NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type
145136 2k2i cing 1-original 5 DISCOVER dihedral angle


#NMR_dihedral
!
!phi angles
!
!helix E
!
1:ASP-_101:C       1:THR_102:N        1:THR_102:CA       1:THR_102:C        -80.000 -40.000 50.00 50.00 500.000
1:THR_102:C        1:LYS+_103:N       1:LYS+_103:CA      1:LYS+_103:C       -80.000 -40.000 50.00 50.00 500.000
1:LYS+_103:C       1:GLU-_104:N       1:GLU-_104:CA      1:GLU-_104:C       -80.000 -40.000 50.00 50.00 500.000
1:GLU-_104:C       1:GLU-_105:N       1:GLU-_105:CA      1:GLU-_105:C       -80.000 -40.000 50.00 50.00 500.000
1:GLU-_105:C       1:ILE_106:N        1:ILE_106:CA       1:ILE_106:C        -80.000 -40.000 50.00 50.00 500.000
1:ILE_106:C        1:LEU_107:N        1:LEU_107:CA       1:LEU_107:C        -80.000 -40.000 50.00 50.00 500.000
1:LEU_107:C        1:LYS+_108:N       1:LYS+_108:CA      1:LYS+_108:C       -80.000 -40.000 50.00 50.00 500.000
1:LYS+_108:C       1:ALA_109:N        1:ALA_109:CA       1:ALA_109:C        -80.000 -40.000 50.00 50.00 500.000
1:ALA_109:C        1:PHE_110:N        1:PHE_110:CA       1:PHE_110:C        -80.000 -40.000 50.00 50.00 500.000
1:PHE_110:C        1:LYS+_111:N       1:LYS+_111:CA      1:LYS+_111:C       -80.000 -40.000 50.00 50.00 500.000
1:LYS+_111:C       1:LEU_112:N        1:LEU_112:CA       1:LEU_112:C        -80.000 -40.000 50.00 50.00 500.000
1:LEU_112:C        1:PHE_113:N        1:PHE_113:CA       1:PHE_113:C        -80.000 -40.000 50.00 50.00 500.000
!
!helix F
!
1:PHE_123:C        1:LYS+_124:N       1:LYS+_124:CA      1:LYS+_124:C       -80.000 -40.000 50.00 50.00 500.000
1:LYS+_124:C       1:ASN_125:N        1:ASN_125:CA       1:ASN_125:C        -80.000 -40.000 50.00 50.00 500.000
1:ASN_125:C        1:LEU_126:N        1:LEU_126:CA       1:LEU_126:C        -80.000 -40.000 50.00 50.00 500.000
1:LEU_126:C        1:LYS+_127:N       1:LYS+_127:CA      1:LYS+_127:C       -80.000 -40.000 50.00 50.00 500.000
1:LYS+_127:C       1:ARG+_128:N       1:ARG+_128:CA      1:ARG+_128:C       -80.000 -40.000 50.00 50.00 500.000
1:ARG+_128:C       1:VAL_129:N        1:VAL_129:CA       1:VAL_129:C        -80.000 -40.000 50.00 50.00 500.000
1:VAL_129:C        1:ALA_130:N        1:ALA_130:CA       1:ALA_130:C        -80.000 -40.000 50.00 50.00 500.000
1:ALA_130:C        1:LYS+_131:N       1:LYS+_131:CA      1:LYS+_131:C       -80.000 -40.000 50.00 50.00 500.000
1:LYS+_131:C       1:GLU-_132:N       1:GLU-_132:CA      1:GLU-_132:C       -80.000 -40.000 50.00 50.00 500.000
!
!helix G
!
1:ASP-_139:C       1:GLU-_140:N       1:GLU-_140:CA      1:GLU-_140:C       -80.000 -40.000 50.00 50.00 500.000
1:GLU-_140:C       1:GLU-_141:N       1:GLU-_141:CA      1:GLU-_141:C       -80.000 -40.000 50.00 50.00 500.000
1:GLU-_141:C       1:LEU_142:N        1:LEU_142:CA       1:LEU_142:C        -80.000 -40.000 50.00 50.00 500.000
1:LEU_142:C        1:GLN_143:N        1:GLN_143:CA       1:GLN_143:C        -80.000 -40.000 50.00 50.00 500.000
1:GLN_143:C        1:GLU-_144:N       1:GLU-_144:CA      1:GLU-_144:C       -80.000 -40.000 50.00 50.00 500.000
1:GLU-_144:C       1:MET_145:N        1:MET_145:CA       1:MET_145:C        -80.000 -40.000 50.00 50.00 500.000
1:MET_145:C        1:ILE_146:N        1:ILE_146:CA       1:ILE_146:C        -80.000 -40.000 50.00 50.00 500.000
1:ILE_146:C        1:ASP-_147:N       1:ASP-_147:CA      1:ASP-_147:C       -80.000 -40.000 50.00 50.00 500.000
1:ASP-_147:C       1:GLU-_148:N       1:GLU-_148:CA      1:GLU-_148:C       -80.000 -40.000 50.00 50.00 500.000
1:GLU-_148:C       1:ALA_149:N        1:ALA_149:CA       1:ALA_149:C        -80.000 -40.000 50.00 50.00 500.000
!
!helix H
!
1:GLU-_159:C       1:GLN_160:N        1:GLN_160:CA       1:GLN_160:C        -80.000 -40.000 50.00 50.00 500.000
1:GLN_160:C        1:GLU-_161:N       1:GLU-_161:CA      1:GLU-_161:C       -80.000 -40.000 50.00 50.00 500.000
1:GLU-_161:C       1:PHE_162:N        1:PHE_162:CA       1:PHE_162:C        -80.000 -40.000 50.00 50.00 500.000
1:PHE_162:C        1:LEU_163:N        1:LEU_163:CA       1:LEU_163:C        -80.000 -40.000 50.00 50.00 500.000
1:LEU_163:C        1:ARG+_164:N       1:ARG+_164:CA      1:ARG+_164:C       -80.000 -40.000 50.00 50.00 500.000
1:ARG+_164:C       1:ILE_165:N        1:ILE_165:CA       1:ILE_165:C        -80.000 -40.000 50.00 50.00 500.000
1:ILE_165:C        1:MET_166:N        1:MET_166:CA       1:MET_166:C        -80.000 -40.000 50.00 50.00 500.000
1:MET_166:C        1:LYS+_167:N       1:LYS+_167:CA      1:LYS+_167:C       -80.000 -40.000 50.00 50.00 500.000
1:LYS+_167:C       1:LYS+_168:N       1:LYS+_168:CA      1:LYS+_168:C       -80.000 -40.000 50.00 50.00 500.000
!
!helix hsSfi1R17
!      
1:LEU_651:C        1:HIS_652:N        1:HIS_652:CA       1:HIS_652:C        -80.000 -40.000 50.00 50.00 500.000
1:HIS_652:C        1:ARG+_653:N       1:ARG+_653:CA      1:ARG+_653:C       -80.000 -40.000 50.00 50.00 500.000
1:ARG+_653:C        1:ALA_654:N       1:ALA_654:CA       1:ALA_654:C        -80.000 -40.000 50.00 50.00 500.000
1:ALA_654:C        1:LEU_655:N        1:LEU_655:CA       1:LEU_655:C        -80.000 -40.000 50.00 50.00 500.000
1:LEU_655:C        1:GLN_656:N        1:GLN_656:CA       1:GLN_656:C        -80.000 -40.000 50.00 50.00 500.000
1:GLN_656:C        1:ALA_657:N        1:ALA_657:CA       1:ALA_657:C        -80.000 -40.000 50.00 50.00 500.000
1:ALA_657:C        1:TRP_658:N        1:TRP_658:CA       1:TRP_658:C        -80.000 -40.000 50.00 50.00 500.000
1:TRP_658:C        1:VAL_659:N        1:VAL_659:CA       1:VAL_659:C        -80.000 -40.000 50.00 50.00 500.000
1:VAL_659:C        1:THRC_660:N       1:THRC_660:CA      1:THRC_660:C       -80.000 -40.000 50.00 50.00 500.000
!
!psi angle
!
!helix E
!
1:ASP-_101:N       1:ASP-_101:CA      1:ASP-_101:C       1:THR_102:N        -60.000 -20.000 50.00 50.00 500.000
1:THR_102:N        1:THR_102:CA       1:THR_102:C        1:LYS+_103:N       -60.000 -20.000 50.00 50.00 500.000
1:LYS+_103:N       1:LYS+_103:CA      1:LYS+_103:C       1:GLU-_104:N       -60.000 -20.000 50.00 50.00 500.000
1:GLU-_104:N       1:GLU-_104:CA      1:GLU-_104:C       1:GLU-_105:N       -60.000 -20.000 50.00 50.00 500.000
1:GLU-_105:N       1:GLU-_105:CA      1:GLU-_105:C       1:ILE_106:N        -60.000 -20.000 50.00 50.00 500.000
1:ILE_106:N        1:ILE_106:CA       1:ILE_106:C        1:LEU_107:N        -60.000 -20.000 50.00 50.00 500.000
1:LEU_107:N        1:LEU_107:CA       1:LEU_107:C        1:LYS+_108:N       -60.000 -20.000 50.00 50.00 500.000
1:LYS+_108:N       1:LYS+_108:CA      1:LYS+_108:C       1:ALA_109:N        -60.000 -20.000 50.00 50.00 500.000
1:ALA_109:N        1:ALA_109:CA       1:ALA_109:C        1:PHE_110:N        -60.000 -20.000 50.00 50.00 500.000
1:PHE_110:N        1:PHE_110:CA       1:PHE_110:C        1:LYS+_111:N       -60.000 -20.000 50.00 50.00 500.000
1:LYS+_111:N       1:LYS+_111:CA      1:LYS+_111:C       1:LEU_112:N        -60.000 -20.000 50.00 50.00 500.000
1:LEU_112:N        1:LEU_112:CA       1:LEU_112:C        1:PHE_113:N        -60.000 -20.000 50.00 50.00 500.000
1:PHE_113:N        1:PHE_113:CA       1:PHE_113:C        1:ASP-_114:N       -60.000 -20.000 50.00 50.00 500.000
!
!helix F
!
1:PHE_123:N        1:PHE_123:CA       1:PHE_123:C        1:LYS+_124:N       -60.000 -20.000 50.00 50.00 500.000
1:LYS+_124:N       1:LYS+_124:CA      1:LYS+_124:C       1:ASN_125:N        -60.000 -20.000 50.00 50.00 500.000
1:ASN_125:N        1:ASN_125:CA       1:ASN_125:C        1:LEU_126:N        -60.000 -20.000 50.00 50.00 500.000
1:LEU_126:N        1:LEU_126:CA       1:LEU_126:C        1:LYS+_127:N       -60.000 -20.000 50.00 50.00 500.000
1:LYS+_127:N       1:LYS+_127:CA      1:LYS+_127:C       1:ARG+_128:N       -60.000 -20.000 50.00 50.00 500.000
1:ARG+_128:N       1:ARG+_128:CA      1:ARG+_128:C       1:VAL_129:N        -60.000 -20.000 50.00 50.00 500.000
1:VAL_129:N        1:VAL_129:CA       1:VAL_129:C        1:ALA_130:N        -60.000 -20.000 50.00 50.00 500.000
1:ALA_130:N        1:ALA_130:CA       1:ALA_130:C        1:LYS+_131:N       -60.000 -20.000 50.00 50.00 500.000
1:LYS+_131:N       1:LYS+_131:CA      1:LYS+_131:C       1:GLU-_132:N       -60.000 -20.000 50.00 50.00 500.000
1:GLU-_132:N       1:GLU-_132:CA      1:GLU-_132:C       1:LEU_133:N        -60.000 -20.000 50.00 50.00 500.000
!
!helix G
!
1:ASP-_139:N       1:ASP-_139:CA      1:ASP-_139:C       1:GLU-_140:N       -60.000 -20.000 50.00 50.00 500.000
1:GLU-_140:N       1:GLU-_140:CA      1:GLU-_140:C       1:GLU-_141:N       -60.000 -20.000 50.00 50.00 500.000
1:GLU-_141:N       1:GLU-_141:CA      1:GLU-_141:C       1:LEU_142:N        -60.000 -20.000 50.00 50.00 500.000
1:LEU_142:N        1:LEU_142:CA       1:LEU_142:C        1:GLN_143:N        -60.000 -20.000 50.00 50.00 500.000
1:GLN_143:N        1:GLN_143:CA       1:GLN_143:C        1:GLU-_144:N       -60.000 -20.000 50.00 50.00 500.000
1:GLU-_144:N       1:GLU-_144:CA      1:GLU-_144:C       1:MET_145:N        -60.000 -20.000 50.00 50.00 500.000
1:MET_145:N        1:MET_145:CA       1:MET_145:C        1:ILE_146:N        -60.000 -20.000 50.00 50.00 500.000
1:ILE_146:N        1:ILE_146:CA       1:ILE_146:C        1:ASP-_147:N       -60.000 -20.000 50.00 50.00 500.000
1:ASP-_147:N       1:ASP-_147:CA      1:ASP-_147:C       1:GLU-_148:N       -60.000 -20.000 50.00 50.00 500.000
1:GLU-_148:N       1:GLU-_148:CA      1:GLU-_148:C       1:ALA_149:N        -60.000 -20.000 50.00 50.00 500.000
1:ALA_149:N        1:ALA_149:CA       1:ALA_149:C        1:ASP-_150:N       -60.000 -20.000 50.00 50.00 500.000
!
!helix H
!
1:GLU-_159:N       1:GLU-_159:CA      1:GLU-_159:C       1:GLN_160:N        -60.000 -20.000 50.00 50.00 500.000
1:GLN_160:N        1:GLN_160:CA       1:GLN_160:C        1:GLU-_161:N       -60.000 -20.000 50.00 50.00 500.000
1:GLU-_161:N       1:GLU-_161:CA      1:GLU-_161:C       1:PHE_162:N        -60.000 -20.000 50.00 50.00 500.000
1:PHE_162:N        1:PHE_162:CA       1:PHE_162:C        1:LEU_163:N        -60.000 -20.000 50.00 50.00 500.000
1:LEU_163:N        1:LEU_163:CA       1:LEU_163:C        1:ARG+_164:N       -60.000 -20.000 50.00 50.00 500.000
1:ARG+_164:N       1:ARG+_164:CA      1:ARG+_164:C       1:ILE_165:N        -60.000 -20.000 50.00 50.00 500.000
1:ILE_165:N        1:ILE_165:CA       1:ILE_165:C        1:MET_166:N        -60.000 -20.000 50.00 50.00 500.000
1:MET_166:N        1:MET_166:CA       1:MET_166:C        1:LYS+_167:N       -60.000 -20.000 50.00 50.00 500.000
1:LYS+_167:N       1:LYS+_167:CA      1:LYS+_167:C       1:LYS+_168:N       -60.000 -20.000 50.00 50.00 500.000
1:LYS+_168:N       1:LYS+_168:CA      1:LYS+_168:C       1:THR_169:N        -60.000 -20.000 50.00 50.00 500.000
!
!helix hsSfi1R17
!      
1:LEU_651:N        1:LEU_651:CA       1:LEU_651:C        1:HIS_652:N        -60.000 -20.000 50.00 50.00 500.000
1:HIS_652:N        1:HIS_652:CA       1:HIS_652:C        1:ARG+_653:N       -60.000 -20.000 50.00 50.00 500.000
1:ARG+_653:N       1:ARG+_653:CA      1:ARG+_653:C       1:ALA_654:N        -60.000 -20.000 50.00 50.00 500.000
1:ALA_654:N        1:ALA_654:CA       1:ALA_654:C        1:LEU_655:N        -60.000 -20.000 50.00 50.00 500.000
1:LEU_655:N        1:LEU_655:CA       1:LEU_655:C        1:GLN_656:N        -60.000 -20.000 50.00 50.00 500.000
1:GLN_656:N        1:GLN_656:CA       1:GLN_656:C        1:ALA_657:N        -60.000 -20.000 50.00 50.00 500.000
1:ALA_657:N        1:ALA_657:CA       1:ALA_657:C        1:TRP_658:N        -60.000 -20.000 50.00 50.00 500.000
1:TRP_658:N        1:TRP_658:CA       1:TRP_658:C        1:VAL_659:N        -60.000 -20.000 50.00 50.00 500.000
1:VAL_659:N        1:VAL_659:CA       1:VAL_659:C        1:THRC_660:N       -60.000 -20.000 50.00 50.00 500.000
!
!b-sheet
!
!angle phi
!
1:GLY_119:C        1:LYS+_120:N       1:LYS+_120:CA      1:LYS+_120:C       -160.000 -100.000 50.00 50.00 500.000
1:LYS+_120:C       1:ILE_121:N        1:ILE_121:CA       1:ILE_121:C        -160.000 -100.000 50.00 50.00 500.000
1:ILE_121:C        1:SER_122:N        1:SER_122:CA       1:SER_122:C        -160.000 -100.000 50.00 50.00 500.000
1:GLY_155:C        1:GLU-_156:N       1:GLU-_156:CA      1:GLU-_156:C       -160.000 -100.000 50.00 50.00 500.000
1:GLU-_156:C       1:VAL_157:N        1:VAL_157:CA       1:VAL_157:C        -160.000 -100.000 50.00 50.00 500.000
1:VAL_157:C        1:SER_158:N        1:SER_158:CA       1:SER_158:C        -160.000 -100.000 50.00 50.00 500.000
!
!angle psi
!
1:LYS+_120:N       1:LYS+_120:CA      1:LYS+_120:C       1:ILE_121:N        110.000 180.000 50.00 50.00 500.000
1:ILE_121:N        1:ILE_121:CA       1:ILE_121:C        1:SER_122:N        110.000 180.000 50.00 50.00 500.000
1:SER_122:N        1:SER_122:CA       1:SER_122:C        1:PHE_123:N        110.000 180.000 50.00 50.00 500.000
1:GLU-_156:N       1:GLU-_156:CA      1:GLU-_156:C       1:VAL_157:N        110.000 180.000 50.00 50.00 500.000
1:VAL_157:N        1:VAL_157:CA       1:VAL_157:C        1:SER_158:N        110.000 180.000 50.00 50.00 500.000
1:SER_158:N        1:SER_158:CA       1:SER_158:C        1:GLU-_159:N       110.000 180.000 50.00 50.00 500.000
!
!calcium loop III
!
1:ASP-_114:C       1:ASP-_115:N       1:ASP-_115:CA      1:ASP-_115:C       -80.000 -40.000 100.00 100.00 500.000
1:ASP-_115:N       1:ASP-_115:CA      1:ASP-_115:C       1:ASP-_116:N       -50.000 -10.000 100.00 100.00 500.000
1:SER_122:C        1:PHE_123:N        1:PHE_123:CA       1:PHE_123:C        -80.000 -40.000 100.00 100.00 500.000
!
!calcium loop IV
!
1:ASP-_150:C       1:ARG+_151:N       1:ARG+_151:CA      1:ARG+_151:C       -80.000 -40.000 100.00 100.00 500.000
1:ARG+_151:N       1:ARG+_151:CA      1:ARG+_151:C       1:ASP-_152:N       -50.000 -10.000 100.00 100.00 500.000
1:SER_158:C        1:GLU-_159:N       1:GLU-_159:CA      1:GLU-_159:C       -80.000 -40.000 100.00 100.00 500.000
!


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