NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
638227 | 6osw | 30608 | cing | 1-original | 1 | STAR | chemical shift |
# Restraints file 1: FoxM1_cs_QRBLEUp.str data_nef_csrosetta_test_1 ####################### # Entry information # ####################### save_nef_nmr_meta_data _Entry.Sf_category entry_information _Entry.Sf_framecode nef_nmr_meta_data _Entry.NMR_STAR_version 3.2.0.4 _Entry.Source_data_format nmr_exchange_format _Entry.Source_data_format_version 1.1 _Entry.Generated_software_name CS-Rosetta _Entry.Generated_software_version 3.4 _Entry.Generated_date 2019-01-03 _Entry.UUID CS-Rosetta_Thu_Jan_3_21:43:48_PST_bf8fe124-46b4-4575-81b5-7151a341a58f save_ ############################################# # Molecular system (assembly) description # ############################################# save_nef_molecular_system _Assembly.Sf_category assembly _Assembly.Sf_framecode nef_molecular_system loop_ _Chem_comp_assembly.Entity_assembly_ID _Chem_comp_assembly.Comp_index_ID _Chem_comp_assembly.Comp_ID _Chem_comp_assembly.Auth_asym_ID _Chem_comp_assembly.Auth_seq_ID _Chem_comp_assembly.Auth_comp_ID _Chem_comp_assembly.Auth_variant_ID _Chem_comp_assembly.Sequence_linking _Chem_comp_assembly.NEF_index 1 1 GLY A 32 GLY . start 1 1 2 ILE A 33 ILE . middle 2 1 3 ARG A 34 ARG . middle 3 1 4 VAL A 35 VAL . middle 4 1 5 MET A 36 MET . middle 5 1 6 ASP A 37 ASP . middle 6 1 7 HIS A 38 HIS . middle 7 1 8 PRO A 39 PRO . middle 8 1 9 THR A 40 THR . middle 9 1 10 MET A 41 MET . middle 10 1 11 PRO A 42 PRO . middle 11 1 12 ASP A 43 ASP . middle 12 1 13 THR A 44 THR . middle 13 1 14 GLN A 45 GLN . middle 14 1 15 VAL A 46 VAL . middle 15 1 16 VAL A 47 VAL . middle 16 1 17 VAL A 48 VAL . middle 17 1 18 ILE A 49 ILE . middle 18 1 19 PRO A 50 PRO . middle 19 1 20 LYS A 51 LYS . middle 20 1 21 SER A 52 SER . middle 21 1 22 ALA A 53 ALA . middle 22 1 23 ASP A 54 ASP . middle 23 1 24 LEU A 55 LEU . middle 24 1 25 GLN A 56 GLN . middle 25 1 26 SER A 57 SER . middle 26 1 27 VAL A 58 VAL . middle 27 1 28 ILE A 59 ILE . middle 28 1 29 SER A 60 SER . middle 29 1 30 VAL A 61 VAL . middle 30 1 31 LEU A 62 LEU . middle 31 1 32 THR A 63 THR . middle 32 1 33 ALA A 64 ALA . middle 33 1 34 LYS A 65 LYS . middle 34 1 35 GLY A 66 GLY . middle 35 1 36 LYS A 67 LYS . middle 36 1 37 GLU A 68 GLU . middle 37 1 38 ALA A 69 ALA . middle 38 1 39 GLY A 70 GLY . middle 39 1 40 PRO A 71 PRO . middle 40 1 41 GLN A 72 GLN . middle 41 1 42 GLY A 73 GLY . middle 42 1 43 ARG A 74 ARG . middle 43 1 44 ASN A 75 ASN . middle 44 1 45 LYS A 76 LYS . middle 45 1 46 PHE A 77 PHE . middle 46 1 47 ILE A 78 ILE . middle 47 1 48 LEU A 79 LEU . middle 48 1 49 LEU A 80 LEU . middle 49 1 50 SER A 81 SER . middle 50 1 51 GLY A 82 GLY . middle 51 1 52 ASP A 83 ASP . middle 52 1 53 THR A 84 THR . middle 53 1 54 SER A 85 SER . middle 54 1 55 ALA B 569 ALA . middle 55 1 56 GLN B 570 GLN . middle 56 1 57 ALA B 571 ALA . middle 57 1 58 GLY B 572 GLY . middle 58 1 59 ALA B 573 ALA . middle 59 1 60 ALA B 574 ALA . middle 60 1 61 ASN B 575 ASN . middle 61 1 62 ARG B 576 ARG . middle 62 1 63 SER B 577 SER . middle 63 1 64 LEU B 578 LEU . middle 64 1 65 THR B 579 THR . middle 65 1 66 GLU B 580 GLU . middle 66 1 67 GLY B 581 GLY . middle 67 1 68 PHE B 582 PHE . middle 68 1 69 VAL B 583 VAL . middle 69 1 70 LEU B 584 LEU . middle 70 1 71 ASP B 585 ASP . middle 71 1 72 THR B 586 THR . middle 72 1 73 MET B 587 MET . middle 73 1 74 ASN B 588 ASN . middle 74 1 75 ASP B 589 ASP . middle 75 1 76 SER B 590 SER . middle 76 1 77 LEU B 591 LEU . middle 77 1 78 SER B 592 SER . middle 78 1 79 LYS B 593 LYS . end 79 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_nef_chemical_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode nef_chemical_shift_list_1 loop_ _Atom_chem_shift.ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 1 32 GLY CA 44.680 . 1 A 32 GLY CA 1 2 1 32 GLY H 8.270 . 1 A 32 GLY H 1 3 1 32 GLY N 107.870 . 1 A 32 GLY N 1 4 1 33 ILE C 175.110 . 1 A 33 ILE C 1 5 1 33 ILE CA 60.910 . 1 A 33 ILE CA 1 6 1 33 ILE CB 37.310 . 1 A 33 ILE CB 1 7 1 34 ARG C 176.660 . 1 A 34 ARG C 1 8 1 34 ARG CA 54.070 . 1 A 34 ARG CA 1 9 1 34 ARG CB 31.718 . 1 A 34 ARG CB 1 10 1 34 ARG H 8.030 . 1 A 34 ARG H 1 11 1 34 ARG N 125.710 . 1 A 34 ARG N 1 12 1 35 VAL C 175.190 . 1 A 35 VAL C 1 13 1 35 VAL CA 60.710 . 1 A 35 VAL CA 1 14 1 35 VAL CB 33.420 . 1 A 35 VAL CB 1 15 1 35 VAL H 8.790 . 1 A 35 VAL H 1 16 1 35 VAL N 118.600 . 1 A 35 VAL N 1 17 1 36 MET C 175.010 . 1 A 36 MET C 1 18 1 36 MET CA 53.630 . 1 A 36 MET CA 1 19 1 36 MET CB 35.740 . 1 A 36 MET CB 1 20 1 36 MET H 9.210 . 1 A 36 MET H 1 21 1 36 MET N 124.740 . 1 A 36 MET N 1 22 1 37 ASP C 175.470 . 1 A 37 ASP C 1 23 1 37 ASP CA 55.150 . 1 A 37 ASP CA 1 24 1 37 ASP CB 38.890 . 1 A 37 ASP CB 1 25 1 37 ASP H 9.000 . 1 A 37 ASP H 1 26 1 37 ASP N 125.300 . 1 A 37 ASP N 1 27 1 38 HIS CA 55.960 . 1 A 38 HIS CA 1 28 1 38 HIS H 7.940 . 1 A 38 HIS H 1 29 1 38 HIS N 125.450 . 1 A 38 HIS N 1 30 1 39 PRO C 177.720 . 1 A 39 PRO C 1 31 1 39 PRO CA 64.420 . 1 A 39 PRO CA 1 32 1 39 PRO CB 31.870 . 1 A 39 PRO CB 1 33 1 40 THR C 176.430 . 1 A 40 THR C 1 34 1 40 THR CA 61.680 . 1 A 40 THR CA 1 35 1 40 THR CB 69.220 . 1 A 40 THR CB 1 36 1 40 THR H 9.370 . 1 A 40 THR H 1 37 1 40 THR N 109.340 . 1 A 40 THR N 1 38 1 41 MET CA 56.410 . 1 A 41 MET CA 1 39 1 41 MET H 8.170 . 1 A 41 MET H 1 40 1 41 MET N 123.140 . 1 A 41 MET N 1 41 1 42 PRO CA 64.270 . 1 A 42 PRO CA 1 42 1 42 PRO CB 31.000 . 1 A 42 PRO CB 1 43 1 43 ASP C 175.780 . 1 A 43 ASP C 1 44 1 43 ASP CA 52.080 . 1 A 43 ASP CA 1 45 1 43 ASP CB 40.620 . 1 A 43 ASP CB 1 46 1 43 ASP H 7.800 . 1 A 43 ASP H 1 47 1 43 ASP N 114.270 . 1 A 43 ASP N 1 48 1 44 THR CA 62.520 . 1 A 44 THR CA 1 49 1 44 THR CB 71.210 . 1 A 44 THR CB 1 50 1 44 THR H 7.580 . 1 A 44 THR H 1 51 1 44 THR N 116.370 . 1 A 44 THR N 1 52 1 45 GLN C 173.570 . 1 A 45 GLN C 1 53 1 45 GLN CA 54.940 . 1 A 45 GLN CA 1 54 1 45 GLN CB 32.130 . 1 A 45 GLN CB 1 55 1 45 GLN H 8.860 . 1 A 45 GLN H 1 56 1 45 GLN N 126.110 . 1 A 45 GLN N 1 57 1 46 VAL C 173.680 . 1 A 46 VAL C 1 58 1 46 VAL CA 61.570 . 1 A 46 VAL CA 1 59 1 46 VAL CB 32.290 . 1 A 46 VAL CB 1 60 1 46 VAL H 9.550 . 1 A 46 VAL H 1 61 1 46 VAL N 124.250 . 1 A 46 VAL N 1 62 1 47 VAL C 173.980 . 1 A 47 VAL C 1 63 1 47 VAL CA 60.030 . 1 A 47 VAL CA 1 64 1 47 VAL CB 33.450 . 1 A 47 VAL CB 1 65 1 47 VAL H 9.560 . 1 A 47 VAL H 1 66 1 47 VAL N 128.510 . 1 A 47 VAL N 1 67 1 48 VAL C 175.990 . 1 A 48 VAL C 1 68 1 48 VAL CA 61.160 . 1 A 48 VAL CA 1 69 1 48 VAL CB 31.710 . 1 A 48 VAL CB 1 70 1 48 VAL H 8.940 . 1 A 48 VAL H 1 71 1 48 VAL N 126.790 . 1 A 48 VAL N 1 72 1 49 ILE CA 57.760 . 1 A 49 ILE CA 1 73 1 49 ILE H 8.920 . 1 A 49 ILE H 1 74 1 49 ILE N 127.680 . 1 A 49 ILE N 1 75 1 50 PRO C 176.690 . 1 A 50 PRO C 1 76 1 50 PRO CA 62.780 . 1 A 50 PRO CA 1 77 1 50 PRO CB 31.240 . 1 A 50 PRO CB 1 78 1 51 LYS C 176.110 . 1 A 51 LYS C 1 79 1 51 LYS CA 55.970 . 1 A 51 LYS CA 1 80 1 51 LYS CB 29.630 . 1 A 51 LYS CB 1 81 1 51 LYS H 8.350 . 1 A 51 LYS H 1 82 1 51 LYS N 121.390 . 1 A 51 LYS N 1 83 1 52 SER C 174.620 . 1 A 52 SER C 1 84 1 52 SER CA 58.170 . 1 A 52 SER CA 1 85 1 52 SER CB 62.550 . 1 A 52 SER CB 1 86 1 52 SER H 8.350 . 1 A 52 SER H 1 87 1 52 SER N 119.110 . 1 A 52 SER N 1 88 1 53 ALA CA 51.444 . 1 A 53 ALA CA 1 89 1 53 ALA CB 18.920 . 1 A 53 ALA CB 1 90 1 53 ALA H 7.530 . 1 A 53 ALA H 1 91 1 53 ALA N 124.880 . 1 A 53 ALA N 1 92 1 54 ASP C 176.190 . 1 A 54 ASP C 1 93 1 54 ASP CA 53.190 . 1 A 54 ASP CA 1 94 1 54 ASP CB 40.790 . 1 A 54 ASP CB 1 95 1 54 ASP H 8.410 . 1 A 54 ASP H 1 96 1 54 ASP N 120.930 . 1 A 54 ASP N 1 97 1 55 LEU CA 58.090 . 1 A 55 LEU CA 1 98 1 55 LEU CB 40.760 . 1 A 55 LEU CB 1 99 1 55 LEU H 8.540 . 1 A 55 LEU H 1 100 1 55 LEU N 129.010 . 1 A 55 LEU N 1 101 1 56 GLN C 179.050 . 1 A 56 GLN C 1 102 1 56 GLN CA 58.920 . 1 A 56 GLN CA 1 103 1 56 GLN CB 26.800 . 1 A 56 GLN CB 1 104 1 56 GLN H 8.290 . 1 A 56 GLN H 1 105 1 56 GLN N 116.780 . 1 A 56 GLN N 1 106 1 57 SER C 176.670 . 1 A 57 SER C 1 107 1 57 SER CA 61.350 . 1 A 57 SER CA 1 108 1 57 SER CB 62.010 . 1 A 57 SER CB 1 109 1 57 SER H 7.810 . 1 A 57 SER H 1 110 1 57 SER N 116.610 . 1 A 57 SER N 1 111 1 58 VAL C 177.690 . 1 A 58 VAL C 1 112 1 58 VAL CA 66.370 . 1 A 58 VAL CA 1 113 1 58 VAL CB 30.560 . 1 A 58 VAL CB 1 114 1 58 VAL H 7.710 . 1 A 58 VAL H 1 115 1 58 VAL N 122.230 . 1 A 58 VAL N 1 116 1 59 ILE C 179.300 . 1 A 59 ILE C 1 117 1 59 ILE CA 65.590 . 1 A 59 ILE CA 1 118 1 59 ILE CB 36.360 . 1 A 59 ILE CB 1 119 1 59 ILE H 8.530 . 1 A 59 ILE H 1 120 1 59 ILE N 119.830 . 1 A 59 ILE N 1 121 1 60 SER C 177.240 . 1 A 60 SER C 1 122 1 60 SER CA 62.140 . 1 A 60 SER CA 1 123 1 60 SER H 8.090 . 1 A 60 SER H 1 124 1 60 SER N 118.420 . 1 A 60 SER N 1 125 1 61 VAL CA 65.890 . 1 A 61 VAL CA 1 126 1 61 VAL CB 30.870 . 1 A 61 VAL CB 1 127 1 61 VAL H 7.650 . 1 A 61 VAL H 1 128 1 61 VAL N 123.050 . 1 A 61 VAL N 1 129 1 62 LEU CA 55.440 . 1 A 62 LEU CA 1 130 1 62 LEU CB 39.440 . 1 A 62 LEU CB 1 131 1 62 LEU H 8.340 . 1 A 62 LEU H 1 132 1 62 LEU N 119.730 . 1 A 62 LEU N 1 133 1 63 THR C 175.320 . 1 A 63 THR C 1 134 1 63 THR CA 67.330 . 1 A 63 THR CA 1 135 1 63 THR CB 68.100 . 1 A 63 THR CB 1 136 1 63 THR H 8.390 . 1 A 63 THR H 1 137 1 63 THR N 116.590 . 1 A 63 THR N 1 138 1 64 ALA C 180.520 . 1 A 64 ALA C 1 139 1 64 ALA CA 54.710 . 1 A 64 ALA CA 1 140 1 64 ALA CB 17.020 . 1 A 64 ALA CB 1 141 1 64 ALA H 7.050 . 1 A 64 ALA H 1 142 1 64 ALA N 122.450 . 1 A 64 ALA N 1 143 1 65 LYS C 180.320 . 1 A 65 LYS C 1 144 1 65 LYS CA 58.680 . 1 A 65 LYS CA 1 145 1 65 LYS CB 31.570 . 1 A 65 LYS CB 1 146 1 65 LYS H 7.920 . 1 A 65 LYS H 1 147 1 65 LYS N 119.130 . 1 A 65 LYS N 1 148 1 66 GLY C 176.160 . 1 A 66 GLY C 1 149 1 66 GLY CA 46.760 . 1 A 66 GLY CA 1 150 1 66 GLY H 9.280 . 1 A 66 GLY H 1 151 1 66 GLY N 109.500 . 1 A 66 GLY N 1 152 1 67 LYS C 179.980 . 1 A 67 LYS C 1 153 1 67 LYS CA 58.960 . 1 A 67 LYS CA 1 154 1 67 LYS CB 31.320 . 1 A 67 LYS CB 1 155 1 67 LYS H 8.180 . 1 A 67 LYS H 1 156 1 67 LYS N 119.760 . 1 A 67 LYS N 1 157 1 68 GLU C 177.910 . 1 A 68 GLU C 1 158 1 68 GLU CA 58.040 . 1 A 68 GLU CA 1 159 1 68 GLU CB 28.770 . 1 A 68 GLU CB 1 160 1 68 GLU H 7.720 . 1 A 68 GLU H 1 161 1 68 GLU N 119.370 . 1 A 68 GLU N 1 162 1 69 ALA C 179.886 . 1 A 69 ALA C 1 163 1 69 ALA CA 53.770 . 1 A 69 ALA CA 1 164 1 69 ALA CB 18.200 . 1 A 69 ALA CB 1 165 1 69 ALA H 7.820 . 1 A 69 ALA H 1 166 1 69 ALA N 123.120 . 1 A 69 ALA N 1 167 1 70 GLY CA 44.300 . 1 A 70 GLY CA 1 168 1 70 GLY H 7.680 . 1 A 70 GLY H 1 169 1 70 GLY N 103.250 . 1 A 70 GLY N 1 170 1 71 PRO C 177.950 . 1 A 71 PRO C 1 171 1 71 PRO CA 64.620 . 1 A 71 PRO CA 1 172 1 71 PRO CB 31.380 . 1 A 71 PRO CB 1 173 1 72 GLN C 176.090 . 1 A 72 GLN C 1 174 1 72 GLN CA 55.270 . 1 A 72 GLN CA 1 175 1 72 GLN CB 27.700 . 1 A 72 GLN CB 1 176 1 72 GLN H 8.630 . 1 A 72 GLN H 1 177 1 73 GLN N 115.870 . 1 A 72 GLN N 1 178 1 73 GLY C 172.720 . 1 A 73 GLY C 1 179 1 73 GLY CA 43.110 . 1 A 73 GLY CA 1 180 1 73 GLY H 7.250 . 1 A 73 GLY H 1 181 1 73 GLY N 108.960 . 1 A 73 GLY N 1 182 1 74 ARG C 173.380 . 1 A 74 ARG C 1 183 1 74 ARG CA 55.110 . 1 A 74 ARG CA 1 184 1 74 ARG CB 26.540 . 1 A 74 ARG CB 1 185 1 74 ARG H 8.380 . 1 A 74 ARG H 1 186 1 74 ARG N 119.030 . 1 A 74 ARG N 1 187 1 75 ASN CA 51.740 . 1 A 75 ASN CA 1 188 1 75 ASN CB 39.760 . 1 A 75 ASN CB 1 189 1 75 ASN H 7.290 . 1 A 75 ASN H 1 190 1 75 ASN N 119.600 . 1 A 75 ASN N 1 191 1 76 LYS C 174.420 . 1 A 76 LYS C 1 192 1 76 LYS CA 54.330 . 1 A 76 LYS CA 1 193 1 76 LYS CB 33.700 . 1 A 76 LYS CB 1 194 1 76 LYS H 8.010 . 1 A 76 LYS H 1 195 1 76 LYS N 123.220 . 1 A 76 LYS N 1 196 1 77 PHE C 174.960 . 1 A 77 PHE C 1 197 1 77 PHE CA 55.400 . 1 A 77 PHE CA 1 198 1 77 PHE CB 42.190 . 1 A 77 PHE CB 1 199 1 77 PHE H 8.980 . 1 A 77 PHE H 1 200 1 77 PHE N 118.700 . 1 A 77 PHE N 1 201 1 78 ILE C 174.040 . 1 A 78 ILE C 1 202 1 78 ILE CA 59.890 . 1 A 78 ILE CA 1 203 1 78 ILE H 9.060 . 1 A 78 ILE H 1 204 1 78 ILE N 125.200 . 1 A 78 ILE N 1 205 1 79 LEU C 175.390 . 1 A 79 LEU C 1 206 1 79 LEU CA 53.900 . 1 A 79 LEU CA 1 207 1 79 LEU CB 41.160 . 1 A 79 LEU CB 1 208 1 79 LEU H 9.600 . 1 A 79 LEU H 1 209 1 79 LEU N 128.200 . 1 A 79 LEU N 1 210 1 80 LEU C 175.530 . 1 A 80 LEU C 1 211 1 80 LEU CA 52.720 . 1 A 80 LEU CA 1 212 1 80 LEU CB 43.640 . 1 A 80 LEU CB 1 213 1 80 LEU H 8.950 . 1 A 80 LEU H 1 214 1 80 LEU N 123.340 . 1 A 80 LEU N 1 215 1 81 SER C 175.170 . 1 A 81 SER C 1 216 1 81 SER CA 56.870 . 1 A 81 SER CA 1 217 1 81 SER CB 63.840 . 1 A 81 SER CB 1 218 1 81 SER H 8.660 . 1 A 81 SER H 1 219 1 81 SER N 116.790 . 1 A 81 SER N 1 220 1 82 GLY CA 44.660 . 1 A 82 GLY CA 1 221 1 82 GLY H 8.350 . 1 A 82 GLY H 1 222 1 82 GLY N 112.380 . 1 A 82 GLY N 1 223 1 83 ASP CA 53.510 . 1 A 83 ASP CA 1 224 1 83 ASP CB 41.360 . 1 A 83 ASP CB 1 225 1 83 ASP H 8.250 . 1 A 83 ASP H 1 226 1 83 ASP N 120.450 . 1 A 83 ASP N 1 227 1 84 THR CA 61.620 . 1 A 84 THR CA 1 228 1 84 THR CB 69.240 . 1 A 84 THR CB 1 229 1 84 THR H 8.190 . 1 A 84 THR H 1 230 1 84 THR N 114.870 . 1 A 84 THR N 1 231 1 85 SER CA 58.480 . 1 A 85 SER CA 1 232 1 85 SER CB 63.460 . 1 A 85 SER CB 1 233 1 85 SER H 8.400 . 1 A 85 SER H 1 234 1 85 SER N 118.670 . 1 A 85 SER N 1 235 1 569 ALA CA 52.090 . 1 B 569 ALA CA 1 236 1 569 ALA CB 18.540 . 1 B 569 ALA CB 1 237 1 569 ALA H 8.180 . 1 B 569 ALA H 1 238 1 569 ALA N 126.410 . 1 B 569 ALA N 1 239 1 570 GLN C 174.560 . 1 B 570 GLN C 1 240 1 570 GLN CA 55.330 . 1 B 570 GLN CA 1 241 1 570 GLN CB 28.650 . 1 B 570 GLN CB 1 242 1 570 GLN H 8.440 . 1 B 570 GLN H 1 243 1 570 GLN N 120.460 . 1 B 570 GLN N 1 244 1 571 ALA CA 52.260 . 1 B 571 ALA CA 1 245 1 571 ALA CB 18.390 . 1 B 571 ALA CB 1 246 1 571 ALA H 8.370 . 1 B 571 ALA H 1 247 1 571 ALA N 126.290 . 1 B 571 ALA N 1 248 1 572 GLY C 173.950 . 1 B 572 GLY C 1 249 1 572 GLY CA 44.530 . 1 B 572 GLY CA 1 250 1 572 GLY H 8.340 . 1 B 572 GLY H 1 251 1 572 GLY N 109.020 . 1 B 572 GLY N 1 252 1 573 ALA CA 51.950 . 1 B 573 ALA CA 1 253 1 573 ALA H 8.050 . 1 B 573 ALA H 1 254 1 573 ALA N 124.130 . 1 B 573 ALA N 1 255 1 574 ALA C 177.570 . 1 B 574 ALA C 1 256 1 574 ALA CA 52.140 . 1 B 574 ALA CA 1 257 1 574 ALA CB 18.340 . 1 B 574 ALA CB 1 258 1 575 ASN CA 52.840 . 1 B 575 ASN CA 1 259 1 575 ASN CB 38.250 . 1 B 575 ASN CB 1 260 1 575 ASN H 8.260 . 1 B 575 ASN H 1 261 1 575 ASN N 117.860 . 1 B 575 ASN N 1 262 1 576 ARG CA 55.540 . 1 B 576 ARG CA 1 263 1 576 ARG CB 30.180 . 1 B 576 ARG CB 1 264 1 576 ARG H 8.130 . 1 B 576 ARG H 1 265 1 576 ARG N 121.700 . 1 B 576 ARG N 1 266 1 577 SER C 174.970 . 1 B 577 SER C 1 267 1 577 SER CA 57.800 . 1 B 577 SER CA 1 268 1 577 SER CB 63.480 . 1 B 577 SER CB 1 269 1 577 SER H 8.470 . 1 B 577 SER H 1 270 1 577 SER N 118.150 . 1 B 577 SER N 1 271 1 578 LEU C 176.550 . 1 B 578 LEU C 1 272 1 578 LEU CA 53.880 . 1 B 578 LEU CA 1 273 1 578 LEU H 8.100 . 1 B 578 LEU H 1 274 1 578 LEU N 124.110 . 1 B 578 LEU N 1 275 1 579 THR H 8.000 . 1 B 579 THR H 1 276 1 579 THR N 114.170 . 1 B 579 THR N 1 277 1 580 GLU CA 51.980 . 1 B 580 GLU CA 1 278 1 580 GLY CA 43.970 . 1 B 581 GLY CA 1 279 1 581 GLY H 8.110 . 1 B 581 GLY H 1 280 1 581 GLY N 108.390 . 1 B 581 GLY N 1 281 1 582 PHE C 175.070 . 1 B 582 PHE C 1 282 1 582 PHE CA 56.110 . 1 B 582 PHE CA 1 283 1 582 PHE CB 43.490 . 1 B 582 PHE CB 1 284 1 582 PHE H 8.460 . 1 B 582 PHE H 1 285 1 582 PHE N 117.350 . 1 B 582 PHE N 1 286 1 583 VAL C 174.780 . 1 B 583 VAL C 1 287 1 583 VAL CA 60.060 . 1 B 583 VAL CA 1 288 1 583 VAL CB 33.140 . 1 B 583 VAL CB 1 289 1 583 VAL H 9.430 . 1 B 583 VAL H 1 290 1 583 VAL N 119.540 . 1 B 583 VAL N 1 291 1 584 LEU C 174.100 . 1 B 584 LEU C 1 292 1 584 LEU CA 52.760 . 1 B 584 LEU CA 1 293 1 584 LEU CB 43.730 . 1 B 584 LEU CB 1 294 1 584 LEU H 9.650 . 1 B 584 LEU H 1 295 1 584 LEU N 133.000 . 1 B 584 LEU N 1 296 1 585 ASP C 177.620 . 1 B 585 ASP C 1 297 1 585 ASP CA 52.120 . 1 B 585 ASP CA 1 298 1 585 ASP CB 40.730 . 1 B 585 ASP CB 1 299 1 585 ASP H 9.070 . 1 B 585 ASP H 1 300 1 585 ASP N 127.950 . 1 B 585 ASP N 1 301 1 586 THR C 175.600 . 1 B 586 THR C 1 302 1 586 THR CA 64.370 . 1 B 586 THR CA 1 303 1 586 THR CB 68.530 . 1 B 586 THR CB 1 304 1 586 THR H 7.930 . 1 B 586 THR H 1 305 1 586 THR N 113.770 . 1 B 586 THR N 1 306 1 587 MET C 177.850 . 1 B 587 MET C 1 307 1 587 MET CA 55.870 . 1 B 587 MET CA 1 308 1 587 MET CB 32.160 . 1 B 587 MET CB 1 309 1 587 MET H 8.570 . 1 B 587 MET H 1 310 1 587 MET N 120.640 . 1 B 587 MET N 1 311 1 588 ASN C 174.030 . 1 B 588 ASN C 1 312 1 588 ASN CA 51.890 . 1 B 588 ASN CA 1 313 1 588 ASN CB 38.630 . 1 B 588 ASN CB 1 314 1 588 ASN H 7.330 . 1 B 588 ASN H 1 315 1 588 ASN N 115.470 . 1 B 588 ASN N 1 316 1 589 ASP C 173.950 . 1 B 589 ASP C 1 317 1 589 ASP CA 55.200 . 1 B 589 ASP CA 1 318 1 589 ASP CB 38.690 . 1 B 589 ASP CB 1 319 1 589 ASP H 7.610 . 1 B 589 ASP H 1 320 1 589 ASP N 118.160 . 1 B 589 ASP N 1 321 1 590 SER C 172.330 . 1 B 590 SER C 1 322 1 590 SER CA 56.280 . 1 B 590 SER CA 1 323 1 590 SER CB 66.120 . 1 B 590 SER CB 1 324 1 590 SER H 8.100 . 1 B 590 SER H 1 325 1 590 SER N 111.880 . 1 B 590 SER N 1 326 1 591 LEU CA 53.570 . 1 B 591 LEU CA 1 327 1 591 LEU CB 43.980 . 1 B 591 LEU CB 1 328 1 591 LEU H 8.520 . 1 B 591 LEU H 1 329 1 591 LEU N 126.820 . 1 B 591 LEU N 1 330 1 592 SER H 8.620 . 1 B 592 SER H 1 331 1 592 SER N 120.420 . 1 B 592 SER N 1 stop_ save_
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