49 20.98 Favored 'General case' 0 N--CA 1.413 -2.289 0 N-CA-C 104.326 -2.472 . . . . 30.02 104.326 176.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 4.2 p -115.52 157.35 24.18 Favored 'General case' 0 N--CA 1.42 -1.952 0 CA-C-O 122.135 0.969 . . . . 67.17 110.662 -175.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.426 HG12 ' HB2' ' B' ' 110' ' ' CYS . 20.5 t -80.4 -30.76 12.6 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-O 122.931 1.348 . . . . 19.13 112.946 -177.045 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' CYS . . . . . . . . . . . . . 57.1 m -138.37 139.02 38.81 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.15 -0.932 . . . . 31.23 109.026 179.284 -74.856 -80.078 -83.362 107.186 2.023 104.937 -79.172 -57.897 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ASP . . . . . 0.48 ' CG ' HH22 ' B' ' 69' ' ' ARG . 73.3 m-20 -90.38 123.67 34.31 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 123.554 1.645 . . . . 35.97 112.2 -178.16 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 26.8 p -116.63 167.03 11.44 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 118.76 -1.176 . . . . 26.17 110.966 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.35 126.41 40.31 Favored 'Isoleucine or valine' 0 C--O 1.245 0.824 0 CA-C-N 115.298 -0.865 . . . . 51.34 108.883 176.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' SER . . . . . . . . . . . . . 1.5 m -110.12 139.42 45.28 Favored 'General case' 0 C--O 1.244 0.806 0 N-CA-C 115.956 1.836 . . . . 30.37 115.956 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 10.5 m -150.3 176.64 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.939 0 O-C-N 121.134 -0.979 . . . . 24.77 111.564 -177.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -118.99 124.47 47.09 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.767 -1.197 . . . . 22.12 107.767 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 39.1 t -105.28 125.36 60.44 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.98 0 CA-C-N 115.566 -0.743 . . . . 25.42 109.334 -176.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -118.33 1.7 16.37 Favored Glycine 0 C--N 1.337 0.627 0 C-N-CA 118.607 -1.759 . . . . 29.04 114.466 -177.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 40.5 p-10 -124.75 28.16 6.6 Favored 'General case' 0 C--O 1.246 0.897 0 N-CA-C 115.24 1.57 . . . . 40.9 115.24 -178.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' LYS . . . . . . . . . . . . . 3.1 ttmm -59.54 135.04 57.55 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 108.171 -1.048 . . . . 36.64 108.171 178.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 67.1 p -122.22 -22.03 5.7 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 118.203 -1.399 . . . . 25.68 111.621 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.37 153.66 42.19 Favored 'General case' 0 N--CA 1.409 -2.524 0 CA-C-O 123.6 1.667 . . . . 33.07 113.801 177.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.0 171.76 18.77 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 118.587 -1.245 . . . . 22.69 112.077 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . 0.432 0.2 OUTLIER -104.93 128.62 53.26 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 123.257 1.503 . . . . 50.13 111.422 174.528 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ASP . . . . . 0.505 ' OD1' ' HG2' ' B' ' 34' ' ' LYS 0.277 24.9 p-10 -83.3 -175.17 5.7 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 117.095 2.257 . . . . 37.5 117.095 -176.259 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.445 HD11 ' HZ2' ' C' ' 21' ' ' TRP . 7.7 tt -61.22 -34.95 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.778 0 CA-C-N 113.342 -1.754 . . . . 80.0 111.694 -178.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -75.79 -10.01 59.08 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 121.865 0.84 . . . . 80.0 111.782 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.83 14.16 56.91 Favored Glycine 0 N--CA 1.441 -1.025 0 O-C-N 121.18 -0.95 . . . . 37.1 113.127 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' LYS . . . . . 0.505 ' HG2' ' OD1' ' B' ' 30' ' ' ASP . 10.5 ptmt -102.72 143.94 31.72 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 119.513 -0.875 . . . . 80.0 113.295 -177.74 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.58 118.74 13.76 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 114.435 -1.257 . . . . 42.13 112.763 -178.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.41 172.94 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 115.154 1.539 . . . . 35.1 115.154 -177.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' THR . . . . . 0.558 ' O ' ' N ' ' B' ' 92' ' ' THR . 52.5 m -113.02 127.62 56.28 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-O 122.798 1.285 . . . . 49.33 111.51 -178.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 76.1 t -92.6 120.06 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.775 0 CA-C-N 111.815 -2.448 . . . . 36.99 110.907 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LEU . . . . . 0.67 ' O ' ' NE2' ' B' ' 51' ' ' GLN . 0.0 OUTLIER -68.01 126.01 28.13 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 122.5 1.143 . . . . 46.55 110.719 178.388 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.09 -50.63 73.33 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 114.087 -1.415 . . . . 48.4 112.593 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . . . -105.42 166.52 10.37 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 114.593 1.331 . . . . 66.18 114.593 -177.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.653 ' N ' ' O ' ' B' ' 49' ' ' PHE 0.345 0.4 OUTLIER -155.2 122.68 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 118.299 2.703 . . . . 69.89 118.299 178.28 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ASN . . . . . 0.588 ' HA ' ' O ' ' B' ' 47' ' ' SER . 51.4 t-20 -108.17 109.9 21.41 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.044 -1.889 . . . . 80.0 111.139 178.271 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . . . -134.62 119.78 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.754 0 C-N-CA 126.171 1.788 . . . . 80.0 108.382 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ASN . . . . . 1.079 ' ND2' ' H ' ' C' ' 45' ' ' ASN 0.348 9.2 m120 57.17 58.79 3.72 Favored 'General case' 0 CA--C 1.554 1.111 0 O-C-N 125.126 1.516 . . . . 80.0 113.653 -175.948 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . . . 51.13 55.12 10.01 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 114.349 1.24 . . . . 80.0 114.349 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' SER . . . . . 0.588 ' O ' ' HA ' ' B' ' 43' ' ' ASN . . . -156.41 161.9 40.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 122.105 -0.372 . . . . 80.0 110.747 177.335 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.314 2.5 t -132.59 125.23 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 C-N-CA 115.181 -2.608 . . . . 80.0 116.594 -177.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' PHE . . . . . 0.653 ' O ' ' N ' ' B' ' 42' ' ' VAL . 1.4 m-85 -138.69 162.48 34.57 Favored 'General case' 0 N--CA 1.423 -1.797 0 CA-C-N 112.872 -1.967 . . . . 65.2 114.585 -176.861 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.97 145.46 28.64 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 110.519 -3.037 . . . . 80.0 107.585 179.099 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.67 ' NE2' ' O ' ' B' ' 39' ' ' LEU . 16.3 mt-30 -86.0 121.85 29.2 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.012 -1.449 . . . . 33.0 109.985 -179.583 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -118.71 142.8 47.34 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.352 -0.981 . . . . 27.51 108.352 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -137.53 130.37 30.2 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 126.185 2.178 . . . . 25.27 109.629 -176.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -91.34 116.54 28.92 Favored 'General case' 0 N--CA 1.416 -2.131 0 CA-C-N 114.571 -1.195 . . . . 22.74 108.351 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -118.03 147.43 43.23 Favored 'General case' 0 CA--C 1.489 -1.396 0 N-CA-C 114.85 1.426 . . . . 23.34 114.85 -175.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 40.1 m -130.49 136.2 48.73 Favored 'General case' 0 CA--C 1.48 -1.713 0 O-C-N 123.81 0.694 . . . . 18.68 110.514 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -140.43 167.76 21.39 Favored 'General case' 0 N--CA 1.439 -1.002 0 O-C-N 126.328 2.268 . . . . 80.0 110.449 -177.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 98.0 m -75.62 136.51 40.47 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 114.187 -1.37 . . . . 24.97 110.389 177.047 -69.259 -54.219 97.358 102.447 2.034 107.569 77.139 -166.676 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -70.96 -31.73 68.39 Favored 'General case' 0 CA--C 1.482 -1.658 0 N-CA-C 102.027 -3.323 . . . . 80.0 102.027 175.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -163.41 153.59 15.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.911 -1.495 . . . . 44.68 113.673 -176.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 9.9 t -73.43 -33.19 64.8 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 113.002 -1.908 . . . . 80.0 112.216 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -127.18 71.74 76.35 Favored Pre-proline 0 C--O 1.215 -0.732 0 CA-C-O 121.733 0.777 . . . . 80.0 110.07 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -41.91 -39.6 5.5 Favored 'Trans proline' 0 C--N 1.319 -0.986 0 C-N-CA 123.792 2.995 . . . . 41.07 113.03 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.608 HG12 ' H ' ' B' ' 67' ' ' GLY . 0.5 OUTLIER -118.56 174.58 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.622 0 CA-C-N 113.101 -1.863 . . . . 48.55 108.122 -178.894 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.586 ' N ' HG13 ' B' ' 64' ' ' VAL . . . -59.44 -57.82 11.29 Favored 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 117.207 -1.797 . . . . 51.31 110.855 -179.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.9 -34.33 59.2 Favored 'General case' 0 C--N 1.346 0.424 0 O-C-N 127.044 2.715 . . . . 80.0 115.439 -178.447 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . 0.608 ' H ' HG12 ' B' ' 64' ' ' VAL . . . 144.63 -118.62 1.16 Allowed Glycine 0 C--O 1.218 -0.886 0 N-CA-C 108.021 -2.032 . . . . 39.25 108.021 -179.204 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' CYS . . . . . . . . . . . . 0.273 1.4 m -74.96 155.34 37.5 Favored 'General case' 0 C--O 1.213 -0.849 0 C-N-CA 117.303 -1.759 . . . . 26.29 112.632 176.94 -28.882 149.699 86.567 98.958 2.013 102.704 79.226 -178.255 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ARG . . . . . 0.48 HH22 ' CG ' ' B' ' 16' ' ' ASP . 17.5 ttp-105 -81.58 131.68 35.28 Favored 'General case' 0 N--CA 1.425 -1.724 0 C-N-CA 119.163 -1.015 . . . . 47.04 110.794 -175.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' GLY . . . . . 0.461 ' HA3' HD21 ' C' ' 112' ' ' LEU . . . 98.2 -11.76 63.68 Favored Glycine 0 C--O 1.218 -0.857 0 CA-C-O 118.912 -0.938 . . . . 26.89 113.875 175.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.58 HG22 ' N ' ' B' ' 72' ' ' ASP . 7.0 mm -66.49 161.45 3.45 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-N 117.941 0.87 . . . . 33.87 110.78 -178.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.58 ' N ' HG22 ' B' ' 71' ' ' ILE . 14.1 t0 -100.63 74.28 1.67 Allowed 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.669 1.588 . . . . 40.41 107.357 178.065 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' SER . . . . . 0.494 ' O ' ' NZ ' ' B' ' 115' ' ' LYS . 79.7 p -61.2 -13.73 20.34 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 114.0 -1.454 . . . . 44.88 111.273 -176.773 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . . . -66.82 -21.76 66.02 Favored 'General case' 0 C--O 1.194 -1.863 0 C-N-CA 114.283 -2.967 . . . . 34.86 106.72 179.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.65 ' NE2' ' O ' ' B' ' 904' ' ' HOH . 45.3 m80 -129.02 -2.73 5.15 Favored 'General case' 0 CA--C 1.493 -1.245 0 C-N-CA 118.466 -1.294 . . . . 70.8 111.572 -177.262 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' TRP . . . . . 0.585 ' CH2' ' HD2' ' B' ' 114' ' ' ARG 0.275 74.2 m95 -137.02 150.51 48.15 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 117.319 -1.752 . . . . 39.81 115.103 -177.326 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ASN . . . . . 0.65 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 8.7 m120 -106.99 140.14 40.26 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.888 -1.152 . . . . 80.0 107.888 172.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . 0.294 89.2 p -156.63 154.67 30.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 115.707 1.743 . . . . 34.9 115.707 -179.688 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -148.46 171.79 15.5 Favored 'General case' 0 N--CA 1.427 -1.599 0 C-N-CA 115.307 -2.557 . . . . 46.37 109.448 171.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 66.9 m -94.23 142.68 27.13 Favored 'General case' 0 C--N 1.359 0.995 0 O-C-N 125.981 2.05 . . . . 25.99 113.257 179.62 -57.897 -79.172 -83.362 104.937 2.023 107.186 -80.078 -74.856 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 5.1 t -150.83 155.17 38.66 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-O 123.572 1.653 . . . . 51.64 113.692 -178.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' B' ' 107' ' ' ALA . 5.0 t -91.86 132.77 36.22 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 113.972 -1.467 . . . . 26.45 110.738 -176.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 63.9 p -109.54 157.62 18.82 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 126.386 2.304 . . . . 21.36 111.888 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -114.53 170.27 8.43 Favored 'General case' 0 C--O 1.195 -1.784 0 N-CA-C 115.683 1.734 . . . . 30.43 115.683 -172.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' THR . . . . . 0.552 HG22 ' HD2' ' C' ' 54' ' ' PHE 0.257 0.2 OUTLIER -140.34 -177.65 5.12 Favored 'General case' 0 CA--C 1.47 -2.124 0 N-CA-C 101.163 -3.643 . . . . 42.87 101.163 174.376 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.479 ' H ' HG22 ' B' ' 85' ' ' THR . 49.2 m-85 -127.07 142.12 51.61 Favored 'General case' 0 CA--C 1.47 -2.107 0 O-C-N 127.318 2.886 . . . . 34.92 107.393 179.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' B' ' 101' ' ' PHE . 74.5 t -144.29 145.62 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.652 0 O-C-N 126.272 2.233 . . . . 28.28 108.768 -177.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.43 132.47 40.87 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.253 -0.885 . . . . 80.0 110.076 179.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ALA . . . . . 0.766 ' HB3' HD13 ' B' ' 102' ' ' ILE . . . -144.06 152.04 40.45 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 119.609 -0.836 . . . . 28.87 112.022 177.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 8.4 tp -83.14 123.72 29.81 Favored 'General case' 0 CA--C 1.487 -1.454 0 C-N-CA 117.651 -1.62 . . . . 46.7 108.524 176.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . 0.255 72.2 p -134.48 -166.07 1.75 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.286 1.587 . . . . 34.36 115.286 -176.596 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' THR . . . . . 0.558 ' N ' ' O ' ' B' ' 37' ' ' THR . 6.1 t -163.87 123.77 2.1 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 113.797 -1.547 . . . . 53.02 114.572 174.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -86.5 39.51 0.84 Allowed 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 128.613 2.765 . . . . 80.0 110.012 179.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLU . . . . . 0.698 ' HA ' ' OE1' ' B' ' 94' ' ' GLU 0.399 0.0 OUTLIER 82.51 -43.07 0.13 Allowed 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 110.687 -2.96 . . . . 80.0 110.874 -176.915 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . . . -109.31 -53.54 2.64 Favored 'General case' 0 C--O 1.252 1.196 0 C-N-CA 117.87 -1.532 . . . . 80.0 114.23 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' GLN . . . . . 0.529 ' O ' ' HA ' ' B' ' 92' ' ' THR . 2.0 tt0 -77.67 124.44 27.94 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 112.895 -1.957 . . . . 80.0 115.898 -176.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -98.9 102.5 14.25 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 106.593 -1.632 . . . . 68.43 106.593 174.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -141.48 150.06 41.73 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 115.292 1.59 . . . . 55.93 115.292 -174.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -71.62 142.77 49.95 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 117.702 -1.599 . . . . 44.09 107.684 172.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 4.7 mtm180 -152.08 157.76 42.07 Favored 'General case' 0 N--CA 1.422 -1.843 0 N-CA-C 109.597 -0.52 . . . . 63.34 109.597 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' PHE . . . . . 0.451 ' HA ' ' O ' ' B' ' 87' ' ' VAL . 43.1 m-85 -92.67 121.24 33.88 Favored 'General case' 0 CA--C 1.479 -1.764 0 O-C-N 125.198 1.561 . . . . 40.07 107.076 177.914 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ILE . . . . . 0.766 HD13 ' HB3' ' B' ' 89' ' ' ALA . 0.6 OUTLIER -110.85 164.71 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 C-N-CA 117.291 -1.764 . . . . 33.04 110.579 179.49 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 20.9 ttt-85 -89.69 133.76 34.5 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.582 -1.247 . . . . 80.0 111.379 -176.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 49.3 mm -133.85 146.84 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.813 0.845 . . . . 43.1 110.314 -176.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.48 128.43 35.53 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.062 -1.459 . . . . 21.99 107.062 176.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' B' ' 936' ' ' HOH . 12.5 t -123.56 -14.61 7.28 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 113.922 1.082 . . . . 21.46 113.922 -175.149 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ALA . . . . . 0.531 ' O ' ' HA ' ' B' ' 82' ' ' THR . . . -175.94 165.85 2.98 Favored 'General case' 0 CA--C 1.487 -1.466 0 N-CA-C 117.019 2.229 . . . . 11.53 117.019 -178.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' CYS . . . . . . . . . . . . . 14.7 t -113.49 108.67 17.5 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 109.736 -3.393 . . . . 21.0 112.362 -178.698 -166.676 77.139 97.358 107.569 2.034 102.447 -54.219 -69.259 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 11.3 m -117.91 152.6 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 121.893 0.854 . . . . 22.01 113.063 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' CYS . . . . . 0.426 ' HB2' HG12 ' B' ' 14' ' ' VAL . 51.4 t -88.49 122.3 31.81 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.113 -0.949 . . . . 25.39 113.366 179.178 -178.255 79.226 86.567 102.704 2.013 98.958 149.699 -28.882 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 2.2 t -101.38 144.7 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-O 122.499 1.142 . . . . 34.75 112.323 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' B' ' 112' ' ' LEU . 0.2 OUTLIER -108.83 151.07 26.74 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 114.074 1.138 . . . . 34.71 114.074 -175.959 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' SER . . . . . 0.65 ' OG ' ' HB2' ' B' ' 77' ' ' ASN 0.277 4.4 p -150.27 123.61 8.97 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 112.03 -2.35 . . . . 70.41 110.449 173.842 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ARG . . . . . 0.585 ' HD2' ' CH2' ' B' ' 76' ' ' TRP . 2.8 tpt85 -65.63 161.09 21.18 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-N 112.607 -2.088 . . . . 80.0 112.323 -179.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' LYS . . . . . 0.564 ' N ' ' HG3' ' B' ' 114' ' ' ARG 0.314 3.0 ptmt -135.01 141.44 46.2 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 117.59 -1.644 . . . . 80.0 110.728 174.089 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -84.68 94.82 8.73 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.477 -0.764 . . . . 80.0 109.277 177.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' THR . . . . . . . . . . . . . 40.2 p -79.59 -156.26 0.11 Allowed 'General case' 0 C--O 1.24 0.589 0 N-CA-C 119.037 2.977 . . . . 80.0 119.037 -172.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 7.9 ptt85 . . . . . 0 C--N 1.363 1.171 0 C-N-CA 127.072 2.149 . . . . 80.0 111.542 178.47 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.709 0 CA-C-O 120.16 -0.245 . . . . 80.0 113.185 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -129.42 119.34 23.65 Favored 'General case' 0 CA--C 1.498 -1.04 0 N-CA-C 112.669 0.618 . . . . 80.0 112.669 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' PHE . . . . . 0.866 ' HD1' ' H ' ' C' ' 13' ' ' SER . 0.1 OUTLIER -90.52 165.96 13.49 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 118.561 -1.256 . . . . 80.0 111.614 177.797 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' SER . . . . . 0.866 ' H ' ' HD1' ' C' ' 12' ' ' PHE . 31.9 p -105.58 150.71 25.15 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 103.072 -2.936 . . . . 61.81 103.072 175.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' VAL . . . . . 0.592 HG13 ' HB3' ' C' ' 68' ' ' CYS . 0.9 OUTLIER -75.95 -33.26 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 CA-C-O 122.569 1.176 . . . . 29.01 111.189 -176.972 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' CYS . . . . . . . . . . . . . 94.0 m -129.52 156.67 43.78 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-N 114.19 -1.368 . . . . 21.23 107.497 177.378 -69.952 -78.515 -86.773 102.328 2.011 104.233 -90.398 -51.533 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -113.83 146.32 40.14 Favored 'General case' 0 N--CA 1.44 -0.928 0 O-C-N 124.632 1.207 . . . . 37.61 110.905 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 12.1 p -139.2 171.76 13.81 Favored 'General case' 0 C--O 1.207 -1.139 0 C-N-CA 119.6 -0.84 . . . . 21.52 111.084 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' VAL . . . . . 0.519 ' CG1' ' HG3' ' C' ' 59' ' ' ARG . 3.7 m -134.01 131.9 55.97 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.844 0 C-N-CA 126.594 1.957 . . . . 28.54 110.31 179.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' SER . . . . . . . . . . . . . 51.8 m -100.09 162.66 12.83 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 107.921 -1.14 . . . . 28.32 107.921 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -168.97 133.11 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.405 -2.724 0 C-N-CA 115.458 -2.497 . . . . 27.68 108.518 -177.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' TRP . . . . . 0.445 ' HZ2' HD11 ' B' ' 31' ' ' ILE . 89.3 m95 -84.37 113.74 21.38 Favored 'General case' 0 C--O 1.204 -1.301 0 N-CA-C 107.965 -1.124 . . . . 27.81 107.965 177.745 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 58.9 t -103.4 117.72 49.3 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.703 0 N-CA-C 114.486 1.291 . . . . 24.47 114.486 -175.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' GLY . . . . . . . . . . . . . . . -118.05 3.46 16.61 Favored Glycine 0 C--N 1.346 1.108 0 O-C-N 125.806 1.941 . . . . 20.28 111.114 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 41.1 p-10 -126.02 37.0 4.42 Favored 'General case' 0 CA--C 1.478 -1.806 0 CA-C-O 116.467 -1.73 . . . . 28.1 112.332 -175.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' LYS . . . . . 0.498 ' NZ ' ' OE2' ' C' ' 55' ' ' GLU . 15.5 ttmm -85.01 144.39 28.32 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 125.822 1.951 . . . . 80.0 107.487 177.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' THR . . . . . 0.57 ' O ' ' HB ' ' C' ' 37' ' ' THR . 74.8 p -128.15 -23.81 3.24 Favored 'General case' 0 CA--C 1.482 -1.659 0 C-N-CA 117.888 -1.525 . . . . 79.42 111.216 -178.438 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' THR . . . . . . . . . . . . . 52.5 m -131.6 150.28 52.21 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 117.882 -1.527 . . . . 55.49 112.213 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -151.65 171.4 17.7 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 118.663 -1.215 . . . . 28.08 113.589 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 17.3 m -115.33 123.22 48.19 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 105.56 -2.015 . . . . 78.05 105.56 174.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' ASP . . . . . . . . . . . . 0.275 38.1 p30 -78.09 -171.51 2.37 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 118.175 -1.41 . . . . 34.39 112.919 -177.013 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 8.3 tt -69.46 -27.33 33.78 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 N-CA-C 115.647 1.721 . . . . 26.69 115.647 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' LYS . . . . . . . . . . . . . . . -78.35 -21.92 48.79 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 108.822 -0.807 . . . . 43.3 108.822 177.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.77 10.21 23.38 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 114.686 0.634 . . . . 41.12 114.686 174.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' LYS . . . . . . . . . . . . . . . -90.7 146.55 23.91 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 124.534 1.134 . . . . 41.01 112.592 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -75.87 133.22 40.63 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 106.249 -1.76 . . . . 67.43 106.249 175.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' VAL . . . . . 0.454 HG13 ' HB ' ' C' ' 91' ' ' THR . 1.2 t -145.11 156.48 13.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 O-C-N 120.184 -1.573 . . . . 42.93 108.901 -173.684 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' THR . . . . . 0.57 ' HB ' ' O ' ' C' ' 26' ' ' THR 0.404 1.1 p -108.58 134.64 51.06 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 115.207 -2.597 . . . . 52.41 112.91 179.603 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 19.1 t -85.66 123.19 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.861 0 N-CA-C 107.64 -1.244 . . . . 30.3 107.64 -176.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 12.9 mt -72.98 151.82 41.64 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.914 -0.772 . . . . 40.12 108.914 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' C' ' 50' ' ' ARG . . . -72.66 -61.09 1.93 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 116.861 2.171 . . . . 43.63 116.861 -175.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.582 ' HB3' ' O ' ' C' ' 49' ' ' PHE . 0.7 OUTLIER -106.23 152.91 22.88 Favored 'General case' 0 C--N 1.299 -1.625 0 C-N-CA 114.845 -2.742 . . . . 80.0 108.862 -179.868 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' C' ' 49' ' ' PHE 0.335 0.3 OUTLIER -108.7 116.45 51.85 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.696 0 C-N-CA 117.088 -1.845 . . . . 63.69 112.488 177.093 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' C' ' 47' ' ' SER . . . -101.89 138.28 39.07 Favored 'General case' 0 C--O 1.25 1.098 0 CA-C-N 110.455 -3.066 . . . . 80.0 107.339 173.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . . . 172.05 131.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.249 1.03 0 C-N-CA 124.161 0.984 . . . . 80.0 109.609 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' ASN . . . . . 1.079 ' H ' ' ND2' ' B' ' 45' ' ' ASN . 0.1 OUTLIER 64.61 42.73 4.66 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 119.359 -0.936 . . . . 80.0 110.425 -178.221 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' C' ' 46' ' ' ASN . 2.6 p-10 47.24 54.05 9.98 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.484 -1.689 . . . . 80.0 115.17 -178.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' SER . . . . . 0.513 ' O ' ' HA ' ' C' ' 43' ' ' ASN . . . -158.21 153.57 25.89 Favored 'General case' 0 C--N 1.319 -0.719 0 O-C-N 120.545 -1.347 . . . . 80.0 110.378 179.002 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' VAL . . . . . 0.516 HG11 ' OE1' ' C' ' 41' ' ' GLU . 46.7 t -121.25 117.4 52.68 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 0 N-CA-C 115.681 1.734 . . . . 76.48 115.681 -175.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' PHE . . . . . 0.744 ' HB2' HG12 ' C' ' 42' ' ' VAL . 29.0 m-85 -113.39 178.26 4.34 Favored 'General case' 0 CA--C 1.49 -1.363 0 C-N-CA 119.563 -0.855 . . . . 80.0 110.922 177.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' C' ' 40' ' ' ALA . 4.1 ttp180 -121.1 130.26 53.67 Favored 'General case' 0 CA--C 1.496 -1.108 0 C-N-CA 119.559 -0.857 . . . . 80.0 110.206 174.875 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -68.02 122.27 17.87 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 115.799 1.778 . . . . 32.63 115.799 -175.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -119.42 141.3 49.22 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.777 -0.647 . . . . 50.37 112.072 174.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -130.39 133.42 46.36 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 108.308 -0.997 . . . . 38.98 108.308 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' PHE . . . . . 0.552 ' HD2' HG22 ' B' ' 85' ' ' THR . 88.9 t80 -87.26 122.52 31.15 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.269 -1.012 . . . . 23.21 108.269 176.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' GLU . . . . . 0.498 ' OE2' ' NZ ' ' C' ' 25' ' ' LYS . 31.0 mt-10 -127.56 150.83 49.52 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 119.563 1.074 . . . . 29.76 112.072 -176.54 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' THR . . . . . . . . . . . . . 18.7 m -135.91 138.92 42.89 Favored 'General case' 0 CA--C 1.488 -1.414 0 N-CA-C 108.074 -1.084 . . . . 25.71 108.074 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' LYS . . . . . 0.626 ' HE2' ' OD2' ' C' ' 105' ' ' ASP . 12.8 ptpt -155.53 171.79 19.35 Favored 'General case' 0 N--CA 1.427 -1.587 0 C-N-CA 118.556 -1.258 . . . . 17.96 109.573 -176.442 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' CYS . . . . . . . . . . . . . 94.9 m -70.81 132.89 45.98 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 117.562 -1.209 . . . . 19.86 111.782 -178.122 -66.133 -54.771 96.183 104.636 2.024 102.646 72.373 179.732 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' ARG . . . . . 0.519 ' HG3' ' CG1' ' C' ' 18' ' ' VAL 0.285 4.6 mtp85 -68.15 -43.73 77.6 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 123.567 1.651 . . . . 61.45 108.531 175.086 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' ALA . . . . . . . . . . . . 0.255 . . -148.08 161.53 41.21 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-N 112.699 -2.046 . . . . 19.67 109.938 179.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' SER . . . . . . . . . . . . . 1.7 p -82.46 -22.59 35.13 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 114.579 1.326 . . . . 26.62 114.579 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -136.11 75.82 52.9 Favored Pre-proline 0 CA--C 1.493 -1.223 0 O-C-N 119.537 -1.977 . . . . 45.29 111.365 -175.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' PRO . . . . . 0.412 ' HD2' ' O ' ' C' ' 67' ' ' GLY . 8.8 Cg_endo -45.14 -35.73 11.13 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.52 2.147 . . . . 34.08 110.762 176.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' VAL . . . . . . . . . . . . . 31.5 m -129.62 173.28 14.31 Favored 'Isoleucine or valine' 0 CA--C 1.444 -3.103 0 N-CA-C 103.755 -2.683 . . . . 27.99 103.755 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.22 -40.81 82.62 Favored 'General case' 0 C--N 1.285 -2.208 0 N-CA-C 116.246 1.943 . . . . 80.0 116.246 -173.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' SER . . . . . . . . . . . . . 6.7 p -82.19 -10.56 59.11 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 113.395 -1.729 . . . . 39.5 112.624 -175.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' GLY . . . . . 0.412 ' O ' ' HD2' ' C' ' 63' ' ' PRO . . . 127.5 -123.82 4.68 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 108.823 -1.711 . . . . 30.1 108.823 -179.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' CYS . . . . . 0.592 ' HB3' HG13 ' C' ' 14' ' ' VAL . 0.0 OUTLIER -73.23 159.65 33.12 Favored 'General case' 0 N--CA 1.424 -1.728 0 CA-C-O 123.194 1.473 . . . . 24.25 111.259 -179.258 -22.293 155.094 93.489 101.77 2.03 106.643 69.582 -170.943 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' ARG . . . . . 0.472 ' O ' HG22 ' C' ' 14' ' ' VAL . 42.5 mtm-85 -77.78 146.17 36.0 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.975 -1.466 . . . . 64.41 110.514 179.561 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.44 -13.3 28.8 Favored Glycine 0 C--N 1.354 1.57 0 CA-C-O 122.251 0.917 . . . . 23.23 114.932 175.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' ILE . . . . . 0.482 ' N ' HD13 ' C' ' 71' ' ' ILE . 0.2 OUTLIER -59.29 139.65 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.75 0 C-N-CA 118.057 -1.457 . . . . 31.32 113.696 -178.803 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' ASP . . . . . 0.655 ' OD2' ' ND1' ' C' ' 75' ' ' HIS . 7.5 t0 -73.69 105.37 4.97 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 105.281 -2.118 . . . . 80.0 105.281 170.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' SER . . . . . 0.669 ' O ' ' NZ ' ' C' ' 115' ' ' LYS 0.331 0.1 OUTLIER -78.04 -15.37 58.98 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 116.576 2.065 . . . . 80.0 116.576 -177.483 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' LYS . . . . . 0.528 ' O ' ' HG3' ' C' ' 115' ' ' LYS . . . -65.99 -53.2 41.84 Favored 'General case' 0 CA--C 1.493 -1.231 0 C-N-CA 117.094 -1.842 . . . . 80.0 108.305 177.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' HIS . . . . . 0.717 ' O ' ' HG2' ' C' ' 115' ' ' LYS . 29.4 m80 -82.11 -30.49 31.15 Favored 'General case' 0 CA--C 1.492 -1.288 0 N-CA-C 113.76 1.022 . . . . 43.76 113.76 -178.789 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' TRP . . . . . 0.509 ' C ' ' HD3' ' C' ' 115' ' ' LYS . 60.4 m95 -118.87 158.14 26.26 Favored 'General case' 0 C--O 1.21 -0.993 0 C-N-CA 113.034 -3.466 . . . . 42.33 119.258 -175.085 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' ASN . . . . . 0.523 ' HB2' ' HB3' ' C' ' 113' ' ' SER . 8.8 m120 -114.39 139.07 49.79 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 103.699 -2.704 . . . . 60.43 103.699 170.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' SER . . . . . . . . . . . . . 81.5 p -152.06 164.29 37.56 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 113.366 0.876 . . . . 31.75 113.366 -177.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -165.06 160.3 18.74 Favored 'General case' 0 N--CA 1.424 -1.76 0 CA-C-O 116.894 -1.527 . . . . 34.3 108.491 173.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' CYS . . . . . 0.431 ' HB3' ' SG ' ' C' ' 108' ' ' CYS . 35.6 m -89.31 144.01 26.4 Favored 'General case' 0 C--O 1.238 0.469 0 O-C-N 125.156 1.535 . . . . 22.75 111.894 178.937 -51.533 -90.398 -86.773 104.233 2.011 102.328 -78.515 -69.952 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 4.6 t -146.32 152.38 39.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 113.213 -1.812 . . . . 55.88 112.571 -178.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' C' ' 107' ' ' ALA . 84.2 m -87.35 140.76 29.21 Favored 'General case' 0 N--CA 1.425 -1.697 0 CA-C-N 113.355 -1.748 . . . . 21.2 108.933 -178.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' THR . . . . . 0.676 HG22 HG22 ' C' ' 106' ' ' THR . 0.6 OUTLIER -114.18 148.94 36.47 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 127.106 2.754 . . . . 24.71 108.08 -178.95 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' HIS . . . . . 0.436 ' HB3' ' HG3' ' C' ' 103' ' ' ARG . 57.8 m80 -108.26 157.95 17.89 Favored 'General case' 0 CA--C 1.56 1.352 0 N-CA-C 116.899 2.185 . . . . 29.36 116.899 -177.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' THR . . . . . . . . . . . . . 8.9 t -134.05 168.32 19.03 Favored 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 104.466 -2.42 . . . . 23.24 104.466 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -116.57 140.2 49.65 Favored 'General case' 0 CA--C 1.458 -2.56 0 CA-C-O 117.015 -1.469 . . . . 22.65 107.38 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' VAL . . . . . . . . . . . . . 1.5 t -139.43 147.77 24.03 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.36 0 O-C-N 127.161 2.788 . . . . 21.34 109.45 -175.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.14 143.03 31.73 Favored 'General case' 0 C--O 1.205 -1.274 0 C-N-CA 118.563 -1.255 . . . . 80.0 108.64 -175.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' ALA . . . . . 0.444 ' O ' HG23 ' C' ' 91' ' ' THR . . . -158.18 144.61 17.45 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 119.798 -0.761 . . . . 28.04 112.632 -179.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' LEU . . . . . 0.747 HD12 ' N ' ' C' ' 91' ' ' THR . 0.2 OUTLIER -73.24 119.0 16.87 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 108.341 -0.985 . . . . 45.39 108.341 177.308 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' THR . . . . . 0.747 ' N ' HD12 ' C' ' 90' ' ' LEU 0.266 63.2 p -141.88 171.32 14.21 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 123.726 0.641 . . . . 41.79 112.527 -174.806 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' THR . . . . . 0.791 HG22 ' HA ' ' C' ' 97' ' ' ALA . 38.0 p -142.85 129.46 20.27 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 114.769 -1.105 . . . . 58.99 112.481 177.325 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' C' ' 93' ' ' ASP . 21.1 p-10 -91.49 161.38 14.99 Favored 'General case' 0 N--CA 1.426 -1.625 1 N-CA-C 94.385 -6.154 . . . . 80.0 94.385 167.668 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' GLU . . . . . 0.645 ' OE1' ' N ' ' C' ' 95' ' ' LYS . 0.0 OUTLIER -37.99 -34.22 0.11 Allowed 'General case' 0 C--N 1.301 -1.516 0 O-C-N 125.808 1.942 . . . . 80.0 113.259 -179.786 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' LYS . . . . . 0.645 ' N ' ' OE1' ' C' ' 94' ' ' GLU 0.339 . . -59.8 -85.31 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 113.888 -1.505 . . . . 78.51 110.771 -179.839 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -135.17 151.99 51.18 Favored 'General case' 0 C--O 1.245 0.845 0 O-C-N 127.887 3.242 . . . . 80.0 118.054 -172.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' ALA . . . . . 0.791 ' HA ' HG22 ' C' ' 92' ' ' THR . . . -64.45 155.92 31.12 Favored 'General case' 0 CA--C 1.494 -1.18 0 N-CA-C 103.848 -2.649 . . . . 63.15 103.848 177.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' ALA . . . . . 0.655 ' HB3' ' NH1' ' C' ' 100' ' ' ARG . . . 174.88 140.13 0.05 OUTLIER 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 124.026 0.829 . . . . 53.94 110.516 -177.485 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -76.72 142.28 40.55 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 106.741 -1.577 . . . . 49.61 106.741 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' ARG . . . . . 0.655 ' NH1' ' HB3' ' C' ' 98' ' ' ALA . 60.3 mtt85 -148.03 159.46 43.88 Favored 'General case' 0 CA--C 1.479 -1.766 0 CA-C-N 114.657 -1.156 . . . . 58.29 108.094 -179.312 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -91.3 135.64 33.67 Favored 'General case' 0 N--CA 1.397 -3.09 0 C-N-CA 114.109 -3.036 . . . . 23.76 103.048 175.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' ILE . . . . . . . . . . . . . 33.2 pt -121.77 161.73 21.93 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.016 0 C-N-CA 117.977 -1.489 . . . . 22.47 108.788 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' ARG . . . . . 0.436 ' HG3' ' HB3' ' C' ' 84' ' ' HIS . 21.2 ttt-85 -93.71 129.17 40.13 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 125.039 1.462 . . . . 80.0 111.127 -178.053 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' ILE . . . . . . . . . . . . . 8.5 pt -135.61 151.15 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 N-CA-C 113.713 1.005 . . . . 39.62 113.713 178.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' ASP . . . . . 0.626 ' OD2' ' HE2' ' C' ' 57' ' ' LYS . 20.9 m-20 -62.47 125.85 25.32 Favored 'General case' 0 C--O 1.203 -1.382 0 N-CA-C 107.657 -1.238 . . . . 25.07 107.657 -178.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' THR . . . . . 0.676 HG22 HG22 ' C' ' 83' ' ' THR . 0.6 OUTLIER -122.74 -19.3 6.28 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 115.053 1.501 . . . . 18.87 115.053 -175.109 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' ALA . . . . . 0.463 ' O ' ' HA ' ' C' ' 82' ' ' THR . . . -171.29 171.88 5.46 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 120.627 -1.295 . . . . 15.04 110.831 -176.465 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' CYS . . . . . 0.431 ' SG ' ' HB3' ' C' ' 80' ' ' CYS . 51.2 t -128.71 118.1 22.28 Favored 'General case' 0 CA--C 1.487 -1.475 0 N-CA-C 107.508 -1.293 . . . . 17.1 107.508 -178.202 179.732 72.373 96.183 102.646 2.024 104.636 -54.771 -66.133 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' VAL . . . . . . . . . . . . . 31.8 m -130.22 161.58 39.7 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.404 0 C-N-CA 118.521 -1.272 . . . . 22.04 110.429 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' CYS . . . . . 0.526 ' HB2' HG11 ' C' ' 14' ' ' VAL . 34.7 t -84.66 136.32 33.8 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 127.679 3.112 . . . . 25.39 112.427 178.226 -170.943 69.582 93.489 106.643 2.03 101.77 155.094 -22.293 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -132.23 116.4 29.11 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.196 0 N-CA-C 114.581 1.326 . . . . 20.43 114.581 -178.509 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' LEU . . . . . 0.461 HD21 ' HA3' ' B' ' 70' ' ' GLY . 0.0 OUTLIER -79.57 158.98 27.02 Favored 'General case' 0 C--O 1.197 -1.67 0 N-CA-C 114.646 1.35 . . . . 38.78 114.646 -176.518 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' SER . . . . . 0.642 ' HB2' ' O ' ' B' ' 954' ' ' HOH . 1.1 t -147.27 124.22 11.33 Favored 'General case' 0 C--N 1.312 -1.056 0 C-N-CA 126.96 2.104 . . . . 42.04 106.243 174.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -75.71 131.81 40.11 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 114.903 1.446 . . . . 35.66 114.903 -175.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' LYS . . . . . 0.717 ' HG2' ' O ' ' C' ' 75' ' ' HIS . 0.0 OUTLIER -72.91 134.71 44.9 Favored 'General case' 0 CA--C 1.498 -1.054 0 C-N-CA 118.001 -1.479 . . . . 56.96 109.3 175.252 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' ALA . . . . . 0.501 ' O ' HG23 ' C' ' 117' ' ' THR . . . -66.94 50.54 0.04 OUTLIER 'General case' 0 CA--C 1.477 -1.858 0 N-CA-C 120.314 3.45 . . . . 68.05 120.314 -172.062 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' THR . . . . . 0.501 HG23 ' O ' ' C' ' 116' ' ' ALA . 0.2 OUTLIER -171.92 157.89 4.61 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 121.192 1.814 . . . . 80.0 110.444 179.721 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.784 0 C-N-CA 128.603 2.761 . . . . 80.0 111.191 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 902' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 900' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 901' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 903' ' ' HOH . . . . . 0.57 ' O ' ' NE2' ' A' ' 75' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 921' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 922' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 923' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 924' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 925' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 926' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 941' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 904' ' ' HOH . . . . . 0.65 ' O ' ' NE2' ' B' ' 75' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 927' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 928' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 930' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 931' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 933' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 934' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 935' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 936' ' ' HOH . . . . . 0.44 ' O ' ' HA ' ' B' ' 106' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 937' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 938' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 939' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 940' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 942' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 943' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 944' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 954' ' ' HOH . . . . . 0.642 ' O ' ' HB2' ' C' ' 113' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 961' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 962' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 929' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 932' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 949' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 950' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 951' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 952' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 953' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 955' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 956' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 957' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 958' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 959' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 960' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_