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
1572 1apq cing 1-original 3 DISCOVER distance NOE simple


!NOE distances used for structure calculations of C1r-EGF
!The following lines contain the NOE distance information
!Column 1 and 2 identify the two protons between which the NOE has been observed
!Column 3 gives the lower bound, -1.000 corresponds to the sum of the two van der Waals radii
!Column 4 gives the effective upper bound after correction for pseudoatoms
!Column 5 is the original upper bound as extracted from the NOESY spectrum.
!Columns 6 and 7 are the force constants in kcal/mol A2 for the lower and the upper bound, respectively.
!A value of 25 kcal/mol A2 has been used for the rMD refinement (see the original publication for more
!details on the force constants used).
!Column 8 corresponds to the maximum force.
#NOE_distance
1:VAL_24:HN     1:VAL_24:HA          -1.000     3.120     3.120     50.00     50.00     1000.00     0.00
1:VAL_24:HN     1:VAL_24:HG*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:ASX_25:HN     1:ASX_25:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:LEU_26:HN     1:ASX_25:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:LEU_26:HN     1:LEU_26:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:LEU_26:HN     1:LEU_26:HD2*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:LEU_26:HN     1:LEU_26:HD1*        -1.000     4.360     3.360     50.00     50.00     1000.00     0.00
1:ASX_27:HN     1:LEU_26:HA          -1.000     3.120     3.120     50.00     50.00     1000.00     0.00     
1:ASX_27:HN     1:LEU_26:HB*         -1.000     4.360     3.360     50.00     50.00     1000.00     0.00     
1:ASX_27:HN     1:ASX_27:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00     
1:ASX_27:HN     1:ALA_30:HB*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:ASX_27:HN     1:LEU_26:HD1*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:ASX_27:HN     1:LEU_26:HD2*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLX_28:HN     1:ASX_27:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:GLX_28:HN     1:ASX_27:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:GLX_28:HN     1:ASX_27:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:GLX_28:HN     1:LEU_26:HD1*        -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:GLX_28:HN     1:GLX_28:HG2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:CYS_29:HN     1:CYS_29:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:CYS_29:HN     1:GLX_28:HA          -1.000     3.800     3.360     50.00     50.00     1000.00     0.00
1:CYS_29:HN     1:ASX_27:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_29:HN     1:GLX_28:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_29:HN     1:ALA_30:HB*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:ALA_30:HN     1:ALA_30:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:ALA_30:HN     1:CYS_29:HA          -1.000     4.560     3.360     50.00     50.00     1000.00     0.00
1:ALA_30:HN     1:CYS_29:HB*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:SER_31:HN     1:ALA_30:HA          -1.000     3.800     3.360     50.00     50.00     1000.00     0.00
1:SER_31:HN     1:CYS_29:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:SER_31:HN     1:CYS_29:HB*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:SER_31:HN     1:ALA_30:HB*         -1.000     4.360     3.360     50.00     50.00     1000.00     0.00
1:ARX_32:HN     1:SER_31:HA          -1.000     3.800     3.360     50.00     50.00     1000.00     0.00
1:ARX_32:HN     1:ARX_32:HD*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_32:HN     1:SER_31:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ARX_32:HN     1:SER_31:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ARX_32:HN     1:ALA_30:HB*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:SER_33:HN     1:ARX_32:HA          -1.000     3.800     3.360     50.00     50.00     1000.00     0.00     
1:SER_33:HN     1:ARX_32:HB2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:SER_33:HN     1:ARX_32:HD*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00     
1:SER_33:HN     1:ARX_32:HB1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:LYX_34:HN     1:SER_33:HB*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00     
1:LYX_34:HN     1:SER_33:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:SER_35:HN     1:LYX_34:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00     
1:GLY_36:HN     1:SER_35:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00     
1:GLY_36:HN     1:SER_35:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:GLY_36:HN     1:SER_35:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:GLX_37:HN     1:GLY_36:HA*         -1.000     3.600     2.600     50.00     50.00     1000.00     0.00
1:GLX_37:HN     1:GLX_37:HG*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00     
1:GLX_38:HN     1:ASX_39:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLX_38:HN     1:GLX_38:HG*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00     
1:ASX_39:HN     1:GLX_38:HA          -1.000     2.600     3.360     50.00     50.00     1000.00     0.00     
1:ASX_39:HN     1:PRO_40:HD*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00     
1:ASX_39:HN     1:PRO_40:HB*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00     
1:ASX_39:HN     1:GLX_38:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:ASX_39:HN     1:GLX_38:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:GLN_41:HN     1:PRO_40:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00     
1:GLN_41:HN     1:PRO_42:HD1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:GLN_41:HN     1:PRO_42:HD2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:GLN_41:HE21   1:GLN_41:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:GLN_41:HE22   1:GLN_41:HB1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:GLN_43:HN     1:PRO_42:HA          -1.000     2.800     3.360     50.00     50.00     1000.00     0.00
1:GLN_43:HE21   1:GLN_43:HG*         -1.000     4.360     3.360     50.00     50.00     1000.00     0.00
1:GLN_43:HE22   1:GLN_43:HG*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_45:HN     1:HIS_70:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_45:HN     1:GLN_45:HG2         -1.000     3.800     3.360     50.00     50.00     1000.00     0.00
1:GLN_45:HE21   1:GLN_45:HB1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLN_45:HE21   1:GLN_45:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_45:HE21   1:GLN_45:HG1         -1.000     3.800     3.360     50.00     50.00     1000.00     0.00
1:GLN_45:HE21   1:GLN_45:HG2         -1.000     3.800     3.360     50.00     50.00     1000.00     0.00
1:GLN_45:HE22   1:GLN_45:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_46:HN     1:CYS_59:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:HIS_46:HN     1:GLN_45:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:HIS_46:HN     1:GLN_45:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:HIS_46:HN     1:GLN_45:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:HIS_46:HD2    1:CYS_59:HA          -1.000     7.000     7.000     50.00     50.00     1000.00     0.00     
1:HIS_46:HD2    1:HIS_46:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:HIS_46:HD2    1:SER_71:HA          -1.000     7.000     7.000     50.00     50.00     1000.00     0.00     
1:HIS_46:HD2    1:GLN_45:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:HIS_46:HD2    1:GLN_45:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_46:HD2    1:GLN_45:HG1         -1.000     4.200     4.560     50.00     50.00     1000.00     0.00     
1:HIS_46:HD2    1:GLN_45:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:HIS_46:HD2    1:GLN_45:HG2         -1.000     4.200     4.560     50.00     50.00     1000.00     0.00
1:HIS_46:HD2    1:CYS_72:HB2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:HIS_46:HD2    1:CYS_72:HB1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:LEU_47:HN     1:CYS_59:HA          -1.000     3.120     3.120     50.00     50.00     1000.00     0.00     
1:LEU_47:HN     1:HIS_46:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:LEU_47:HN     1:HIS_46:HB2         -1.000     3.120     3.120     50.00     50.00     1000.00     0.00     
1:LEU_47:HN     1:HIS_46:HB1         -1.000     3.120     3.120     50.00     50.00     1000.00     0.00     
1:LEU_47:HN     1:LEU_47:HG          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:CYS_48:HN     1:LEU_47:HA          -1.000     2.800     3.360     50.00     50.00     1000.00     0.00
1:CYS_48:HN     1:LEU_47:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_48:HN     1:LEU_47:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_48:HN     1:LEU_47:HD1*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_48:HN     1:CYS_48:HA          -1.000     3.000     3.000     50.00     50.00     1000.00     0.00
1:HIS_49:HN     1:CYS_48:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:HIS_49:HN     1:CYS_48:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_49:HN     1:CYS_48:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_49:HD2    1:HIS_49:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:HIS_49:HD2    1:HIS_49:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:HIS_49:HD2    1:SER_58:HB2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:HIS_49:HD2    1:SER_58:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:HIS_49:HD2    1:HIS_49:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:HIS_49:HD2    1:SER_58:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00     
1:HIS_49:HD2    1:CYS_57:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00  
1:HIS_49:HD2    1:CYS_48:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:ASN_50:HN     1:HIS_49:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00     
1:ASN_50:HN     1:HIS_49:HB2         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00     
1:ASN_50:HN     1:HIS_49:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:ASN_50:HD21   1:ASX_27:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:ASN_50:HD21   1:CYS_29:HB*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00     
1:ASN_50:HD21   1:ASN_50:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ASN_50:HD21   1:ASN_50:HB2         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00     
1:ASN_50:HD21   1:ASN_50:HB1         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00     
1:ASN_50:HD22   1:ASX_27:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:ASN_50:HD22   1:CYS_29:HB*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00     
1:ASN_50:HD22   1:ASN_50:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:ASN_50:HD22   1:ASN_50:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:TYR_51:HN     1:ASN_50:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00     
1:TYR_51:HN     1:TYR_55:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00     
1:TYR_51:HN     1:ASN_50:HB1         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00     
1:TYR_51:HN     1:ASN_50:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00     
1:TYR_51:HD*    1:VAL_52:HG1*        -1.000     7.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:VAL_52:HG2*        -1.000     7.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:TYR_55:HB1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:TYR_55:HB2         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:TYR_51:HB1         -1.000     5.120     3.120     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:TYR_51:HB2         -1.000     5.120     3.120     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:VAL_52:HA          -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:GLY_53:HA*         -1.000     7.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:ASN_50:HA          -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HE*    1:ASN_50:HA          -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_51:HE*    1:PHE_56:HA          -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HE*    1:GLY_54:HA1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HE*    1:VAL_52:HA          -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HE*    1:TYR_51:HB2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HE*    1:TYR_51:HB1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HE*    1:VAL_52:HG2*        -1.000     7.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HE*    1:VAL_52:HG1*        -1.000     7.560     4.560     50.00     50.00     1000.00     0.00
1:VAL_52:HN     1:TYR_51:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:VAL_52:HN     1:TYR_51:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:VAL_52:HN     1:TYR_51:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:VAL_52:HN     1:VAL_52:HG1*        -1.000     4.120     3.120     50.00     50.00     1000.00     0.00
1:VAL_52:HN     1:VAL_52:HG2*        -1.000     4.120     3.120     50.00     50.00     1000.00     0.00
1:GLY_53:HN     1:VAL_52:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:GLY_53:HN     1:VAL_52:HG1*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLY_54:HN     1:VAL_52:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:GLY_54:HN     1:VAL_52:HG1*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLY_54:HN     1:VAL_52:HG2*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HN     1:GLY_54:HA1         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:TYR_55:HN     1:GLY_54:HA2         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:TYR_55:HD*    1:PHE_56:HA          -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HD*    1:GLY_54:HA1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HD*    1:GLY_54:HA2         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HD*    1:TYR_55:HB2         -1.000     5.360     3.360     50.00     50.00     1000.00     0.00
1:TYR_55:HD*    1:TYR_55:HB1         -1.000     5.360     3.360     50.00     50.00     1000.00     0.00
1:TYR_55:HD*    1:GLX_28:HG1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HD*    1:GLX_28:HG2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HD*    1:GLX_28:HB1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HD*    1:GLX_28:HB2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:TYR_55:HA          -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:PHE_56:HA          -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:GLN_43:HA          -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:GLY_54:HA1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:TYR_55:HB2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:ARX_32:HD*         -1.000     7.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:TYR_55:HB1         -1.000     5.360     3.360     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:GLX_28:HG1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:GLX_28:HG2         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:GLN_43:HG*         -1.000     7.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:GLX_28:HB1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:GLX_28:HB2         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:ARX_32:HG1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HN     1:TYR_55:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:PHE_56:HN     1:ASN_50:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HN     1:TYR_55:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HN     1:TYR_55:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HN     1:HIS_49:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:TYR_55:HA          -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:SER_58:HA          -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:PHE_56:HA          -1.000     5.360     3.360     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:SER_58:HB1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:TYR_51:HB2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:TYR_51:HB1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:PHE_56:HB2         -1.000     5.360     3.360     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:PHE_56:HB1         -1.000     5.360     3.360     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:TYR_55:HB1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:HIS_49:HB1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:HIS_49:HB2         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:LEU_47:HD1*        -1.000     9.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:SER_58:HB2         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:SER_58:HB1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:TYR_51:HD*         -1.000     7.960     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:TYR_51:HE*         -1.000     7.960     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:TYR_51:HB2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:TYR_51:HB1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:PHE_56:HB2         -1.000     5.360     3.360     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:TYR_55:HB2         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:PHE_56:HB1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:TYR_55:HB1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:HIS_49:HB2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:HIS_49:HB1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:LEU_47:HD1*        -1.000     9.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_57:HN     1:CYS_48:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_57:HN     1:PHE_56:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:CYS_57:HN     1:PHE_56:HB2         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:CYS_57:HN     1:PHE_56:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_57:HN     1:CYS_48:HB1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_57:HN     1:LEU_65:HD1*        -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_57:HN     1:LEU_65:HD2*        -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:SER_58:HN     1:CYS_57:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:SER_58:HN     1:CYS_57:HB1         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:SER_58:HN     1:LEU_47:HB2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:SER_58:HN     1:LEU_47:HG          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:SER_58:HN     1:LEU_47:HB1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:SER_58:HN     1:LEU_65:HD1*        -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:SER_58:HN     1:CYS_57:HB2         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:CYS_59:HN     1:SER_58:HA          -1.000     2.800     3.360     50.00     50.00     1000.00     0.00
1:CYS_59:HN     1:SER_58:HB2         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:CYS_59:HN     1:SER_58:HB1         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:CYS_59:HN     1:LEU_65:HD1*        -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_59:HN     1:LEU_65:HD2*        -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:ARX_60:HD1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:CYS_59:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:HIS_46:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:PRO_61:HD1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:PRO_61:HD2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:TYR_63:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:CYS_59:HB2         -1.000     3.600     4.560     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:HIS_46:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:CYS_59:HB1         -1.000     3.600     4.560     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:TYR_63:HB1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:LEU_47:HG          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:LEU_47:HD2*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLY_62:HN     1:PRO_61:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:GLY_62:HN     1:PRO_61:HB2         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:GLY_62:HN     1:PRO_61:HG2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLY_62:HN     1:PRO_61:HB1         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:TYR_63:HN     1:TYR_63:HA          -1.000     2.800     3.360     50.00     50.00     1000.00     0.00
1:TYR_63:HN     1:GLY_62:HA1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HN     1:GLY_62:HA2         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:TYR_63:HN     1:CYS_59:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HE*    1:TYR_63:HA          -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HE*    1:ALA_74:HA          -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HE*    1:GLY_62:HA2         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HE*    1:TYR_63:HB2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HE*    1:TYR_63:HB1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HE*    1:CYS_72:HB2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HE*    1:ARX_60:HB2         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HE*    1:ARX_60:HG1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HE*    1:CYS_72:HB1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HE*    1:ALA_74:HB*         -1.000     6.120     3.120     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:CYS_72:HA          -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:TYR_63:HA          -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:GLX_64:HA          -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:GLY_62:HA1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:ALA_74:HA          -1.000     5.360     3.360     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:GLY_62:HA2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:TYR_63:HB2         -1.000     5.360     3.360     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:CYS_59:HB2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:ARX_60:HG1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:ARX_60:HG2         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:CYS_59:HB1         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:CYS_59:HA          -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:TYR_63:HB1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:CYS_72:HB2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:ARX_60:HB2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:CYS_72:HB1         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:ALA_74:HB*         -1.000     6.360     3.360     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:TYR_63:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:GLX_64:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:TYR_63:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:TYR_63:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:ALA_74:HA          -1.000     4.560     6.000     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:ALA_74:HB*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:CYS_72:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:CYS_72:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:GLX_64:HG*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLX_64:HA     1:LEU_65:HN          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:GLX_64:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:GLX_64:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:LEU_65:HN     1:GLX_64:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:LEU_65:HN     1:LEU_65:HG          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:LEU_65:HN     1:LEU_65:HB1         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:LEU_65:HN     1:LEU_65:HD2*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:LEU_65:HN     1:LEU_65:HD1*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HN     1:CYS_72:HA          -1.000     3.600     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HN     1:LEU_65:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:GLN_66:HN     1:SER_71:HB*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:GLN_66:HN     1:LEU_65:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HN     1:LEU_65:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HN     1:LEU_65:HD1*        -1.000     4.360     3.360     50.00     50.00     1000.00     0.00
1:GLN_66:HN     1:LEU_65:HD2*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HE21   1:CYS_72:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLN_66:HE21   1:LEU_65:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLN_66:HE21   1:GLN_66:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HE21   1:GLX_64:HG*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HE21   1:GLX_64:HB2         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:GLN_66:HE22   1:CYS_72:HA          -1.000     5.000     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HE22   1:LEU_65:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HE22   1:GLN_66:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HE22   1:GLN_66:HG*         -1.000     4.360     3.360     50.00     50.00     1000.00     0.00
1:GLN_66:HE22   1:GLX_64:HG*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HE22   1:GLN_66:HB1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLN_66:HE22   1:GLX_64:HB2         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:GLN_66:HE22   1:GLX_64:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLX_67:HN     1:GLN_66:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:GLX_67:HN     1:GLN_66:HB2         -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:GLX_67:HN     1:GLX_67:HG*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLX_67:HN     1:GLN_66:HG*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:ASX_68:HN     1:GLN_66:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ASX_68:HN     1:GLX_67:HA          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:ASX_68:HN     1:ARX_69:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ASX_68:HN     1:GLN_66:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ASX_68:HN     1:GLX_67:HG*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:ASX_68:HN     1:GLX_67:HB*         -1.000     4.360     3.360     50.00     50.00     1000.00     0.00
1:ASX_68:HN     1:ARX_69:HB1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ASX_68:HN     1:ARX_69:HG2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_69:HN     1:ASX_68:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ARX_69:HN     1:GLX_67:HA          -1.000     3.600     4.560     50.00     50.00     1000.00     0.00
1:ARX_69:HN     1:ARX_69:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:ARX_69:HN     1:ASX_68:HB2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_69:HN     1:ARX_69:HD*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_69:HN     1:LEU_65:HD2*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:ARX_69:HN     1:LEU_65:HD1*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_70:HN     1:SER_71:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_70:HN     1:ASX_68:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_70:HN     1:SER_71:HB*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_70:HN     1:ARX_69:HA          -1.000     4.650     3.360     50.00     50.00     1000.00     0.00
1:HIS_70:HN     1:ASX_68:HB2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_70:HN     1:ASX_68:HB1          3.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_70:HN     1:ARX_69:HB1          3.000     7.000     4.560     50.00     50.00     1000.00     0.00
1:HIS_70:HN     1:ARX_69:HG2         -1.000     6.000     4.560     50.00     50.00     1000.00     0.00
1:HIS_70:HN     1:LEU_65:HD2*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_70:HN     1:LEU_65:HD1*        -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_70:HD2    1:HIS_70:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_70:HD2    1:CYS_44:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_70:HD2    1:GLN_43:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_70:HD2    1:GLN_43:HG*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:SER_71:HN     1:HIS_70:HA          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:SER_71:HN     1:ARX_69:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:SER_71:HN     1:HIS_70:HB2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:SER_71:HN     1:HIS_70:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:SER_71:HN     1:ARX_69:HB2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:SER_71:HN     1:ARX_69:HB1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_72:HN     1:SER_71:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:CYS_72:HN     1:GLN_45:HA          -1.000     5.000     4.560     50.00     50.00     1000.00     0.00
1:CYS_72:HN     1:SER_71:HB*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_72:HN     1:GLN_45:HB2         -1.000     5.000     5.000     50.00     50.00     1000.00     0.00
1:CYS_72:HN     1:GLN_45:HB1         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_72:HN     1:GLN_45:HG1         -1.000     5.000     5.000     50.00     50.00     1000.00     0.00
1:GLN_73:HN     1:CYS_72:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:GLN_73:HN     1:TYR_63:HA          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLN_73:HN     1:LEU_65:HA          -1.000     3.800     3.360     50.00     50.00     1000.00     0.00 
1:GLN_73:HN     1:GLX_64:HB1         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLN_73:HN     1:CYS_72:HB1         -1.000     4.560     6.000     50.00     50.00     1000.00     0.00
1:GLN_73:HE21   1:GLN_73:HB2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLN_73:HE22   1:GLN_73:HG*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_73:HE22   1:GLN_73:HB2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ALA_74:HN     1:GLN_73:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:ALA_74:HN     1:GLN_73:HB2         -1.000     3.360     4.560     50.00     50.00     1000.00     0.00
1:ALA_74:HN     1:GLN_73:HB1         -1.000     3.200     4.560     50.00     50.00     1000.00     0.00
1:ALA_74:HN     1:ALA_74:HB*         -1.000     4.120     3.120     50.00     50.00     1000.00     0.00
1:GLXC_75:HN    1:TYR_63:HA          -1.000     3.120     3.120     50.00     50.00     1000.00     0.00
1:GLXC_75:HN    1:ALA_74:HA          -1.000     2.600     2.600     50.00     50.00     1000.00     0.00
1:GLXC_75:HN    1:ALA_74:HB*         -1.000     4.120     3.120     50.00     50.00     1000.00     0.00
1:CYS_72:HN     1:GLN_45:HN          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLY_53:HN     1:GLY_54:HN           2.500     4.560     4.560     50.00     50.00     1000.00     0.00
1:ARX_60:HN     1:LEU_47:HN          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:SER_58:HN     1:CYS_57:HN          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:SER_58:HN     1:HIS_49:HD2         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_57:HN     1:HIS_49:HD2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:TYR_63:HD*         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_57:HN     1:PHE_56:HD*         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:GLXC_75:HN         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HN     1:GLXC_75:HN         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:TYR_63:HN          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:GLN_73:HN          -1.000     3.360     4.560     50.00     50.00     1000.00     0.00
1:GLX_64:HN     1:LEU_65:HN          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_49:HN     1:TYR_55:HD*         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:SER_58:HN     1:LEU_47:HN          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_49:HN     1:CYS_48:HN          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_49:HN     1:PHE_56:HN          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_46:HN     1:HIS_46:HD2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_46:HN     1:LEU_47:HN          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_46:HN     1:GLN_45:HN          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ALA_74:HN     1:TYR_63:HD*         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:ALA_74:HN     1:TYR_63:HE*         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:ALA_74:HN     1:GLXC_75:HN         -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ALA_74:HN     1:GLN_73:HN          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HN     1:TYR_55:HD*         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HN     1:PHE_56:HD*         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HN     1:TYR_51:HD*         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:GLY_62:HN     1:TYR_63:HN          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:PHE_56:HN     1:TYR_51:HN          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_29:HN     1:ASN_50:HD22        -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_29:HN     1:ASN_50:HD21        -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_29:HN     1:ALA_30:HN          -1.000     4.200     4.560     50.00     50.00     1000.00     0.00
1:CYS_29:HN     1:GLX_28:HN          -1.000     4.200     4.560     50.00     50.00     1000.00     0.00
1:GLX_67:HN     1:ASX_68:HN          -1.000     4.000     4.560     50.00     50.00     1000.00     0.00
1:GLX_67:HN     1:ARX_69:HN          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ASN_50:HN     1:ASN_50:HD22        -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ASN_50:HN     1:ASN_50:HD21        -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_51:HN     1:TYR_51:HD*         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HN     1:GLY_54:HN          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_73:HN     1:TYR_63:HD*         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:GLN_73:HN     1:GLN_66:HE22        -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLN_73:HN     1:GLN_66:HE21        -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_69:HN     1:ASX_68:HN          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:GLN_66:HN     1:GLN_66:HE22        -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_66:HN     1:GLN_66:HE21        -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ASX_25:HN     1:LEU_26:HN          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLX_38:HN     1:ASX_39:HN          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:ASX_27:HN     1:LEU_26:HN          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLY_36:HN     1:GLX_37:HN          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:VAL_52:HN     1:TYR_51:HD*         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:GLX_28:HN     1:ASN_50:HD22        -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLX_28:HN     1:ASN_50:HD21        -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HN     1:TYR_51:HE*         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HN     1:TYR_55:HE*         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HN     1:TYR_55:HD*         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HN     1:TYR_51:HD*         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_55:HN     1:GLY_54:HN           2.500     6.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HN     1:TYR_63:HD*         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HN     1:TYR_63:HE*         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:SER_31:HN     1:ALA_30:HN          -1.000     4.200     4.560     50.00     50.00     1000.00     0.00
1:ARX_32:HN     1:SER_33:HN          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:GLXC_75:HN    1:TYR_63:HD*         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:GLN_45:HN     1:HIS_46:HD2         -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:GLY_54:HN     1:TYR_51:HE*         -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:GLY_54:HN     1:TYR_51:HD*         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:PHE_56:HD*         -1.000     7.960     4.560     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:HIS_49:HD2         -1.000     6.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_59:HA     1:HIS_46:HB2          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:CYS_59:HA     1:TYR_63:HB2          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_59:HA     1:HIS_46:HB1          -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:CYS_59:HA     1:TYR_63:HB1          -1.000     5.500     5.500     50.00     50.00     1000.00     0.00
1:CYS_59:HA     1:LEU_47:HG           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_72:HA     1:TYR_63:HB1          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_72:HA     1:LEU_65:HD1*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_72:HA     1:LEU_65:HD2*         -1.000     6.500     5.500     50.00     50.00     1000.00     0.00
1:ASN_50:HA     1:TYR_55:HB2          -1.000     4.500     4.500     50.00     50.00     1000.00     0.00
1:HIS_70:HA     1:LEU_65:HD2*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_70:HA     1:LEU_65:HD1*         -1.000     5.000     4.000     50.00     50.00     1000.00     0.00
1:TYR_63:HA     1:ALA_74:HA           -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HA     1:ALA_74:HB*          -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_51:HA     1:VAL_52:HG2*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:GLN_73:HA     1:ALA_74:HB*          -1.000     5.500     4.500     50.00     50.00     1000.00     0.00
1:SER_71:HA     1:GLN_45:HB2          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:SER_71:HA     1:GLN_45:HB1          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:LEU_47:HA     1:LEU_47:HD1*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:LEU_47:HA     1:LEU_47:HD2*         -1.000     7.600     6.600     50.00     50.00     1000.00     0.00
1:HIS_46:HB2    1:CYS_59:HB2          -1.000     6.600     6.600     50.00     50.00     1000.00     0.00
1:HIS_46:HB2    1:CYS_59:HB1          -1.000     6.600     6.600     50.00     50.00     1000.00     0.00
1:HIS_46:HB2    1:LEU_47:HG           -1.000     6.600     6.600     50.00     50.00     1000.00     0.00
1:HIS_46:HB2    1:LEU_47:HD2*         -1.000     7.600     6.600     50.00     50.00     1000.00     0.00
1:SER_71:HB*    1:GLN_66:HB2          -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:SER_71:HB*    1:GLN_66:HG*          -1.000     6.960     4.560     50.00     50.00     1000.00     0.00
1:SER_71:HB*    1:GLN_66:HB1          -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_57:HB2    1:LEU_65:HD1*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:PRO_61:HD2    1:ARX_60:HG2          -1.000     6.600     6.600     50.00     50.00     1000.00     0.00
1:PRO_61:HD1    1:ARX_60:HG2          -1.000     5.400     5.400     50.00     50.00     1000.00     0.00
1:TYR_63:HB2    1:CYS_59:HB2          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HB2    1:CYS_59:HB1          -1.000     3.200     3.200     50.00     50.00     1000.00     0.00
1:TYR_63:HB2    1:CYS_72:HB2          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_63:HB2    1:CYS_72:HB1          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:PRO_42:HD1    1:GLN_41:HA           -1.000     3.120     3.120     50.00     50.00     1000.00     0.00
1:PRO_42:HD1    1:GLN_41:HB2          -1.000     4.500     4.500     50.00     50.00     1000.00     0.00
1:PRO_42:HD1    1:GLN_41:HB1          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:PRO_42:HD2    1:GLN_41:HA           -1.000     3.120     3.120     50.00     50.00     1000.00     0.00
1:CYS_59:HB2    1:TYR_63:HB1          -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_59:HB2    1:CYS_72:HB2          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_59:HB2    1:CYS_72:HB1          -1.000     5.400     5.400     50.00     50.00     1000.00     0.00
1:ASX_27:HB2    1:ALA_30:HB*          -1.000     6.400     5.400     50.00     50.00     1000.00     0.00
1:CYS_57:HB1    1:LEU_65:HD2*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_57:HB1    1:LEU_65:HD1*         -1.000     6.400     5.400     50.00     50.00     1000.00     0.00
1:CYS_72:HB1    1:CYS_59:HB1          -1.000     6.600     6.600     50.00     50.00     1000.00     0.00
1:CYS_59:HB1    1:TYR_63:HB1          -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:ARX_69:HA     1:LEU_65:HD2*         -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:ARX_69:HA     1:LEU_65:HD1*         -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:SER_58:HA     1:LEU_65:HD1*          -1.000     6.000     5.000     50.00     50.00     1000.00     0.00
1:SER_58:HA     1:LEU_65:HD2*          -1.000     6.000     5.000     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:VAL_52:HB            -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:TYR_55:HA            -1.000     5.360     3.360     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:PHE_56:HB1           -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_51:HD*    1:PHE_56:HB2           -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_51:HE*    1:PHE_56:HB1           -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_51:HE*    1:PHE_56:HB2           -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_51:HE*    1:TYR_55:HA            -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HD*    1:TYR_51:HE*           -1.000     6.760     3.360     50.00     50.00     1000.00     0.00
1:TYR_63:HE*    1:HIS_46:HE1           -1.000     5.120     3.120     50.00     50.00     1000.00     0.00
1:TYR_55:HD*    1:ASN_50:HA            -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:PHE_56:HE*    1:ASN_50:HA            -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:TYR_63:HD*    1:HIS_46:HE1           -1.000     5.120     3.120     50.00     50.00     1000.00     0.00
1:TYR_55:HE*    1:HIS_70:HD2           -1.000     8.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_57:HA     1:HIS_70:HA            -1.000     7.000     7.000     50.00     50.00     1000.00     0.00
1:CYS_57:HA     1:LEU_65:HD1*          -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_57:HA     1:LEU_65:HD2*          -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_57:HA     1:SER_58:HA            -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_57:HA     1:CYS_48:HA            -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:TYR_55:HA     1:ASN_50:HA            -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:ARX_60:HA            -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:TYR_63:HB2           -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:CYS_59:HB2           -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:HIS_46:HB2           -1.000     7.000     7.000     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:CYS_59:HB1           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:TYR_63:HB1           -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:CYS_72:HB2           -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:TYR_63:HA            -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:CYS_72:HB1           -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:ARX_60:HB2           -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:ALA_74:HB*           -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_46:HE1    1:ARX_60:HG2           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_59:HA     1:HIS_46:HE1           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_59:HA     1:HIS_46:HA            -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_59:HA     1:LEU_47:HD2*          -1.000     5.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_59:HA     1:CYS_72:HB1           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_59:HA     1:CYS_72:HB2           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_72:HA     1:LEU_65:HA            -1.000     3.120     3.120     50.00     50.00     1000.00     0.00
1:CYS_72:HA     1:HIS_46:HE1           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_72:HA     1:SER_71:HA            -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_72:HA     1:TYR_63:HB2           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_72:HA     1:LEU_65:HB2           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_72:HA     1:LEU_65:HB1           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_72:HA     1:SER_71:HB*           -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_70:HA     1:CYS_44:HA            -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_70:HA     1:ARX_69:HA            -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_70:HA     1:ARX_69:HG2           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_46:HA     1:GLN_45:HG1           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:HIS_46:HA     1:LEU_47:HD1*          -1.000     7.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_44:HA     1:CYS_44:HB1           -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_44:HA     1:HIS_70:HB1           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_44:HA     1:HIS_70:HB2           -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_44:HA     1:CYS_44:HB2           -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_44:HB1    1:CYS_57:HA            -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_44:HB1    1:CYS_48:HA            -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_44:HB2    1:CYS_57:HA            -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_44:HB2    1:CYS_48:HA            -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_44:HN     1:GLN_43:HA            -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:CYS_44:HN     1:GLN_43:HB1           -1.000     4.560     4.560     50.00     50.00     1000.00     0.00
1:HIS_70:HA     1:CYS_57:HB2           -1.000     6.000     6.000     50.00     50.00     1000.00     0.00
1:CYS_44:HA     1:GLN_45:HN            -1.000     3.360     3.360     50.00     50.00     1000.00     0.00
!"negative" NOE constraints for absent NOEs
1:CYS_57:HN     1:PHE_56:HN             3.000    10.00     10.000     50.00     50.00     1000.00     0.00
1:CYS_59:HN     1:CYS_57:HB1            3.500    10.00     10.000     50.00     50.00     1000.00     0.00
1:CYS_59:HN     1:CYS_57:HB2            3.500    10.00     10.000     50.00     50.00     1000.00     0.00


Please acknowledge these references in publications where the data from this site have been utilized.

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