NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type subtype subsubtype
16450 2a51 cing 1-original 1 DISCOVER distance NOE simple



! intra residue NOEs
!
1:THR_2:HN 1:THR_2:HA 1.8 3.5 
1:THR_2:HN 1:THR_2:HB 1.8 3.5 
1:THR_2:HN 1:THR_2:HG2* 1.8 4.5 
!
1:CYS_3:HN 1:CYS_3:HA 1.8 3.0 
1:CYS_3:HN 1:CYS_3:HB1 1.8 2.5 
1:CYS_3:HN 1:CYS_3:HB2 1.8 2.5 
!
1:PHE_4:HN 1:PHE_4:HA 1.8 3.0 
1:PHE_4:HN 1:PHE_4:HB1 1.8 3.5 
1:PHE_4:HN 1:PHE_4:HB2 1.8 3.0 
!
1:ASN_5:HA      1:ASN_5:HN      1.8     3.0
1:ASN_5:HN 1:ASN_5:HB1 1.8 3.5 
1:ASN_5:HN 1:ASN_5:HB2 1.8 3.5 
!
1:CYS_6:HN 1:CYS_6:HA 1.8 3.0 
1:CYS_6:HN 1:CYS_6:HB1 1.8 3.5 
1:CYS_6:HN 1:CYS_6:HB2 1.8 3.5 
!
1:GLY_7:HN 1:GLY_7:HA1 1.8 2.5 
1:GLY_7:HN 1:GLY_7:HA2 1.8 3.0 
!
1:LYS_8:HN 1:LYS_8:HA 1.8 3.0 
1:LYS_8:HN 1:LYS_8:HB1 1.8 3.0 
1:LYS_8:HN 1:LYS_8:HB2 1.8 3.5 
1:LYS_8:HN 1:LYS_8:HG1 1.8 4.0 
1:LYS_8:HN 1:LYS_8:HG2 1.8 4.0 
!
1:GLY_10:HN 1:GLY_10:HA1 1.8 2.5 
1:GLY_10:HN 1:GLY_10:HA2 1.8 3.0 
!
1:HISD_11:HN 1:HISD_11:HA 1.8 3.0 
1:HISD_11:HN 1:HISD_11:HB1 1.8 4.0 
1:HISD_11:HN 1:HISD_11:HB2 1.8 4.0 
1:HISD_11:HB1 1:HISD_11:HD2 1.8 4.0 
1:HISD_11:HB2 1:HISD_11:HD2 1.8 3.5 
!
1:THR_12:HN 1:THR_12:HA 1.8 3.5 
1:THR_12:HN 1:THR_12:HB 1.8 3.5 
1:THR_12:HN 1:THR_12:HG2* 1.8 5.0 
!
1:ALA_13:HN 1:ALA_13:HA 1.8 3.0 
1:ALA_13:HN 1:ALA_13:HB* 1.8 3.5 
!
1:ARG_14:HN 1:ARG_14:HA 1.8 3.0 
1:ARG_14:HN 1:ARG_14:HB1 1.8 2.5 
1:ARG_14:HN 1:ARG_14:HB2 1.8 2.5 
1:ARG_14:HN 1:ARG_14:HG* 1.8 4.5 
!
1:MET_15:HN 1:MET_15:HA 1.8 3.0 
1:MET_15:HN 1:MET_15:HB1 1.8 3.5 
1:MET_15:HN 1:MET_15:HB2 1.8 3.5 
1:MET_15:HN 1:MET_15:HG1 1.8 3.5 
1:MET_15:HN 1:MET_15:HG2 1.8 3.0 
!
1:CYS_16:HN 1:CYS_16:HA 1.8 3.0 
1:CYS_16:HN 1:CYS_16:HB1 1.8 2.5 
1:CYS_16:HN 1:CYS_16:HB2 1.8 3.0 
!
1:ARG_17:HN 1:ARG_17:HA 1.8 3.5 
1:ARG_17:HN 1:ARG_17:HB1 1.8 3.0 
1:ARG_17:HN 1:ARG_17:HB2 1.8 3.0 
1:ARG_17:HN 1:ARG_17:HG* 1.8 4.5 
!
1:GLN_18:HN 1:GLN_18:HA 1.8 3.0 
1:GLN_18:HN 1:GLN_18:HB1 1.8 3.5 
1:GLN_18:HN 1:GLN_18:HB2 1.8 3.0 
1:GLN_18:HN 1:GLN_18:HG* 1.8 4.0 
!
1:ARG_20:HN 1:ARG_20:HA 1.8 3.0 
1:ARG_20:HN 1:ARG_20:HB* 1.8 3.5 
1:ARG_20:HN 1:ARG_20:HG1 1.8 3.5 
1:ARG_20:HN 1:ARG_20:HG2 1.8 4.0 
!
1:GLN_21:HN 1:GLN_21:HA 1.8 3.0 
1:GLN_21:HN 1:GLN_21:HB1 1.8 3.0 
1:GLN_21:HN 1:GLN_21:HB2 1.8 2.5 
1:GLN_21:HN 1:GLN_21:HG* 1.8 4.5 
!
1:GLUN_22:HN 1:GLUN_22:HA 1.8 3.0 
1:GLUN_22:HN 1:GLUN_22:HB1 1.8 3.5 
1:GLUN_22:HN 1:GLUN_22:HB2 1.8 3.0 
1:GLUN_22:HN 1:GLUN_22:HG1 1.8 3.5 
1:GLUN_22:HN 1:GLUN_22:HG2 1.8 3.5 
!
1:GLY_23:HN 1:GLY_23:HA* 1.8 3.5 
!
1:CYS_24:HN 1:CYS_24:HA 1.8 3.0 
1:CYS_24:HN 1:CYS_24:HB1 1.8 3.0 
1:CYS_24:HN 1:CYS_24:HB2 1.8 3.0 
!
1:TRP_25:HN 1:TRP_25:HB1 1.8 3.5 
1:TRP_25:HN 1:TRP_25:HB2 1.8 3.5 
1:TRP_25:HN 1:TRP_25:HA 1.8 3.0 
1:TRP_25:HB1 1:TRP_25:HE3 1.8 4.0 
1:TRP_25:HB2 1:TRP_25:HE3 1.8 4.0 
1:TRP_25:HB1 1:TRP_25:HD1 1.8 3.5 
1:TRP_25:HB2 1:TRP_25:HD1 1.8 3.5 
!
1:ASN_26:HN 1:ASN_26:HA 1.8 3.0 
1:ASN_26:HN 1:ASN_26:HB1 1.8 3.0 
1:ASN_26:HN 1:ASN_26:HB2 1.8 3.0 
!
1:CYS_27:HN 1:CYS_27:HA 1.8 3.0 
1:CYS_27:HN 1:CYS_27:HB1 1.8 3.5 
1:CYS_27:HN 1:CYS_27:HB2 1.8 3.5 
!
1:GLY_28:HN 1:GLY_28:HA1 1.8 2.5 
1:GLY_28:HN 1:GLY_28:HA2 1.8 3.0 
!
1:SER_29:HN 1:SER_29:HA 1.8 3.0 
1:SER_29:HN 1:SER_29:HB1 1.8 3.0 
1:SER_29:HN 1:SER_29:HB2 1.8 3.0 
!
1:LYS_30:HN 1:LYS_30:HA 1.8 3.0 
1:LYS_30:HN 1:LYS_30:HB1 1.8 3.5 
1:LYS_30:HN 1:LYS_30:HB2 1.8 3.0 
1:LYS_30:HN 1:LYS_30:HG* 1.8 4.0 
!
1:GLUN_31:HN 1:GLUN_31:HA 1.8 3.0 
1:GLUN_31:HN 1:GLUN_31:HB1 1.8 3.5 
1:GLUN_31:HN 1:GLUN_31:HB2 1.8 3.0 
1:GLUN_31:HN 1:GLUN_31:HG1 1.8 3.0 
1:GLUN_31:HN 1:GLUN_31:HG2 1.8 3.5 
!
1:HISD_32:HN 1:HISD_32:HA 1.8 3.0 
!
1:ARG_33:HN 1:ARG_33:HA 1.8 3.5 
1:ARG_33:HN 1:ARG_33:HB1 1.8 3.5 
1:ARG_33:HN 1:ARG_33:HB2 1.8 3.5 
1:ARG_33:HN 1:ARG_33:HG1 1.8 3.5 
1:ARG_33:HN 1:ARG_33:HG2 1.8 4.0 
!
1:PHE_34:HN 1:PHE_34:HA 1.8 3.0 
1:PHE_34:HN 1:PHE_34:HB1 1.8 3.0 
1:PHE_34:HN 1:PHE_34:HB2 1.8 3.0 
1:PHE_34:HA 1:PHE_34:HD* 1.8 4.5 
1:PHE_34:HB1 1:PHE_34:HD* 1.8 4.5 
1:PHE_34:HB2 1:PHE_34:HD* 1.8 4.5 
!
1:ALA_35:HN 1:ALA_35:HA 1.8 3.0 
1:ALA_35:HN 1:ALA_35:HB* 1.8 3.5 
!
1:GLN_36:HN 1:GLN_36:HA 1.8 3.0 
1:GLN_36:HN 1:GLN_36:HB1 1.8 3.5 
1:GLN_36:HN 1:GLN_36:HB2 1.8 3.5 
1:GLN_36:HN 1:GLN_36:HG1 1.8 3.5 
1:GLN_36:HN 1:GLN_36:HG2 1.8 3.0 
!
1:CYS_37:HN 1:CYS_37:HA 1.8 3.0 
1:CYS_37:HN 1:CYS_37:HB1 1.8 2.5 
1:CYS_37:HN 1:CYS_37:HB2 1.8 3.0 
!
1:LYSC_39:HN 1:LYSC_39:HA 1.8 3.0 
1:LYSC_39:HN 1:LYSC_39:HB1 1.8 3.5 
1:LYSC_39:HN 1:LYSC_39:HB2 1.8 3.0 
1:LYSC_39:HN 1:LYSC_39:HG1 1.8 4.5 
1:LYSC_39:HN 1:LYSC_39:HG2 1.8 4.0 
!
!  sequential NOEs
!
1:LEUN_1:HA     1:THR_2:HN      1.8     2.5
1:LEUN_1:HD*    1:THR_2:HN      1.8     6.6
!
1:THR_2:HN 1:CYS_3:HN 1.8 4.5 
1:THR_2:HA      1:CYS_3:HN      1.8     2.5
1:THR_2:HB 1:CYS_3:HN 1.8 4.0 
!
1:CYS_3:HN 1:PHE_4:HN 1.8 4.5 
1:CYS_3:HA      1:PHE_4:HN      1.8     2.5
1:CYS_3:HB1 1:PHE_4:HN 1.8 4.5 
1:CYS_3:HB2 1:PHE_4:HN 1.8 4.5 
!
1:PHE_4:HN 1:ASN_5:HN 1.8 3.0 
1:PHE_4:HA      1:ASN_5:HN      1.8     3.5
1:PHE_4:HB2 1:ASN_5:HN 1.8 4.5 
!
1:ASN_5:HN 1:CYS_6:HN 1.8 2.5 
1:ASN_5:HA      1:CYS_6:HN      1.8     4.0
1:ASN_5:HB1 1:CYS_6:HN 1.8 4.0 
1:ASN_5:HB2 1:CYS_6:HN 1.8 3.5 
1:ASN_5:HD22    1:CYS_6:HN      1.8     4.5
1:ASN_5:HD21    1:CYS_6:HN      1.8     4.5
!
1:CYS_6:HN 1:GLY_7:HN 1.8 2.5 
1:CYS_6:HA      1:GLY_7:HN      1.8     3.5
1:CYS_6:HB1 1:GLY_7:HN 1.8 4.5 
1:CYS_6:HB2 1:GLY_7:HN 1.8 4.5 
!
1:GLY_7:HN 1:LYS_8:HN 1.8 3.0 
1:GLY_7:HA1     1:LYS_8:HN      1.8     3.5
1:GLY_7:HA2     1:LYS_8:HN      1.8     3.5
!
1:LYS_8:HA      1:PRO_9:HD1     1.8     2.5
1:LYS_8:HA      1:PRO_9:HD2     1.8     2.5
!
1:PRO_9:HA 1:GLY_10:HN 1.8     2.5
1:PRO_9:HB1 1:GLY_10:HN 1.8 3.5 
1:PRO_9:HB2 1:GLY_10:HN 1.8 3.0 
!
1:GLY_10:HN 1:HISD_11:HN 1.8 2.5 
1:GLY_10:HA1 1:HISD_11:HN 1.8     3.5
1:GLY_10:HA2 1:HISD_11:HN  1.8     3.5
!
1:HISD_11:HN 1:THR_12:HN 1.8 4.5 
1:HISD_11:HA    1:THR_12:HN     1.8     2.5
1:HISD_11:HB1 1:THR_12:HN 1.8 3.5 
1:HISD_11:HB2 1:THR_12:HN 1.8 3.0 
1:HISD_11:HD2   1:THR_12:HN     1.8     4.0
!
1:THR_12:HN 1:ALA_13:HN 1.8 4.5 
1:THR_12:HA     1:ALA_13:HN     1.8     2.5
1:THR_12:HB 1:ALA_13:HN 1.8 4.0 
1:THR_12:HG2*   1:ALA_13:HN     1.8     4.0
!
1:ALA_13:HN 1:ARG_14:HN 1.8 3.0 
1:ALA_13:HA 1:ARG_14:HN 1.8     4.0 
1:ALA_13:HB* 1:ARG_14:HN 1.8 3.5 
!
1:ARG_14:HN 1:MET_15:HN 1.8 3.0 
1:ARG_14:HA 1:MET_15:HN 1.8     3.5
1:ARG_14:HB1 1:MET_15:HN 1.8 3.5 
1:ARG_14:HB2 1:MET_15:HN 1.8 3.5 
1:ARG_14:HG* 1:MET_15:HN 1.8     5.0 
!
1:MET_15:HN 1:CYS_16:HN 1.8 2.5 
1:MET_15:HA     1:CYS_16:HN     1.8     3.5
1:MET_15:HB1 1:CYS_16:HN 1.8 4.5 
1:MET_15:HB2 1:CYS_16:HN 1.8 3.5 
!
1:CYS_16:HN 1:ARG_17:HN 1.8 4.5 
1:CYS_16:HA 1:ARG_17:HN 1.8     2.5
1:CYS_16:HB1 1:ARG_17:HN 1.8 4.5 
1:CYS_16:HB2 1:ARG_17:HN 1.8 4.5 
!
1:ARG_17:HN 1:GLN_18:HN 1.8 2.5 
1:ARG_17:HA 1:GLN_18:HN 1.8     3.5
1:ARG_17:HB1 1:GLN_18:HN 1.8 4.0 
1:ARG_17:HB2 1:GLN_18:HN 1.8 4.0 
1:ARG_17:HG* 1:GLN_18:HN 1.8     4.5
!
1:GLN_18:HA     1:PRO_19:HD1    1.8     2.5
1:GLN_18:HA     1:PRO_19:HD2    1.8     2.5
!
1:PRO_19:HB1 1:ARG_20:HN 1.8 3.0 
1:PRO_19:HB2 1:ARG_20:HN 1.8 4.0 
1:GLN_18:HB1    1:PRO_19:HD1    1.8     4.0
1:GLN_18:HB2    1:PRO_19:HD1    1.8     4.0
1:GLN_18:HB1    1:PRO_19:HD2    1.8     4.0
1:GLN_18:HB2    1:PRO_19:HD2    1.8     4.5
1:GLN_18:HG*    1:PRO_19:HD1    1.8     4.5
1:GLN_18:HG*    1:PRO_19:HD2    1.8     5.0
1:GLN_18:HN     1:PRO_19:HD1    1.8     5.0
1:GLN_18:HN     1:PRO_19:HD2    1.8     5.0
!
1:PRO_19:HA 1:ARG_20:HN 1.8     2.5
!
1:ARG_20:HA 1:GLN_21:HN 1.8     2.5
1:ARG_20:HN 1:GLN_21:HN 1.8 4.5 
1:ARG_20:HB* 1:GLN_21:HN 1.8 4.0 
1:ARG_20:HG1 1:GLN_21:HN 1.8     4.0
1:ARG_20:HG2 1:GLN_21:HN 1.8     4.0
!
1:GLN_21:HN 1:GLUN_22:HN 1.8 4.5 
1:GLN_21:HB1 1:GLUN_22:HN 1.8 4.0 
1:GLN_21:HB2 1:GLUN_22:HN 1.8 4.0 
!
1:GLUN_22:HN 1:GLY_23:HN 1.8 3.0
1:GLUN_22:HA 1:GLY_23:HN 1.8     3.5 
1:GLUN_22:HB1 1:GLY_23:HN 1.8 3.5 
1:GLUN_22:HB2 1:GLY_23:HN 1.8 3.0 
!
1:GLY_23:HN 1:CYS_24:HN 1.8 4.0 
1:CYS_24:HN     1:GLY_23:HA*    1.8     3.5
!
1:CYS_24:HN 1:TRP_25:HN 1.8 4.5 
1:TRP_25:HN     1:CYS_24:HA     1.8     2.5
1:CYS_24:HB1 1:TRP_25:HN 1.8 4.5 
1:CYS_24:HB2 1:TRP_25:HN 1.8 4.5 
!
1:TRP_25:HN 1:ASN_26:HN 1.8 3.0 
1:TRP_25:HA     1:ASN_26:HN     1.8     3.5
1:TRP_25:HB1 1:ASN_26:HN 1.8 4.0 
1:TRP_25:HB2 1:ASN_26:HN 1.8 4.5 
1:TRP_25:HZ3    1:ASN_26:HA     1.8     3.5
1:TRP_25:HZ3    1:ASN_26:HB1    1.8     4.0
1:TRP_25:HZ3    1:ASN_26:HB2    1.8     4.5
!
1:ASN_26:HN 1:CYS_27:HN 1.8 2.5
1:ASN_26:HA 1:CYS_27:HN 1.8     4.0 
1:ASN_26:HB1 1:CYS_27:HN 1.8 4.0 
1:ASN_26:HB2 1:CYS_27:HN 1.8 3.5 
!
1:CYS_27:HN 1:GLY_28:HN 1.8 2.5 
1:CYS_27:HA 1:GLY_28:HN 1.8     3.5
1:CYS_27:HB1 1:GLY_28:HN 1.8 4.5 
1:CYS_27:HB2 1:GLY_28:HN 1.8 4.5 
!
1:GLY_28:HN 1:SER_29:HN 1.8 3.0 
1:GLY_28:HA1 1:SER_29:HN 1.8     3.5
1:GLY_28:HA2 1:SER_29:HN 1.8     3.5
!
1:SER_29:HN 1:LYS_30:HN 1.8 4.5 
1:SER_29:HA 1:LYS_30:HN 1.8     2.5
1:SER_29:HB1 1:LYS_30:HN 1.8 4.0 
1:SER_29:HB2 1:LYS_30:HN 1.8 4.0 
!
1:LYS_30:HN 1:GLUN_31:HN 1.8 2.5 
1:LYS_30:HA     1:GLUN_31:HN    1.8     3.5
1:LYS_30:HB1 1:GLUN_31:HN 1.8 4.0 
1:LYS_30:HB2 1:GLUN_31:HN 1.8 4.0 
!
1:GLUN_31:HN 1:HISD_32:HN 1.8 2.5 
1:GLUN_31:HA 1:HISD_32:HN 1.8     3.5
1:GLUN_31:HB1 1:HISD_32:HN 1.8 3.5 
1:GLUN_31:HB2 1:HISD_32:HN 1.8 3.5 
!
1:HISD_32:HN 1:ARG_33:HN 1.8 4.5 
1:HISD_32:HA    1:ARG_33:HN     1.8     2.5
1:HISD_32:HB1 1:ARG_33:HN 1.8 3.5 
1:HISD_32:HB2 1:ARG_33:HN 1.8 3.0 
1:HISD_32:HD2   1:ARG_33:HA     1.8     4.0
1:HISD_32:HD2   1:ARG_33:HN     1.8     3.5
!
1:ARG_33:HN 1:PHE_34:HN 1.8 4.5 
1:ARG_33:HA 1:PHE_34:HN 1.8     2.5
1:ARG_33:HB1 1:PHE_34:HN 1.8 3.0 
1:ARG_33:HB2 1:PHE_34:HN 1.8 3.5
1:ARG_33:HG2 1:PHE_34:HN 1.8     5.0 
!
1:PHE_34:HN 1:ALA_35:HN 1.8 3.0 
1:PHE_34:HA     1:ALA_35:HN     1.8     4.0
1:PHE_34:HB1 1:ALA_35:HN 1.8 4.0 
1:PHE_34:HB2 1:ALA_35:HN 1.8 4.5 
1:PHE_34:HD*    1:ALA_35:HA     1.8     5.5
1:PHE_34:HD*    1:ALA_35:HB*    1.8     6.5
!
1:ALA_35:HN 1:GLN_36:HN 1.8 3.0 
1:ALA_35:HA 1:GLN_36:HN 1.8     3.5
1:ALA_35:HB* 1:GLN_36:HN 1.8 4.0 
!
1:GLN_36:HN 1:CYS_37:HN 1.8 3.5
1:GLN_36:HA 1:CYS_37:HN 1.8     3.5 
1:GLN_36:HB1 1:CYS_37:HN 1.8 4.0 
1:GLN_36:HB2 1:CYS_37:HN 1.8 4.0 
!
1:CYS_37:HA     1:PRO_38:HD1    1.8     2.5
1:CYS_37:HA     1:PRO_38:HD2    1.8     2.5
!
1:PRO_38:HA 1:LYSC_39:HN 1.8     3.5
1:PRO_38:HB1 1:LYSC_39:HN 1.8 4.0 
1:PRO_38:HB2 1:LYSC_39:HN 1.8 4.0 
!
!  medium and long-range NOEs
!
1:LEUN_1:HD* 1:GLY_10:HN 1.8 5.9 
1:LEUN_1:HG 1:GLY_10:HN 1.8 3.5 
1:LEUN_1:HG 1:HISD_11:HN 1.8 3.5 
1:LEUN_1:HD* 1:HISD_11:HA 1.8 6.9 
1:LEUN_1:HD* 1:HISD_11:HN 1.8 5.9 
1:LEUN_1:HD* 1:THR_12:HN 1.8 5.9 
!
1:THR_2:HG2* 1:PHE_4:HE* 1.8 6.0 
1:THR_2:HG2* 1:PHE_4:HD* 1.8 6.0 
1:THR_2:HA      1:PRO_9:HA      1.8     2.5
1:THR_2:HA      1:GLY_10:HN     1.8     3.5
1:THR_2:HA      1:HISD_11:HN    1.8     3.5
1:THR_2:HG2* 1:TRP_25:HZ3 1.8 4.5 
1:THR_2:HG2* 1:TRP_25:HH2 1.8 4.5 
1:THR_2:HG2* 1:TRP_25:HZ2 1.8 5.0 
1:THR_2:HG2* 1:PHE_34:HE* 1.8 6.5 
1:THR_2:HG2* 1:PHE_34:HZ 1.8 6.0 
!
1:CYS_3:HA      1:ASN_5:HN      1.8     4.0
1:CYS_3:HB2 1:CYS_6:HN 1.8 4.0 
1:CYS_3:HB1 1:CYS_6:HN 1.8 4.5 
1:CYS_3:HA 1:GLY_7:HN 1.8 5.0 
1:CYS_3:HB1 1:GLY_7:HN 1.8 4.5 
1:CYS_3:HB2 1:GLY_7:HN 1.8 3.0 
1:CYS_3:HN 1:LYS_8:HN 1.8 4.5 
1:CYS_3:HB1 1:LYS_8:HN 1.8 3.5 
1:CYS_3:HB2 1:LYS_8:HN 1.8 3.0 
1:CYS_3:HB1 1:LYS_8:HB1 1.8 5.0 
1:CYS_3:HB2 1:LYS_8:HB1 1.8 5.0 
1:CYS_3:HB1 1:LYS_8:HB2 1.8 5.0 
1:CYS_3:HB2 1:LYS_8:HB2 1.8 5.0 
1:CYS_3:HN      1:PRO_9:HA      1.8     3.0
1:CYS_3:HN      1:HISD_11:HN    1.8     4.0
1:CYS_3:HA      1:HISD_11:HN    1.8     5.0
1:CYS_3:HB1 1:HISD_11:HD2 1.8 3.0 
1:CYS_3:HB2 1:HISD_11:HD2 1.8 4.5 
1:CYS_3:HA 1:HISD_11:HD2 1.8 5.0 
1:CYS_3:HN      1:THR_12:HA     1.8     4.0
1:CYS_3:HA 1:THR_12:HA 1.8 3.0 
1:CYS_3:HA 1:THR_12:HN 1.8 5.0 
1:CYS_3:HA 1:ALA_13:HN 1.8 3.0 
1:CYS_3:HA 1:PHE_4:HD* 1.8 6.5 
!
1:PHE_4:HA      1:GLY_7:HN      1.8     4.5
1:PHE_4:HD*     1:ALA_13:HB*    1.8     6.5
1:PHE_4:HN      1:ALA_13:HB*    1.8     4.0
1:PHE_4:HN 1:ALA_13:HN 1.8 3.0 
1:PHE_4:HD* 1:TRP_25:HZ2 1.8 5.5 
1:PHE_4:HE* 1:TRP_25:HZ2 1.8 6.0 
1:PHE_4:HA 1:TRP_25:HZ2 1.8 3.0 
1:PHE_4:HE* 1:TRP_25:HH2 1.8 6.0 
1:PHE_4:HD* 1:PHE_34:HD* 1.8 7.5 
1:PHE_4:HE* 1:PHE_34:HD* 1.8 8.0 
!
1:ASN_5:HN      1:GLY_7:HN      1.8     3.5
1:ASN_5:HA      1:GLY_7:HN      1.8     5.0
1:ASN_5:HN      1:ALA_13:HB*    1.8     4.5
1:ASN_5:HD22 1:CYS_16:HB1 1.8 4.5 
1:ASN_5:HD22 1:CYS_16:HB2 1.8 4.0 
1:ASN_5:HD22 1:GLN_18:HB1 1.8 5.0 
1:ASN_5:HD22 1:GLN_18:HB2 1.8 3.5 
1:ASN_5:HD21 1:GLN_18:HB2 1.8 3.5 
1:ASN_5:HD21 1:GLN_18:HB1 1.8 5.0 
1:ASN_5:HD22 1:GLN_18:HG* 1.8 5.5 
1:ASN_5:HD21 1:GLN_18:HG* 1.8 5.5 
1:ASN_5:HD21    1:ARG_20:HA     1.8     3.0
1:ASN_5:HD22    1:ARG_20:HA     1.8     4.0
!
1:CYS_6:HN      1:LYS_8:HN      1.8     4.0
1:CYS_6:HA      1:LYS_8:HN      1.8     5.0
1:CYS_6:HB1     1:LYS_8:HN      1.8     5.0
1:CYS_6:HB2     1:LYS_8:HN      1.8     5.0
1:CYS_6:HB1 1:GLN_18:HB1 1.8 4.5 
1:CYS_6:HB1 1:GLN_18:HB2 1.8 3.5 
1:CYS_6:HB2 1:GLN_18:HB1 1.8 4.5 
1:CYS_6:HB2 1:GLN_18:HB2 1.8 4.0 
!
1:GLY_7:HA1 1:TRP_25:HZ3 1.8 5.0 
1:GLY_7:HA2 1:TRP_25:HZ3 1.8 5.0 
!
1:LYS_8:HB1 1:HISD_11:HE1 1.8 3.0 
1:LYS_8:HB2 1:HISD_11:HE1 1.8 3.0 
!
1:PRO_9:HA      1:HISD_11:HN    1.8     3.5
!
1:HISD_11:HD2   1:ALA_13:HA     1.8     4.0
1:HISD_11:HD2   1:MET_15:HB1    1.8     4.5
1:HISD_11:HD2   1:MET_15:HB2    1.8     4.5
1:HISD_11:HD2 1:MET_15:HN 1.8 4.5 
1:HISD_11:HD2 1:CYS_16:HN 1.8 3.5 
1:HISD_11:HD2 1:CYS_16:HA 1.8 3.5 
1:HISD_11:HD2 1:CYS_16:HB1 1.8 3.0 
1:HISD_11:HD2 1:CYS_16:HB2 1.8 4.0 
!
1:THR_12:HA     1:ARG_14:HN     1.8     4.0
1:THR_12:HB     1:ARG_14:HN     1.8     4.0
1:THR_12:HG2* 1:ARG_14:HN 1.8 4.5 
!
1:ALA_13:HN     1:MET_15:HN     1.8     4.5
1:ALA_13:HA     1:MET_15:HN     1.8     4.0
1:ALA_13:HA 1:CYS_16:HB1 1.8 3.0 
1:ALA_13:HA 1:CYS_16:HB2 1.8 3.0 
1:ALA_13:HN 1:CYS_16:HN 1.8 5.0 
1:ALA_13:HA 1:CYS_16:HN 1.8 3.0 
!
1:ARG_14:HN 1:CYS_16:HN 1.8 4.0 
1:ARG_14:HA 1:CYS_16:HN 1.8     4.5 
!
1:CYS_16:HA 1:GLN_18:HN 1.8     4.0
1:CYS_16:HB1 1:GLN_18:HN 1.8     5.0
1:CYS_16:HB2 1:GLN_18:HN  1.8     4.5
!
1:GLN_21:HG* 1:TRP_25:HD1 1.8 4.5 
1:GLN_21:HB1 1:TRP_25:HD1 1.8 4.5 
1:GLN_21:HB2 1:TRP_25:HD1 1.8 4.5 
1:GLN_21:HA 1:GLUN_22:HN 1.8 2.5 
!
1:GLY_23:HA*    1:LYS_30:HA     1.8     3.5
1:GLY_23:HA*    1:GLUN_31:HN    1.8     6.0
1:GLY_23:HA* 1:HISD_32:HN 1.8 5.0 
!
1:CYS_24:HA     1:ASN_26:HN     1.8     4.0
1:CYS_24:HA     1:CYS_27:HN     1.8     5.0
1:CYS_24:HB1 1:CYS_27:HN 1.8     4.5
1:CYS_24:HB2 1:CYS_27:HN 1.8     3.5
1:CYS_24:HB1    1:GLY_28:HN     1.8     4.5
1:CYS_24:HB2    1:GLY_28:HN     1.8     3.0
1:CYS_24:HN 1:SER_29:HN 1.8 4.0 
1:CYS_24:HB1 1:SER_29:HN 1.8     3.5
1:CYS_24:HB2 1:SER_29:HN 1.8     3.0
1:CYS_24:HB1 1:SER_29:HB1 1.8 4.5 
1:CYS_24:HB2 1:SER_29:HB1 1.8 4.0 
1:CYS_24:HB1 1:SER_29:HB2 1.8 3.5 
1:CYS_24:HB2 1:SER_29:HB2 1.8 3.5 
1:CYS_24:HN     1:LYS_30:HA     1.8     3.5
1:CYS_24:HN     1:HISD_32:HN    1.8     4.5
1:CYS_24:HB1    1:HISD_32:HD2   1.8     3.0
1:CYS_24:HB2    1:HISD_32:HD2   1.8     4.5
1:CYS_24:HA 1:ARG_33:HA 1.8 3.0 
1:CYS_24:HA 1:PHE_34:HA 1.8 4.0 
1:CYS_24:HA 1:PHE_34:HN 1.8 3.0 
!
1:TRP_25:HN     1:CYS_27:HN     1.8     4.5
1:TRP_25:HA     1:CYS_27:HN     1.8     5.0
1:TRP_25:HA 1:GLY_28:HN 1.8     4.0
1:TRP_25:HN 1:PHE_34:HN 1.8 3.5 
1:TRP_25:HD1 1:PHE_34:HN 1.8 5.0 
1:TRP_25:HE1 1:PHE_34:HD* 1.8 5.5 
1:TRP_25:HD1 1:PHE_34:HB1 1.8 4.0 
1:TRP_25:HD1 1:PHE_34:HB2 1.8 4.0 
1:TRP_25:HE1 1:PHE_34:HB1 1.8 3.5 
1:TRP_25:HE1 1:PHE_34:HB2 1.8 3.5 
1:TRP_25:HZ2 1:PHE_34:HZ 1.8 4.5 
1:TRP_25:HZ2 1:PHE_34:HE* 1.8 6.0 
1:TRP_25:HZ2 1:PHE_34:HB1 1.8 5.0 
1:TRP_25:HZ2 1:PHE_34:HB2 1.8 5.0 
1:TRP_25:HN 1:PHE_34:HB1 1.8 3.5 
1:TRP_25:HN 1:PHE_34:HB2 1.8 4.0 
!
1:ASN_26:HN 1:GLY_28:HN 1.8 3.5 
1:ASN_26:HA     1:GLY_28:HN     1.8     5.0
1:ASN_26:HN 1:PHE_34:HD* 1.8 5.5 
1:ASN_26:HN 1:PHE_34:HB1 1.8 4.0 
1:ASN_26:HN 1:PHE_34:HB2 1.8 4.0 
1:ASN_26:HB1 1:PHE_34:HB1 1.8 5.0 
1:ASN_26:HB1 1:PHE_34:HB2 1.8 5.0 
1:ASN_26:HB2 1:PHE_34:HB2 1.8 5.0 
1:ASN_26:HB2 1:PHE_34:HB1 1.8 5.0 
1:ASN_26:HB1 1:PHE_34:HD* 1.8 6.5 
1:ASN_26:HB2 1:PHE_34:HD* 1.8 6.5 
1:ASN_26:HB2 1:PHE_34:HE* 1.8 6.0 
1:ASN_26:HB1 1:PHE_34:HE* 1.8 5.5 
1:ASN_26:HD22   1:CYS_37:HB1    1.8     4.0
1:ASN_26:HD22   1:CYS_37:HB2    1.8     3.5
1:ASN_26:HD21 1:LYSC_39:HB1 1.8 4.0 
1:ASN_26:HD21 1:LYSC_39:HB2 1.8 3.5 
1:ASN_26:HD22 1:LYSC_39:HB1 1.8 4.0 
1:ASN_26:HD22 1:LYSC_39:HB2 1.8 3.5 
!
1:CYS_27:HA 1:SER_29:HN 1.8     5.0
1:CYS_27:HB1 1:SER_29:HN 1.8 5.0 
1:CYS_27:HB2 1:SER_29:HN 1.8 5.0 
1:CYS_27:HB1 1:LYSC_39:HB1 1.8 4.5 
1:CYS_27:HB2 1:LYSC_39:HB1 1.8 4.5 
1:CYS_27:HB1 1:LYSC_39:HB2 1.8 4.0 
1:CYS_27:HB2 1:LYSC_39:HB2 1.8 4.0 
!
1:SER_29:HA 1:GLUN_31:HN  1.8     4.0
1:SER_29:HB2 1:HISD_32:HE1 1.8 3.0 
1:SER_29:HA 1:HISD_32:HE1 1.8 5.0 
1:SER_29:HB1 1:HISD_32:HE1 1.8 3.0 
!
1:LYS_30:HN     1:HISD_32:HN    1.8     4.5
1:LYS_30:HA 1:HISD_32:HN 1.8     4.5
!
1:HISD_32:HD2   1:PHE_34:HA     1.8     4.0
1:HISD_32:HD2   1:GLN_36:HN     1.8     4.5
1:HISD_32:HD2   1:GLN_36:HB1    1.8     4.0
1:HISD_32:HD2   1:GLN_36:HB2    1.8     4.0
1:HISD_32:HD2 1:CYS_37:HA 1.8 3.5 
1:HISD_32:HD2 1:CYS_37:HB1 1.8 3.5 
1:HISD_32:HD2 1:CYS_37:HB2 1.8 4.0 
1:HISD_32:HD2 1:CYS_37:HN 1.8 3.5 
!
1:ARG_33:HA     1:ALA_35:HN     1.8     4.5
1:ARG_33:HB1 1:ALA_35:HN 1.8     4.0
1:ARG_33:HB2 1:ALA_35:HN 1.8     3.5
1:ARG_33:HN 1:GLN_36:HN 1.8 4.0 
!
1:PHE_34:HN     1:GLN_36:HN     1.8     4.5
1:PHE_34:HA     1:GLN_36:HN     1.8     4.5
1:PHE_34:HN     1:CYS_37:HN     1.8     5.0
1:PHE_34:HA 1:CYS_37:HN 1.8     3.5
1:PHE_34:HA 1:CYS_37:HB1 1.8 3.0 
1:PHE_34:HA 1:CYS_37:HB2 1.8 3.0 
!
1:ALA_35:HN     1:CYS_37:HN     1.8     4.5
1:ALA_35:HA 1:CYS_37:HN 1.8 4.5 
!
1:CYS_37:HA 1:LYSC_39:HN 1.8     4.0
1:CYS_37:HB1 1:LYSC_39:HN 1.8     4.5
1:CYS_37:HB2 1:LYSC_39:HN 1.8     4.5
!


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