NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
630774 6e8w 30503 cing 1-original 1 XPLOR/CNS distance NOE simple


# Restraints file 1: all.tbl
!--- Intra-monomer NOE restraints ------------------------
!--- NOE restraints obtained from the current study ------
assign (segid AN1 and resid 661 and name  HD#) (segid AN1 and resid 662 and name  HG#) 3.00 2.00 2.00
assign (segid AN1 and resid 661 and name HD1#) (segid AN1 and resid 666 and name  HH2) 4.00 2.00 2.00

assign (segid AN1 and resid 662 and name   HN) (segid AN1 and resid 666 and name  HE1) 2.50 2.00 2.00

assign (segid AN1 and resid 663 and name   HN) (segid AN1 and resid 662 and name   HA) 2.00 1.00 1.00
assign (segid AN1 and resid 663 and name   HN) (segid AN1 and resid 663 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 663 and name   HN) (segid AN1 and resid 664 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 663 and name   HN) (segid AN1 and resid 665 and name   HN) 4.00 0.50 0.50
assign (segid AN1 and resid 663 and name  HD#) (segid AN1 and resid 667 and name   HN) 4.00 1.00 0.50
assign (segid AN1 and resid 663 and name HD2#) (segid AN1 and resid 667 and name  HB#) 3.00 1.00 0.50

assign (segid AN1 and resid 664 and name   HN) (segid AN1 and resid 662 and name   HA) 4.00 1.00 1.00
assign (segid AN1 and resid 664 and name   HN) (segid AN1 and resid 663 and name   HA) 2.80 0.50 0.50
assign (segid AN1 and resid 664 and name   HN) (segid AN1 and resid 663 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 664 and name   HN) (segid AN1 and resid 664 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 664 and name   HN) (segid AN1 and resid 665 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 665 and name   HN) (segid AN1 and resid 662 and name   HA) 3.50 1.00 1.00
assign (segid AN1 and resid 665 and name   HN) (segid AN1 and resid 664 and name   HA) 2.80 0.50 0.50
assign (segid AN1 and resid 665 and name   HN) (segid AN1 and resid 664 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 665 and name   HN) (segid AN1 and resid 665 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 665 and name   HN) (segid AN1 and resid 666 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 665 and name   HN) (segid AN1 and resid 666 and name  HD1) 3.50 1.00 1.00

assign (segid AN1 and resid 666 and name   HN) (segid AN1 and resid 663 and name   HA) 3.30 0.50 0.50
assign (segid AN1 and resid 666 and name   HN) (segid AN1 and resid 665 and name   HA) 3.00 0.50 0.50
assign (segid AN1 and resid 666 and name   HN) (segid AN1 and resid 665 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 666 and name   HN) (segid AN1 and resid 666 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 666 and name   HN) (segid AN1 and resid 666 and name  HE1) 4.00 1.00 1.00
assign (segid AN1 and resid 666 and name   HN) (segid AN1 and resid 667 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 666 and name  HE1) (segid AN1 and resid 661 and name  HB#) 3.00 2.00 2.00
assign (segid AN1 and resid 666 and name  HE1) (segid AN1 and resid 662 and name   HN) 3.00 1.00 1.00

assign (segid AN1 and resid 667 and name   HN) (segid AN1 and resid 664 and name   HA) 3.20 0.50 0.50
assign (segid AN1 and resid 667 and name   HN) (segid AN1 and resid 666 and name   HA) 3.00 0.50 0.50
assign (segid AN1 and resid 667 and name   HN) (segid AN1 and resid 666 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 667 and name   HN) (segid AN1 and resid 666 and name  HD1) 3.50 1.00 1.00
assign (segid AN1 and resid 667 and name   HN) (segid AN1 and resid 667 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 667 and name  HB#) (segid AN1 and resid 664 and name   HA) 3.50 0.50 0.50
assign (segid AN1 and resid 667 and name  HB#) (segid AN1 and resid 663 and name  HD#) 4.00 1.00 1.00

assign (segid AN1 and resid 668 and name   HN) (segid AN1 and resid 665 and name   HA) 3.50 0.50 0.50
assign (segid AN1 and resid 668 and name   HN) (segid AN1 and resid 667 and name   HA) 3.00 0.50 0.50
assign (segid AN1 and resid 668 and name   HN) (segid AN1 and resid 668 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 668 and name   HN) (segid AN1 and resid 669 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 669 and name   HN) (segid AN1 and resid 666 and name   HA) 3.20 0.50 0.50
assign (segid AN1 and resid 669 and name   HN) (segid AN1 and resid 668 and name   HA) 3.00 0.50 0.50
assign (segid AN1 and resid 669 and name   HN) (segid AN1 and resid 668 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 669 and name   HN) (segid AN1 and resid 669 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 669 and name   HN) (segid AN1 and resid 670 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 669 and name  HD#) (segid AN1 and resid 672 and name  HZ3) 3.50 1.00 1.00

assign (segid AN1 and resid 670 and name   HN) (segid AN1 and resid 667 and name   HA) 3.00 0.50 0.50
assign (segid AN1 and resid 670 and name   HN) (segid AN1 and resid 669 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 670 and name   HN) (segid AN1 and resid 670 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 670 and name   HN) (segid AN1 and resid 671 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 670 and name  HE1) (segid AN1 and resid 667 and name  HB#) 3.50 1.00 1.00
assign (segid AN1 and resid 670 and name  HE1) (segid AN1 and resid 669 and name  HD#) 4.00 1.00 1.00

assign (segid AN1 and resid 671 and name   HN) (segid AN1 and resid 670 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 671 and name   HN) (segid AN1 and resid 672 and name  HE1) 4.50 1.00 1.00

assign (segid AN1 and resid 672 and name   HN) (segid AN1 and resid 671 and name   HN) 2.70 0.50 0.50
assign (segid AN1 and resid 672 and name   HN) (segid AN1 and resid 673 and name   HN) 2.30 0.50 0.50
assign (segid AN1 and resid 672 and name  HE1) (segid AN1 and resid 669 and name  HD#) 3.00 1.00 1.00
assign (segid AN1 and resid 672 and name  HE1) (segid AN1 and resid 671 and name   HN) 4.50 1.00 1.00

assign (segid AN1 and resid 673 and name   HN) (segid AN1 and resid 672 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 674 and name   HN) (segid AN1 and resid 677 and name   HN) 4.50 0.50 0.50

assign (segid AN1 and resid 675 and name   HN) (segid AN1 and resid 674 and name   HN) 2.50 0.50 0.50 
assign (segid AN1 and resid 675 and name   HN) (segid AN1 and resid 676 and name   HN) 2.50 0.50 0.50 

assign (segid AN1 and resid 676 and name   HN) (segid AN1 and resid 675 and name   HN) 2.50 0.50 0.50 
assign (segid AN1 and resid 676 and name HG2#) (segid AN1 and resid 666 and name  HZ3) 4.00 1.00 1.00
assign (segid AN1 and resid 676 and name HG2#) (segid AN1 and resid 669 and name   HA) 4.00 1.00 1.00
assign (segid AN1 and resid 676 and name HG2#) (segid AN1 and resid 670 and name  HE1) 4.00 1.00 1.00
assign (segid AN1 and resid 676 and name HG2#) (segid AN1 and resid 679 and name   HN) 4.00 1.00 1.00
assign (segid AN1 and resid 676 and name HG2#) (segid AN1 and resid 681 and name   HH) 5.00 1.00 1.00

assign (segid AN1 and resid 677 and name   HN) (segid AN1 and resid 678 and name   HN) 2.50 0.50 0.50 

assign (segid AN1 and resid 678 and name   HN) (segid AN1 and resid 677 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 678 and name   HN) (segid AN1 and resid 679 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 678 and name  HE1) (segid AN1 and resid 675 and name HD1#) 4.00 1.00 1.00
assign (segid AN1 and resid 678 and name  HE1) (segid AN1 and resid 679 and name  HD#) 4.00 1.00 1.00
assign (segid AN1 and resid 678 and name  HE1) (segid AN1 and resid 682 and name   HN) 5.00 1.00 1.00

assign (segid AN1 and resid 679 and name HD1#) (segid AN1 and resid 666 and name  HZ3) 3.50 1.00 1.00
assign (segid AN1 and resid 679 and name  HD#) (segid AN1 and resid 678 and name  HH2) 4.00 1.00 1.00

assign (segid AN1 and resid 680 and name  HE1) (segid AN1 and resid 683 and name HH2#) 3.50 1.00 1.00
assign (segid AN1 and resid 680 and name  HE1) (segid AN1 and resid 684 and name HD1#) 4.50 1.00 1.00

assign (segid AN1 and resid 681 and name   HN) (segid AN1 and resid 680 and name   HN) 2.30 0.50 0.50 
assign (segid AN1 and resid 681 and name   HN) (segid AN1 and resid 682 and name   HN) 2.50 0.50 0.50 

assign (segid AN1 and resid 682 and name HG2#) (segid AN1 and resid 679 and name   HN) 4.50 1.00 0.50
assign (segid AN1 and resid 682 and name HG2#) (segid AN1 and resid 685 and name  HB#) 3.50 1.00 0.50
assign (segid AN1 and resid 682 and name HG2#) (segid AN1 and resid 685 and name  HD#) 3.20 1.00 1.00
assign (segid AN1 and resid 682 and name HD1#) (segid AN1 and resid 681 and name   HN) 4.50 1.00 0.50
assign (segid AN1 and resid 682 and name HD1#) (segid AN1 and resid 685 and name  HB#) 4.00 1.00 0.50

assign (segid AN1 and resid 683 and name   HN) (segid AN1 and resid 684 and name   HN) 2.50 0.50 0.50 

assign (segid AN1 and resid 684 and name   HN) (segid AN1 and resid 683 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 684 and name   HN) (segid AN1 and resid 685 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 684 and name HD1#) (segid AN1 and resid 681 and name   HA) 4.00 1.00 0.50
assign (segid AN1 and resid 684 and name HD1#) (segid AN1 and resid 681 and name  HE#) 4.00 1.00 1.00
assign (segid AN1 and resid 684 and name HG2#) (segid AN1 and resid 685 and name   HA) 3.50 1.00 0.50
assign (segid AN1 and resid 684 and name HG2#) (segid AN1 and resid 685 and name  HB#) 3.80 1.00 0.50
assign (segid AN1 and resid 684 and name HG2#) (segid AN1 and resid 685 and name  HD#) 3.00 1.00 1.00
assign (segid AN1 and resid 684 and name HG2#) (segid AN1 and resid 685 and name   HN) 3.00 1.00 0.50
assign (segid AN1 and resid 684 and name HG2#) (segid AN1 and resid 688 and name   HN) 4.00 1.00 0.50

assign (segid AN1 and resid 685 and name   HN) (segid AN1 and resid 684 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 685 and name   HN) (segid AN1 and resid 686 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 686 and name   HN) (segid AN1 and resid 684 and name   HN) 4.00 0.50 0.50
assign (segid AN1 and resid 686 and name   HN) (segid AN1 and resid 687 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 687 and name   HN) (segid AN1 and resid 688 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 688 and name   HN) (segid AN1 and resid 687 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 688 and name   HN) (segid AN1 and resid 689 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 688 and name   HN) (segid AN1 and resid 690 and name   HN) 4.00 0.50 0.50

assign (segid AN1 and resid 689 and name   HN) (segid AN1 and resid 690 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 702 and name   HN) (segid AN1 and resid 699 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 702 and name   HN) (segid AN1 and resid 700 and name   HN) 4.00 0.50 0.50
assign (segid AN1 and resid 702 and name   HN) (segid AN1 and resid 702 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 702 and name   HN) (segid AN1 and resid 703 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 702 and name   HN) (segid AN1 and resid 704 and name   HN) 4.00 0.50 0.50
assign (segid AN1 and resid 702 and name HD1#) (segid AN1 and resid 699 and name  HD#) 4.00 1.00 1.00
assign (segid AN1 and resid 702 and name HD1#) (segid AN1 and resid 699 and name  HE#) 4.00 1.00 1.00
assign (segid AN1 and resid 702 and name HD2#) (segid AN1 and resid 706 and name  HB#) 4.50 1.00 0.50
assign (segid AN1 and resid 702 and name HD2#) (segid AN1 and resid 706 and name HD2#) 3.50 1.00 1.00

assign (segid AN1 and resid 703 and name   HN) (segid AN1 and resid 700 and name   HA) 3.00 0.50 0.50
assign (segid AN1 and resid 703 and name   HN) (segid AN1 and resid 702 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 703 and name   HN) (segid AN1 and resid 703 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 703 and name   HN) (segid AN1 and resid 704 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 704 and name   HN) (segid AN1 and resid 701 and name   HA) 3.00 0.50 0.50
assign (segid AN1 and resid 704 and name   HN) (segid AN1 and resid 703 and name   HA) 3.00 0.50 0.50
assign (segid AN1 and resid 704 and name   HN) (segid AN1 and resid 703 and name  HB#) 3.00 0.50 0.50
assign (segid AN1 and resid 704 and name   HN) (segid AN1 and resid 703 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 704 and name   HN) (segid AN1 and resid 704 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 704 and name   HN) (segid AN1 and resid 704 and name  HB1) 2.20 0.50 0.50
assign (segid AN1 and resid 704 and name   HN) (segid AN1 and resid 704 and name  HB2) 2.20 0.50 0.50
assign (segid AN1 and resid 704 and name   HN) (segid AN1 and resid 705 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 704 and name HD1#) (segid AN1 and resid 707 and name  HD#) 3.50 1.00 1.00
assign (segid AN1 and resid 704 and name HD1#) (segid AN1 and resid 707 and name   HE) 4.00 1.00 1.00
assign (segid AN1 and resid 704 and name HD1#) (segid AN1 and resid 708 and name HG2#) 4.50 1.00 1.00

assign (segid AN1 and resid 705 and name   HN) (segid AN1 and resid 702 and name   HA) 2.80 0.50 0.50
assign (segid AN1 and resid 705 and name   HN) (segid AN1 and resid 704 and name   HA) 3.30 0.50 0.50
assign (segid AN1 and resid 705 and name   HN) (segid AN1 and resid 704 and name   HN) 2.70 0.50 0.50
assign (segid AN1 and resid 705 and name   HN) (segid AN1 and resid 705 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 705 and name   HN) (segid AN1 and resid 706 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 705 and name HG1#) (segid AN1 and resid 702 and name   HA) 3.00 1.00 0.50
assign (segid AN1 and resid 705 and name HG1#) (segid AN1 and resid 706 and name   HA) 4.00 1.00 0.50
assign (segid AN1 and resid 705 and name HG1#) (segid AN1 and resid 709 and name  HD#) 3.50 1.00 1.00
assign (segid AN1 and resid 705 and name HG2#) (segid AN1 and resid 701 and name   HA) 4.50 1.00 0.50
assign (segid AN1 and resid 705 and name HG2#) (segid AN1 and resid 702 and name   HG) 4.70 0.50 0.50
assign (segid AN1 and resid 705 and name HG2#) (segid AN1 and resid 706 and name  HB#) 4.50 0.50 0.50

assign (segid AN1 and resid 706 and name   HN) (segid AN1 and resid 703 and name   HA) 2.60 0.50 0.50
assign (segid AN1 and resid 706 and name   HN) (segid AN1 and resid 704 and name   HN) 3.70 0.50 0.50
assign (segid AN1 and resid 706 and name   HN) (segid AN1 and resid 705 and name   HA) 3.60 0.50 0.50
assign (segid AN1 and resid 706 and name   HN) (segid AN1 and resid 705 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 706 and name   HN) (segid AN1 and resid 706 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 706 and name   HN) (segid AN1 and resid 707 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 707 and name   HN) (segid AN1 and resid 704 and name   HA) 2.80 0.50 0.50
assign (segid AN1 and resid 707 and name   HN) (segid AN1 and resid 706 and name   HA) 3.50 0.50 0.50
assign (segid AN1 and resid 707 and name   HN) (segid AN1 and resid 706 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 707 and name   HN) (segid AN1 and resid 707 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 707 and name   HN) (segid AN1 and resid 708 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 707 and name   HN) (segid AN1 and resid 707 and name  HB#) 2.50 1.00 0.50
assign (segid AN1 and resid 707 and name   HN) (segid AN1 and resid 707 and name  HG#) 3.50 1.00 0.50
assign (segid AN1 and resid 707 and name   HN) (segid AN1 and resid 707 and name  HD#) 3.50 1.00 0.50
assign (segid AN1 and resid 707 and name   HE) (segid AN1 and resid 704 and name  HD#) 4.00 1.00 1.00

assign (segid AN1 and resid 708 and name   HN) (segid AN1 and resid 707 and name   HA) 3.00 0.50 0.50
assign (segid AN1 and resid 708 and name   HN) (segid AN1 and resid 707 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 708 and name   HN) (segid AN1 and resid 708 and name   HA) 2.50 0.50 0.50
assign (segid AN1 and resid 708 and name   HN) (segid AN1 and resid 709 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 709 and name   HN) (segid AN1 and resid 708 and name   HN) 2.50 1.00 1.00

!--- NOE restraints taken from the NMR structure of TMD (PDB deposition: 5JYN) ------
assign (segid AN1 and resid 686 and name HD1#) (segid AN1 and resid 683 and name   HA) 3.50 1.00 0.50
assign (segid AN1 and resid 686 and name HD1#) (segid AN1 and resid 685 and name   HN) 4.00 1.00 0.50
assign (segid AN1 and resid 686 and name HD1#) (segid AN1 and resid 685 and name  HD#) 4.00 1.00 1.00
assign (segid AN1 and resid 686 and name HD1#) (segid AN1 and resid 686 and name   HN) 2.50 1.00 0.50

assign (segid AN1 and resid 687 and name HD1#) (segid AN1 and resid 684 and name HD1#) 4.00 1.00 1.00
assign (segid AN1 and resid 687 and name HG2#) (segid AN1 and resid 691 and name   HG) 3.00 1.00 1.00

assign (segid AN1 and resid 688 and name HD1#) (segid AN1 and resid 684 and name HD1#) 4.00 1.00 1.00
assign (segid AN1 and resid 688 and name HG2#) (segid AN1 and resid 692 and name   HG) 4.50 1.00 1.00

assign (segid AN1 and resid 689 and name HG2#) (segid AN1 and resid 685 and name   HA) 4.00 1.00 0.50
assign (segid AN1 and resid 689 and name HG2#) (segid AN1 and resid 685 and name  HD#) 3.50 1.00 1.00
assign (segid AN1 and resid 689 and name HG2#) (segid AN1 and resid 685 and name  HE#) 3.50 1.00 1.00

assign (segid AN1 and resid 690 and name   HN) (segid AN1 and resid 689 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 690 and name   HN) (segid AN1 and resid 691 and name   HN) 2.50 0.50 0.50

assign (segid AN1 and resid 692 and name HD1#) (segid AN1 and resid 689 and name   HA) 3.00 0.50 0.50
assign (segid AN1 and resid 692 and name HD1#) (segid AN1 and resid 689 and name HG2#) 4.00 1.00 1.00
assign (segid AN1 and resid 692 and name HD1#) (segid AN1 and resid 691 and name  HB#) 3.50 1.00 0.50
assign (segid AN1 and resid 692 and name HD1#) (segid AN1 and resid 696 and name  HH#) 3.00 1.00 1.00
assign (segid AN1 and resid 692 and name HD2#) (segid AN1 and resid 696 and name  HH#) 3.50 1.00 1.00

assign (segid AN1 and resid 693 and name HD1#) (segid AN1 and resid 694 and name  HA#) 3.00 1.00 0.50
assign (segid AN1 and resid 693 and name HD1#) (segid AN1 and resid 697 and name   HN) 4.00 1.00 0.50
assign (segid AN1 and resid 693 and name HG2#) (segid AN1 and resid 690 and name  HA#) 3.00 1.00 0.50
assign (segid AN1 and resid 693 and name HG2#) (segid AN1 and resid 693 and name   HN) 2.20 1.00 0.50
assign (segid AN1 and resid 693 and name HG2#) (segid AN1 and resid 694 and name   HN) 3.50 1.00 0.50
assign (segid AN1 and resid 693 and name HG2#) (segid AN1 and resid 696 and name  HG#) 4.00 1.00 1.00

assign (segid AN1 and resid 695 and name   HN) (segid AN1 and resid 691 and name   HA) 4.50 0.50 0.50
assign (segid AN1 and resid 695 and name   HN) (segid AN1 and resid 694 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 695 and name HD1#) (segid AN1 and resid 691 and name  HB#) 3.50 1.00 0.50
assign (segid AN1 and resid 695 and name HD2#) (segid AN1 and resid 696 and name  HD#) 3.00 1.00 1.00
assign (segid AN1 and resid 695 and name HD2#) (segid AN1 and resid 698 and name   HB) 4.00 0.50 0.50 
assign (segid AN1 and resid 695 and name HD2#) (segid AN1 and resid 698 and name   HN) 4.00 0.50 0.50 
assign (segid AN1 and resid 695 and name HD2#) (segid AN1 and resid 699 and name  HE#) 2.50 1.00 1.00

assign (segid AN1 and resid 696 and name   HN) (segid AN1 and resid 693 and name   HA) 3.20 0.50 0.50
assign (segid AN1 and resid 696 and name   HN) (segid AN1 and resid 695 and name   HN) 2.50 0.50 0.50
assign (segid AN1 and resid 696 and name   HN) (segid AN1 and resid 696 and name   HE) 3.00 1.00 1.00

assign (segid AN1 and resid 697 and name HG2#) (segid AN1 and resid 694 and name  HA#) 4.00 1.00 0.50
assign (segid AN1 and resid 697 and name HG2#) (segid AN1 and resid 698 and name   HA) 3.80 1.00 0.50
assign (segid AN1 and resid 697 and name HG2#) (segid AN1 and resid 700 and name  HB#) 4.00 1.00 0.50

assign (segid AN1 and resid 698 and name HG1#) (segid AN1 and resid 695 and name   HA) 3.50 0.50 0.50 
assign (segid AN1 and resid 698 and name HG1#) (segid AN1 and resid 695 and name   HG) 4.50 0.50 0.50 
assign (segid AN1 and resid 698 and name HG1#) (segid AN1 and resid 699 and name  HD#) 3.00 0.50 1.00 
assign (segid AN1 and resid 698 and name HG1#) (segid AN1 and resid 702 and name  HB#) 3.50 1.00 0.50 

assign (segid AN1 and resid 699 and name   HN) (segid AN1 and resid 698 and name   HN) 2.50 0.50 0.50 
assign (segid AN1 and resid 699 and name   HN) (segid AN1 and resid 699 and name   HA) 2.50 0.50 0.50 
assign (segid AN1 and resid 699 and name   HN) (segid AN1 and resid 700 and name   HN) 2.50 0.50 0.50 

assign (segid AN1 and resid 700 and name   HN) (segid AN1 and resid 697 and name   HA) 3.80 0.50 0.50 
assign (segid AN1 and resid 700 and name   HN) (segid AN1 and resid 699 and name   HA) 2.80 0.50 0.50 
assign (segid AN1 and resid 700 and name   HN) (segid AN1 and resid 699 and name   HN) 2.50 0.50 0.50 
assign (segid AN1 and resid 700 and name   HN) (segid AN1 and resid 700 and name   HA) 2.50 0.50 0.50 
assign (segid AN1 and resid 700 and name   HN) (segid AN1 and resid 701 and name   HN) 2.50 0.50 0.50 
assign (segid AN1 and resid 700 and name  HB#) (segid AN1 and resid 697 and name   HA) 4.00 0.50 0.50
assign (segid AN1 and resid 700 and name  HB#) (segid AN1 and resid 703 and name  HB#) 4.50 0.50 0.50

assign (segid AN1 and resid 701 and name   HN) (segid AN1 and resid 698 and name   HA) 2.80 0.50 0.50 
assign (segid AN1 and resid 701 and name   HN) (segid AN1 and resid 700 and name   HN) 2.50 0.50 0.50 
assign (segid AN1 and resid 701 and name   HN) (segid AN1 and resid 701 and name   HA) 2.50 0.50 0.50 
assign (segid AN1 and resid 701 and name HG1#) (segid AN1 and resid 698 and name   HA) 3.00 1.00 0.50 
assign (segid AN1 and resid 701 and name HG2#) (segid AN1 and resid 698 and name   HA) 3.20 1.00 0.50 

!--- NOE restraints obtained from the current study ------
assign (segid AN2 and resid 661 and name  HD#) (segid AN2 and resid 662 and name  HG#) 3.00 2.00 2.00
assign (segid AN2 and resid 661 and name HD1#) (segid AN2 and resid 666 and name  HH2) 4.00 2.00 2.00

assign (segid AN2 and resid 662 and name   HN) (segid AN2 and resid 666 and name  HE1) 2.50 2.00 2.00

assign (segid AN2 and resid 663 and name   HN) (segid AN2 and resid 662 and name   HA) 2.00 1.00 1.00
assign (segid AN2 and resid 663 and name   HN) (segid AN2 and resid 663 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 663 and name   HN) (segid AN2 and resid 664 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 663 and name   HN) (segid AN2 and resid 665 and name   HN) 4.00 0.50 0.50
assign (segid AN2 and resid 663 and name  HD#) (segid AN2 and resid 667 and name   HN) 4.00 1.00 0.50
assign (segid AN2 and resid 663 and name HD2#) (segid AN2 and resid 667 and name  HB#) 3.00 1.00 0.50

assign (segid AN2 and resid 664 and name   HN) (segid AN2 and resid 662 and name   HA) 4.00 1.00 1.00
assign (segid AN2 and resid 664 and name   HN) (segid AN2 and resid 663 and name   HA) 2.80 0.50 0.50
assign (segid AN2 and resid 664 and name   HN) (segid AN2 and resid 663 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 664 and name   HN) (segid AN2 and resid 664 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 664 and name   HN) (segid AN2 and resid 665 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 665 and name   HN) (segid AN2 and resid 662 and name   HA) 3.50 1.00 1.00
assign (segid AN2 and resid 665 and name   HN) (segid AN2 and resid 664 and name   HA) 2.80 0.50 0.50
assign (segid AN2 and resid 665 and name   HN) (segid AN2 and resid 664 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 665 and name   HN) (segid AN2 and resid 665 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 665 and name   HN) (segid AN2 and resid 666 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 665 and name   HN) (segid AN2 and resid 666 and name  HD1) 3.50 1.00 1.00

assign (segid AN2 and resid 666 and name   HN) (segid AN2 and resid 663 and name   HA) 3.30 0.50 0.50
assign (segid AN2 and resid 666 and name   HN) (segid AN2 and resid 665 and name   HA) 3.00 0.50 0.50
assign (segid AN2 and resid 666 and name   HN) (segid AN2 and resid 665 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 666 and name   HN) (segid AN2 and resid 666 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 666 and name   HN) (segid AN2 and resid 666 and name  HE1) 4.00 1.00 1.00
assign (segid AN2 and resid 666 and name   HN) (segid AN2 and resid 667 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 666 and name  HE1) (segid AN2 and resid 661 and name  HB#) 3.00 2.00 2.00
assign (segid AN2 and resid 666 and name  HE1) (segid AN2 and resid 662 and name   HN) 3.00 1.00 1.00

assign (segid AN2 and resid 667 and name   HN) (segid AN2 and resid 664 and name   HA) 3.20 0.50 0.50
assign (segid AN2 and resid 667 and name   HN) (segid AN2 and resid 666 and name   HA) 3.00 0.50 0.50
assign (segid AN2 and resid 667 and name   HN) (segid AN2 and resid 666 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 667 and name   HN) (segid AN2 and resid 666 and name  HD1) 3.50 1.00 1.00
assign (segid AN2 and resid 667 and name   HN) (segid AN2 and resid 667 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 667 and name  HB#) (segid AN2 and resid 664 and name   HA) 3.50 0.50 0.50
assign (segid AN2 and resid 667 and name  HB#) (segid AN2 and resid 663 and name  HD#) 4.00 1.00 1.00

assign (segid AN2 and resid 668 and name   HN) (segid AN2 and resid 665 and name   HA) 3.50 0.50 0.50
assign (segid AN2 and resid 668 and name   HN) (segid AN2 and resid 667 and name   HA) 3.00 0.50 0.50
assign (segid AN2 and resid 668 and name   HN) (segid AN2 and resid 668 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 668 and name   HN) (segid AN2 and resid 669 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 669 and name   HN) (segid AN2 and resid 666 and name   HA) 3.20 0.50 0.50
assign (segid AN2 and resid 669 and name   HN) (segid AN2 and resid 668 and name   HA) 3.00 0.50 0.50
assign (segid AN2 and resid 669 and name   HN) (segid AN2 and resid 668 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 669 and name   HN) (segid AN2 and resid 669 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 669 and name   HN) (segid AN2 and resid 670 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 669 and name  HD#) (segid AN2 and resid 672 and name  HZ3) 3.50 1.00 1.00

assign (segid AN2 and resid 670 and name   HN) (segid AN2 and resid 667 and name   HA) 3.00 0.50 0.50
assign (segid AN2 and resid 670 and name   HN) (segid AN2 and resid 669 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 670 and name   HN) (segid AN2 and resid 670 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 670 and name   HN) (segid AN2 and resid 671 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 670 and name  HE1) (segid AN2 and resid 667 and name  HB#) 3.50 1.00 1.00
assign (segid AN2 and resid 670 and name  HE1) (segid AN2 and resid 669 and name  HD#) 4.00 1.00 1.00

assign (segid AN2 and resid 671 and name   HN) (segid AN2 and resid 670 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 671 and name   HN) (segid AN2 and resid 672 and name  HE1) 4.50 1.00 1.00

assign (segid AN2 and resid 672 and name   HN) (segid AN2 and resid 671 and name   HN) 2.70 0.50 0.50
assign (segid AN2 and resid 672 and name   HN) (segid AN2 and resid 673 and name   HN) 2.30 0.50 0.50
assign (segid AN2 and resid 672 and name  HE1) (segid AN2 and resid 669 and name  HD#) 3.00 1.00 1.00
assign (segid AN2 and resid 672 and name  HE1) (segid AN2 and resid 671 and name   HN) 4.50 1.00 1.00

assign (segid AN2 and resid 673 and name   HN) (segid AN2 and resid 672 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 674 and name   HN) (segid AN2 and resid 677 and name   HN) 4.50 0.50 0.50

assign (segid AN2 and resid 675 and name   HN) (segid AN2 and resid 674 and name   HN) 2.50 0.50 0.50 
assign (segid AN2 and resid 675 and name   HN) (segid AN2 and resid 676 and name   HN) 2.50 0.50 0.50 

assign (segid AN2 and resid 676 and name   HN) (segid AN2 and resid 675 and name   HN) 2.50 0.50 0.50 
assign (segid AN2 and resid 676 and name HG2#) (segid AN2 and resid 666 and name  HZ3) 4.00 1.00 1.00
assign (segid AN2 and resid 676 and name HG2#) (segid AN2 and resid 669 and name   HA) 4.00 1.00 1.00
assign (segid AN2 and resid 676 and name HG2#) (segid AN2 and resid 670 and name  HE1) 4.00 1.00 1.00
assign (segid AN2 and resid 676 and name HG2#) (segid AN2 and resid 679 and name   HN) 4.00 1.00 1.00
assign (segid AN2 and resid 676 and name HG2#) (segid AN2 and resid 681 and name   HH) 5.00 1.00 1.00

assign (segid AN2 and resid 677 and name   HN) (segid AN2 and resid 678 and name   HN) 2.50 0.50 0.50 

assign (segid AN2 and resid 678 and name   HN) (segid AN2 and resid 677 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 678 and name   HN) (segid AN2 and resid 679 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 678 and name  HE1) (segid AN2 and resid 675 and name HD1#) 4.00 1.00 1.00
assign (segid AN2 and resid 678 and name  HE1) (segid AN2 and resid 679 and name  HD#) 4.00 1.00 1.00
assign (segid AN2 and resid 678 and name  HE1) (segid AN2 and resid 682 and name   HN) 5.00 1.00 1.00

assign (segid AN2 and resid 679 and name HD1#) (segid AN2 and resid 666 and name  HZ3) 3.50 1.00 1.00
assign (segid AN2 and resid 679 and name  HD#) (segid AN2 and resid 678 and name  HH2) 4.00 1.00 1.00

assign (segid AN2 and resid 680 and name  HE1) (segid AN2 and resid 683 and name HH2#) 3.50 1.00 1.00
assign (segid AN2 and resid 680 and name  HE1) (segid AN2 and resid 684 and name HD1#) 4.50 1.00 1.00

assign (segid AN2 and resid 681 and name   HN) (segid AN2 and resid 680 and name   HN) 2.30 0.50 0.50 
assign (segid AN2 and resid 681 and name   HN) (segid AN2 and resid 682 and name   HN) 2.50 0.50 0.50 

assign (segid AN2 and resid 682 and name HG2#) (segid AN2 and resid 679 and name   HN) 4.50 1.00 0.50
assign (segid AN2 and resid 682 and name HG2#) (segid AN2 and resid 685 and name  HB#) 3.50 1.00 0.50
assign (segid AN2 and resid 682 and name HG2#) (segid AN2 and resid 685 and name  HD#) 3.20 1.00 1.00
assign (segid AN2 and resid 682 and name HD1#) (segid AN2 and resid 681 and name   HN) 4.50 1.00 0.50
assign (segid AN2 and resid 682 and name HD1#) (segid AN2 and resid 685 and name  HB#) 4.00 1.00 0.50

assign (segid AN2 and resid 683 and name   HN) (segid AN2 and resid 684 and name   HN) 2.50 0.50 0.50 

assign (segid AN2 and resid 684 and name   HN) (segid AN2 and resid 683 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 684 and name   HN) (segid AN2 and resid 685 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 684 and name HD1#) (segid AN2 and resid 681 and name   HA) 4.00 1.00 0.50
assign (segid AN2 and resid 684 and name HD1#) (segid AN2 and resid 681 and name  HE#) 4.00 1.00 1.00
assign (segid AN2 and resid 684 and name HG2#) (segid AN2 and resid 685 and name   HA) 3.50 1.00 0.50
assign (segid AN2 and resid 684 and name HG2#) (segid AN2 and resid 685 and name  HB#) 3.80 1.00 0.50
assign (segid AN2 and resid 684 and name HG2#) (segid AN2 and resid 685 and name  HD#) 3.00 1.00 1.00
assign (segid AN2 and resid 684 and name HG2#) (segid AN2 and resid 685 and name   HN) 3.00 1.00 0.50
assign (segid AN2 and resid 684 and name HG2#) (segid AN2 and resid 688 and name   HN) 4.00 1.00 0.50

assign (segid AN2 and resid 685 and name   HN) (segid AN2 and resid 684 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 685 and name   HN) (segid AN2 and resid 686 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 686 and name   HN) (segid AN2 and resid 684 and name   HN) 4.00 0.50 0.50
assign (segid AN2 and resid 686 and name   HN) (segid AN2 and resid 687 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 687 and name   HN) (segid AN2 and resid 688 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 688 and name   HN) (segid AN2 and resid 687 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 688 and name   HN) (segid AN2 and resid 689 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 688 and name   HN) (segid AN2 and resid 690 and name   HN) 4.00 0.50 0.50

assign (segid AN2 and resid 689 and name   HN) (segid AN2 and resid 690 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 702 and name   HN) (segid AN2 and resid 699 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 702 and name   HN) (segid AN2 and resid 700 and name   HN) 4.00 0.50 0.50
assign (segid AN2 and resid 702 and name   HN) (segid AN2 and resid 702 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 702 and name   HN) (segid AN2 and resid 703 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 702 and name   HN) (segid AN2 and resid 704 and name   HN) 4.00 0.50 0.50
assign (segid AN2 and resid 702 and name HD1#) (segid AN2 and resid 699 and name  HD#) 4.00 1.00 1.00
assign (segid AN2 and resid 702 and name HD1#) (segid AN2 and resid 699 and name  HE#) 4.00 1.00 1.00
assign (segid AN2 and resid 702 and name HD2#) (segid AN2 and resid 706 and name  HB#) 4.50 1.00 0.50
assign (segid AN2 and resid 702 and name HD2#) (segid AN2 and resid 706 and name HD2#) 3.50 1.00 1.00

assign (segid AN2 and resid 703 and name   HN) (segid AN2 and resid 700 and name   HA) 3.00 0.50 0.50
assign (segid AN2 and resid 703 and name   HN) (segid AN2 and resid 702 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 703 and name   HN) (segid AN2 and resid 703 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 703 and name   HN) (segid AN2 and resid 704 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 704 and name   HN) (segid AN2 and resid 701 and name   HA) 3.00 0.50 0.50
assign (segid AN2 and resid 704 and name   HN) (segid AN2 and resid 703 and name   HA) 3.00 0.50 0.50
assign (segid AN2 and resid 704 and name   HN) (segid AN2 and resid 703 and name  HB#) 3.00 0.50 0.50
assign (segid AN2 and resid 704 and name   HN) (segid AN2 and resid 703 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 704 and name   HN) (segid AN2 and resid 704 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 704 and name   HN) (segid AN2 and resid 704 and name  HB1) 2.20 0.50 0.50
assign (segid AN2 and resid 704 and name   HN) (segid AN2 and resid 704 and name  HB2) 2.20 0.50 0.50
assign (segid AN2 and resid 704 and name   HN) (segid AN2 and resid 705 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 704 and name HD1#) (segid AN2 and resid 707 and name  HD#) 3.50 1.00 1.00
assign (segid AN2 and resid 704 and name HD1#) (segid AN2 and resid 707 and name   HE) 4.00 1.00 1.00
assign (segid AN2 and resid 704 and name HD1#) (segid AN2 and resid 708 and name HG2#) 4.50 1.00 1.00

assign (segid AN2 and resid 705 and name   HN) (segid AN2 and resid 702 and name   HA) 2.80 0.50 0.50
assign (segid AN2 and resid 705 and name   HN) (segid AN2 and resid 704 and name   HA) 3.30 0.50 0.50
assign (segid AN2 and resid 705 and name   HN) (segid AN2 and resid 704 and name   HN) 2.70 0.50 0.50
assign (segid AN2 and resid 705 and name   HN) (segid AN2 and resid 705 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 705 and name   HN) (segid AN2 and resid 706 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 705 and name HG1#) (segid AN2 and resid 702 and name   HA) 3.00 1.00 0.50
assign (segid AN2 and resid 705 and name HG1#) (segid AN2 and resid 706 and name   HA) 4.00 1.00 0.50
assign (segid AN2 and resid 705 and name HG1#) (segid AN2 and resid 709 and name  HD#) 3.50 1.00 1.00
assign (segid AN2 and resid 705 and name HG2#) (segid AN2 and resid 701 and name   HA) 4.50 1.00 0.50
assign (segid AN2 and resid 705 and name HG2#) (segid AN2 and resid 702 and name   HG) 4.70 0.50 0.50
assign (segid AN2 and resid 705 and name HG2#) (segid AN2 and resid 706 and name  HB#) 4.50 0.50 0.50

assign (segid AN2 and resid 706 and name   HN) (segid AN2 and resid 703 and name   HA) 2.60 0.50 0.50
assign (segid AN2 and resid 706 and name   HN) (segid AN2 and resid 704 and name   HN) 3.70 0.50 0.50
assign (segid AN2 and resid 706 and name   HN) (segid AN2 and resid 705 and name   HA) 3.60 0.50 0.50
assign (segid AN2 and resid 706 and name   HN) (segid AN2 and resid 705 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 706 and name   HN) (segid AN2 and resid 706 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 706 and name   HN) (segid AN2 and resid 707 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 707 and name   HN) (segid AN2 and resid 704 and name   HA) 2.80 0.50 0.50
assign (segid AN2 and resid 707 and name   HN) (segid AN2 and resid 706 and name   HA) 3.50 0.50 0.50
assign (segid AN2 and resid 707 and name   HN) (segid AN2 and resid 706 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 707 and name   HN) (segid AN2 and resid 707 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 707 and name   HN) (segid AN2 and resid 708 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 707 and name   HN) (segid AN2 and resid 707 and name  HB#) 2.50 1.00 0.50
assign (segid AN2 and resid 707 and name   HN) (segid AN2 and resid 707 and name  HG#) 3.50 1.00 0.50
assign (segid AN2 and resid 707 and name   HN) (segid AN2 and resid 707 and name  HD#) 3.50 1.00 0.50
assign (segid AN2 and resid 707 and name   HE) (segid AN2 and resid 704 and name  HD#) 4.00 1.00 1.00

assign (segid AN2 and resid 708 and name   HN) (segid AN2 and resid 707 and name   HA) 3.00 0.50 0.50
assign (segid AN2 and resid 708 and name   HN) (segid AN2 and resid 707 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 708 and name   HN) (segid AN2 and resid 708 and name   HA) 2.50 0.50 0.50
assign (segid AN2 and resid 708 and name   HN) (segid AN2 and resid 709 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 709 and name   HN) (segid AN2 and resid 708 and name   HN) 2.50 1.00 1.00

!--- NOE restraints taken from the NMR structure of TMD (PDB deposition: 5JYN) ------
assign (segid AN2 and resid 686 and name HD1#) (segid AN2 and resid 683 and name   HA) 3.50 1.00 0.50
assign (segid AN2 and resid 686 and name HD1#) (segid AN2 and resid 685 and name   HN) 4.00 1.00 0.50
assign (segid AN2 and resid 686 and name HD1#) (segid AN2 and resid 685 and name  HD#) 4.00 1.00 1.00
assign (segid AN2 and resid 686 and name HD1#) (segid AN2 and resid 686 and name   HN) 2.50 1.00 0.50

assign (segid AN2 and resid 687 and name HD1#) (segid AN2 and resid 684 and name HD1#) 4.00 1.00 1.00
assign (segid AN2 and resid 687 and name HG2#) (segid AN2 and resid 691 and name   HG) 3.00 1.00 1.00

assign (segid AN2 and resid 688 and name HD1#) (segid AN2 and resid 684 and name HD1#) 4.00 1.00 1.00
assign (segid AN2 and resid 688 and name HG2#) (segid AN2 and resid 692 and name   HG) 4.50 1.00 1.00

assign (segid AN2 and resid 689 and name HG2#) (segid AN2 and resid 685 and name   HA) 4.00 1.00 0.50
assign (segid AN2 and resid 689 and name HG2#) (segid AN2 and resid 685 and name  HD#) 3.50 1.00 1.00
assign (segid AN2 and resid 689 and name HG2#) (segid AN2 and resid 685 and name  HE#) 3.50 1.00 1.00

assign (segid AN2 and resid 690 and name   HN) (segid AN2 and resid 689 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 690 and name   HN) (segid AN2 and resid 691 and name   HN) 2.50 0.50 0.50

assign (segid AN2 and resid 692 and name HD1#) (segid AN2 and resid 689 and name   HA) 3.00 0.50 0.50
assign (segid AN2 and resid 692 and name HD1#) (segid AN2 and resid 689 and name HG2#) 4.00 1.00 1.00
assign (segid AN2 and resid 692 and name HD1#) (segid AN2 and resid 691 and name  HB#) 3.50 1.00 0.50
assign (segid AN2 and resid 692 and name HD1#) (segid AN2 and resid 696 and name  HH#) 3.00 1.00 1.00
assign (segid AN2 and resid 692 and name HD2#) (segid AN2 and resid 696 and name  HH#) 3.50 1.00 1.00

assign (segid AN2 and resid 693 and name HD1#) (segid AN2 and resid 694 and name  HA#) 3.00 1.00 0.50
assign (segid AN2 and resid 693 and name HD1#) (segid AN2 and resid 697 and name   HN) 4.00 1.00 0.50
assign (segid AN2 and resid 693 and name HG2#) (segid AN2 and resid 690 and name  HA#) 3.00 1.00 0.50
assign (segid AN2 and resid 693 and name HG2#) (segid AN2 and resid 693 and name   HN) 2.20 1.00 0.50
assign (segid AN2 and resid 693 and name HG2#) (segid AN2 and resid 694 and name   HN) 3.50 1.00 0.50
assign (segid AN2 and resid 693 and name HG2#) (segid AN2 and resid 696 and name  HG#) 4.00 1.00 1.00

assign (segid AN2 and resid 695 and name   HN) (segid AN2 and resid 691 and name   HA) 4.50 0.50 0.50
assign (segid AN2 and resid 695 and name   HN) (segid AN2 and resid 694 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 695 and name HD1#) (segid AN2 and resid 691 and name  HB#) 3.50 1.00 0.50
assign (segid AN2 and resid 695 and name HD2#) (segid AN2 and resid 696 and name  HD#) 3.00 1.00 1.00
assign (segid AN2 and resid 695 and name HD2#) (segid AN2 and resid 698 and name   HB) 4.00 0.50 0.50 
assign (segid AN2 and resid 695 and name HD2#) (segid AN2 and resid 698 and name   HN) 4.00 0.50 0.50 
assign (segid AN2 and resid 695 and name HD2#) (segid AN2 and resid 699 and name  HE#) 2.50 1.00 1.00

assign (segid AN2 and resid 696 and name   HN) (segid AN2 and resid 693 and name   HA) 3.20 0.50 0.50
assign (segid AN2 and resid 696 and name   HN) (segid AN2 and resid 695 and name   HN) 2.50 0.50 0.50
assign (segid AN2 and resid 696 and name   HN) (segid AN2 and resid 696 and name   HE) 3.00 1.00 1.00

assign (segid AN2 and resid 697 and name HG2#) (segid AN2 and resid 694 and name  HA#) 4.00 1.00 0.50
assign (segid AN2 and resid 697 and name HG2#) (segid AN2 and resid 698 and name   HA) 3.80 1.00 0.50
assign (segid AN2 and resid 697 and name HG2#) (segid AN2 and resid 700 and name  HB#) 4.00 1.00 0.50

assign (segid AN2 and resid 698 and name HG1#) (segid AN2 and resid 695 and name   HA) 3.50 0.50 0.50 
assign (segid AN2 and resid 698 and name HG1#) (segid AN2 and resid 695 and name   HG) 4.50 0.50 0.50 
assign (segid AN2 and resid 698 and name HG1#) (segid AN2 and resid 699 and name  HD#) 3.00 0.50 1.00 
assign (segid AN2 and resid 698 and name HG1#) (segid AN2 and resid 702 and name  HB#) 3.50 1.00 0.50 

assign (segid AN2 and resid 699 and name   HN) (segid AN2 and resid 698 and name   HN) 2.50 0.50 0.50 
assign (segid AN2 and resid 699 and name   HN) (segid AN2 and resid 699 and name   HA) 2.50 0.50 0.50 
assign (segid AN2 and resid 699 and name   HN) (segid AN2 and resid 700 and name   HN) 2.50 0.50 0.50 

assign (segid AN2 and resid 700 and name   HN) (segid AN2 and resid 697 and name   HA) 3.80 0.50 0.50 
assign (segid AN2 and resid 700 and name   HN) (segid AN2 and resid 699 and name   HA) 2.80 0.50 0.50 
assign (segid AN2 and resid 700 and name   HN) (segid AN2 and resid 699 and name   HN) 2.50 0.50 0.50 
assign (segid AN2 and resid 700 and name   HN) (segid AN2 and resid 700 and name   HA) 2.50 0.50 0.50 
assign (segid AN2 and resid 700 and name   HN) (segid AN2 and resid 701 and name   HN) 2.50 0.50 0.50 
assign (segid AN2 and resid 700 and name  HB#) (segid AN2 and resid 697 and name   HA) 4.00 0.50 0.50
assign (segid AN2 and resid 700 and name  HB#) (segid AN2 and resid 703 and name  HB#) 4.50 0.50 0.50

assign (segid AN2 and resid 701 and name   HN) (segid AN2 and resid 698 and name   HA) 2.80 0.50 0.50 
assign (segid AN2 and resid 701 and name   HN) (segid AN2 and resid 700 and name   HN) 2.50 0.50 0.50 
assign (segid AN2 and resid 701 and name   HN) (segid AN2 and resid 701 and name   HA) 2.50 0.50 0.50 
assign (segid AN2 and resid 701 and name HG1#) (segid AN2 and resid 698 and name   HA) 3.00 1.00 0.50 
assign (segid AN2 and resid 701 and name HG2#) (segid AN2 and resid 698 and name   HA) 3.20 1.00 0.50 

!--- NOE restraints obtained from the current study ------
assign (segid AN3 and resid 661 and name  HD#) (segid AN3 and resid 662 and name  HG#) 3.00 2.00 2.00
assign (segid AN3 and resid 661 and name HD1#) (segid AN3 and resid 666 and name  HH2) 4.00 2.00 2.00

assign (segid AN3 and resid 662 and name   HN) (segid AN3 and resid 666 and name  HE1) 2.50 2.00 2.00

assign (segid AN3 and resid 663 and name   HN) (segid AN3 and resid 662 and name   HA) 2.00 1.00 1.00
assign (segid AN3 and resid 663 and name   HN) (segid AN3 and resid 663 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 663 and name   HN) (segid AN3 and resid 664 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 663 and name   HN) (segid AN3 and resid 665 and name   HN) 4.00 0.50 0.50
assign (segid AN3 and resid 663 and name  HD#) (segid AN3 and resid 667 and name   HN) 4.00 1.00 0.50
assign (segid AN3 and resid 663 and name HD2#) (segid AN3 and resid 667 and name  HB#) 3.00 1.00 0.50

assign (segid AN3 and resid 664 and name   HN) (segid AN3 and resid 662 and name   HA) 4.00 1.00 1.00
assign (segid AN3 and resid 664 and name   HN) (segid AN3 and resid 663 and name   HA) 2.80 0.50 0.50
assign (segid AN3 and resid 664 and name   HN) (segid AN3 and resid 663 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 664 and name   HN) (segid AN3 and resid 664 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 664 and name   HN) (segid AN3 and resid 665 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 665 and name   HN) (segid AN3 and resid 662 and name   HA) 3.50 1.00 1.00
assign (segid AN3 and resid 665 and name   HN) (segid AN3 and resid 664 and name   HA) 2.80 0.50 0.50
assign (segid AN3 and resid 665 and name   HN) (segid AN3 and resid 664 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 665 and name   HN) (segid AN3 and resid 665 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 665 and name   HN) (segid AN3 and resid 666 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 665 and name   HN) (segid AN3 and resid 666 and name  HD1) 3.50 1.00 1.00

assign (segid AN3 and resid 666 and name   HN) (segid AN3 and resid 663 and name   HA) 3.30 0.50 0.50
assign (segid AN3 and resid 666 and name   HN) (segid AN3 and resid 665 and name   HA) 3.00 0.50 0.50
assign (segid AN3 and resid 666 and name   HN) (segid AN3 and resid 665 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 666 and name   HN) (segid AN3 and resid 666 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 666 and name   HN) (segid AN3 and resid 666 and name  HE1) 4.00 1.00 1.00
assign (segid AN3 and resid 666 and name   HN) (segid AN3 and resid 667 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 666 and name  HE1) (segid AN3 and resid 661 and name  HB#) 3.00 2.00 2.00
assign (segid AN3 and resid 666 and name  HE1) (segid AN3 and resid 662 and name   HN) 3.00 1.00 1.00

assign (segid AN3 and resid 667 and name   HN) (segid AN3 and resid 664 and name   HA) 3.20 0.50 0.50
assign (segid AN3 and resid 667 and name   HN) (segid AN3 and resid 666 and name   HA) 3.00 0.50 0.50
assign (segid AN3 and resid 667 and name   HN) (segid AN3 and resid 666 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 667 and name   HN) (segid AN3 and resid 666 and name  HD1) 3.50 1.00 1.00
assign (segid AN3 and resid 667 and name   HN) (segid AN3 and resid 667 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 667 and name  HB#) (segid AN3 and resid 664 and name   HA) 3.50 0.50 0.50
assign (segid AN3 and resid 667 and name  HB#) (segid AN3 and resid 663 and name  HD#) 4.00 1.00 1.00

assign (segid AN3 and resid 668 and name   HN) (segid AN3 and resid 665 and name   HA) 3.50 0.50 0.50
assign (segid AN3 and resid 668 and name   HN) (segid AN3 and resid 667 and name   HA) 3.00 0.50 0.50
assign (segid AN3 and resid 668 and name   HN) (segid AN3 and resid 668 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 668 and name   HN) (segid AN3 and resid 669 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 669 and name   HN) (segid AN3 and resid 666 and name   HA) 3.20 0.50 0.50
assign (segid AN3 and resid 669 and name   HN) (segid AN3 and resid 668 and name   HA) 3.00 0.50 0.50
assign (segid AN3 and resid 669 and name   HN) (segid AN3 and resid 668 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 669 and name   HN) (segid AN3 and resid 669 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 669 and name   HN) (segid AN3 and resid 670 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 669 and name  HD#) (segid AN3 and resid 672 and name  HZ3) 3.50 1.00 1.00

assign (segid AN3 and resid 670 and name   HN) (segid AN3 and resid 667 and name   HA) 3.00 0.50 0.50
assign (segid AN3 and resid 670 and name   HN) (segid AN3 and resid 669 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 670 and name   HN) (segid AN3 and resid 670 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 670 and name   HN) (segid AN3 and resid 671 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 670 and name  HE1) (segid AN3 and resid 667 and name  HB#) 3.50 1.00 1.00
assign (segid AN3 and resid 670 and name  HE1) (segid AN3 and resid 669 and name  HD#) 4.00 1.00 1.00

assign (segid AN3 and resid 671 and name   HN) (segid AN3 and resid 670 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 671 and name   HN) (segid AN3 and resid 672 and name  HE1) 4.50 1.00 1.00

assign (segid AN3 and resid 672 and name   HN) (segid AN3 and resid 671 and name   HN) 2.70 0.50 0.50
assign (segid AN3 and resid 672 and name   HN) (segid AN3 and resid 673 and name   HN) 2.30 0.50 0.50
assign (segid AN3 and resid 672 and name  HE1) (segid AN3 and resid 669 and name  HD#) 3.00 1.00 1.00
assign (segid AN3 and resid 672 and name  HE1) (segid AN3 and resid 671 and name   HN) 4.50 1.00 1.00

assign (segid AN3 and resid 673 and name   HN) (segid AN3 and resid 672 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 674 and name   HN) (segid AN3 and resid 677 and name   HN) 4.50 0.50 0.50

assign (segid AN3 and resid 675 and name   HN) (segid AN3 and resid 674 and name   HN) 2.50 0.50 0.50 
assign (segid AN3 and resid 675 and name   HN) (segid AN3 and resid 676 and name   HN) 2.50 0.50 0.50 

assign (segid AN3 and resid 676 and name   HN) (segid AN3 and resid 675 and name   HN) 2.50 0.50 0.50 
assign (segid AN3 and resid 676 and name HG2#) (segid AN3 and resid 666 and name  HZ3) 4.00 1.00 1.00
assign (segid AN3 and resid 676 and name HG2#) (segid AN3 and resid 669 and name   HA) 4.00 1.00 1.00
assign (segid AN3 and resid 676 and name HG2#) (segid AN3 and resid 670 and name  HE1) 4.00 1.00 1.00
assign (segid AN3 and resid 676 and name HG2#) (segid AN3 and resid 679 and name   HN) 4.00 1.00 1.00
assign (segid AN3 and resid 676 and name HG2#) (segid AN3 and resid 681 and name   HH) 5.00 1.00 1.00

assign (segid AN3 and resid 677 and name   HN) (segid AN3 and resid 678 and name   HN) 2.50 0.50 0.50 

assign (segid AN3 and resid 678 and name   HN) (segid AN3 and resid 677 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 678 and name   HN) (segid AN3 and resid 679 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 678 and name  HE1) (segid AN3 and resid 675 and name HD1#) 4.00 1.00 1.00
assign (segid AN3 and resid 678 and name  HE1) (segid AN3 and resid 679 and name  HD#) 4.00 1.00 1.00
assign (segid AN3 and resid 678 and name  HE1) (segid AN3 and resid 682 and name   HN) 5.00 1.00 1.00

assign (segid AN3 and resid 679 and name HD1#) (segid AN3 and resid 666 and name  HZ3) 3.50 1.00 1.00
assign (segid AN3 and resid 679 and name  HD#) (segid AN3 and resid 678 and name  HH2) 4.00 1.00 1.00

assign (segid AN3 and resid 680 and name  HE1) (segid AN3 and resid 683 and name HH2#) 3.50 1.00 1.00
assign (segid AN3 and resid 680 and name  HE1) (segid AN3 and resid 684 and name HD1#) 4.50 1.00 1.00

assign (segid AN3 and resid 681 and name   HN) (segid AN3 and resid 680 and name   HN) 2.30 0.50 0.50 
assign (segid AN3 and resid 681 and name   HN) (segid AN3 and resid 682 and name   HN) 2.50 0.50 0.50 

assign (segid AN3 and resid 682 and name HG2#) (segid AN3 and resid 679 and name   HN) 4.50 1.00 0.50
assign (segid AN3 and resid 682 and name HG2#) (segid AN3 and resid 685 and name  HB#) 3.50 1.00 0.50
assign (segid AN3 and resid 682 and name HG2#) (segid AN3 and resid 685 and name  HD#) 3.20 1.00 1.00
assign (segid AN3 and resid 682 and name HD1#) (segid AN3 and resid 681 and name   HN) 4.50 1.00 0.50
assign (segid AN3 and resid 682 and name HD1#) (segid AN3 and resid 685 and name  HB#) 4.00 1.00 0.50

assign (segid AN3 and resid 683 and name   HN) (segid AN3 and resid 684 and name   HN) 2.50 0.50 0.50 

assign (segid AN3 and resid 684 and name   HN) (segid AN3 and resid 683 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 684 and name   HN) (segid AN3 and resid 685 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 684 and name HD1#) (segid AN3 and resid 681 and name   HA) 4.00 1.00 0.50
assign (segid AN3 and resid 684 and name HD1#) (segid AN3 and resid 681 and name  HE#) 4.00 1.00 1.00
assign (segid AN3 and resid 684 and name HG2#) (segid AN3 and resid 685 and name   HA) 3.50 1.00 0.50
assign (segid AN3 and resid 684 and name HG2#) (segid AN3 and resid 685 and name  HB#) 3.80 1.00 0.50
assign (segid AN3 and resid 684 and name HG2#) (segid AN3 and resid 685 and name  HD#) 3.00 1.00 1.00
assign (segid AN3 and resid 684 and name HG2#) (segid AN3 and resid 685 and name   HN) 3.00 1.00 0.50
assign (segid AN3 and resid 684 and name HG2#) (segid AN3 and resid 688 and name   HN) 4.00 1.00 0.50

assign (segid AN3 and resid 685 and name   HN) (segid AN3 and resid 684 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 685 and name   HN) (segid AN3 and resid 686 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 686 and name   HN) (segid AN3 and resid 684 and name   HN) 4.00 0.50 0.50
assign (segid AN3 and resid 686 and name   HN) (segid AN3 and resid 687 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 687 and name   HN) (segid AN3 and resid 688 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 688 and name   HN) (segid AN3 and resid 687 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 688 and name   HN) (segid AN3 and resid 689 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 688 and name   HN) (segid AN3 and resid 690 and name   HN) 4.00 0.50 0.50

assign (segid AN3 and resid 689 and name   HN) (segid AN3 and resid 690 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 702 and name   HN) (segid AN3 and resid 699 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 702 and name   HN) (segid AN3 and resid 700 and name   HN) 4.00 0.50 0.50
assign (segid AN3 and resid 702 and name   HN) (segid AN3 and resid 702 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 702 and name   HN) (segid AN3 and resid 703 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 702 and name   HN) (segid AN3 and resid 704 and name   HN) 4.00 0.50 0.50
assign (segid AN3 and resid 702 and name HD1#) (segid AN3 and resid 699 and name  HD#) 4.00 1.00 1.00
assign (segid AN3 and resid 702 and name HD1#) (segid AN3 and resid 699 and name  HE#) 4.00 1.00 1.00
assign (segid AN3 and resid 702 and name HD2#) (segid AN3 and resid 706 and name  HB#) 4.50 1.00 0.50
assign (segid AN3 and resid 702 and name HD2#) (segid AN3 and resid 706 and name HD2#) 3.50 1.00 1.00

assign (segid AN3 and resid 703 and name   HN) (segid AN3 and resid 700 and name   HA) 3.00 0.50 0.50
assign (segid AN3 and resid 703 and name   HN) (segid AN3 and resid 702 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 703 and name   HN) (segid AN3 and resid 703 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 703 and name   HN) (segid AN3 and resid 704 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 704 and name   HN) (segid AN3 and resid 701 and name   HA) 3.00 0.50 0.50
assign (segid AN3 and resid 704 and name   HN) (segid AN3 and resid 703 and name   HA) 3.00 0.50 0.50
assign (segid AN3 and resid 704 and name   HN) (segid AN3 and resid 703 and name  HB#) 3.00 0.50 0.50
assign (segid AN3 and resid 704 and name   HN) (segid AN3 and resid 703 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 704 and name   HN) (segid AN3 and resid 704 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 704 and name   HN) (segid AN3 and resid 704 and name  HB1) 2.20 0.50 0.50
assign (segid AN3 and resid 704 and name   HN) (segid AN3 and resid 704 and name  HB2) 2.20 0.50 0.50
assign (segid AN3 and resid 704 and name   HN) (segid AN3 and resid 705 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 704 and name HD1#) (segid AN3 and resid 707 and name  HD#) 3.50 1.00 1.00
assign (segid AN3 and resid 704 and name HD1#) (segid AN3 and resid 707 and name   HE) 4.00 1.00 1.00
assign (segid AN3 and resid 704 and name HD1#) (segid AN3 and resid 708 and name HG2#) 4.50 1.00 1.00

assign (segid AN3 and resid 705 and name   HN) (segid AN3 and resid 702 and name   HA) 2.80 0.50 0.50
assign (segid AN3 and resid 705 and name   HN) (segid AN3 and resid 704 and name   HA) 3.30 0.50 0.50
assign (segid AN3 and resid 705 and name   HN) (segid AN3 and resid 704 and name   HN) 2.70 0.50 0.50
assign (segid AN3 and resid 705 and name   HN) (segid AN3 and resid 705 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 705 and name   HN) (segid AN3 and resid 706 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 705 and name HG1#) (segid AN3 and resid 702 and name   HA) 3.00 1.00 0.50
assign (segid AN3 and resid 705 and name HG1#) (segid AN3 and resid 706 and name   HA) 4.00 1.00 0.50
assign (segid AN3 and resid 705 and name HG1#) (segid AN3 and resid 709 and name  HD#) 3.50 1.00 1.00
assign (segid AN3 and resid 705 and name HG2#) (segid AN3 and resid 701 and name   HA) 4.50 1.00 0.50
assign (segid AN3 and resid 705 and name HG2#) (segid AN3 and resid 702 and name   HG) 4.70 0.50 0.50
assign (segid AN3 and resid 705 and name HG2#) (segid AN3 and resid 706 and name  HB#) 4.50 0.50 0.50

assign (segid AN3 and resid 706 and name   HN) (segid AN3 and resid 703 and name   HA) 2.60 0.50 0.50
assign (segid AN3 and resid 706 and name   HN) (segid AN3 and resid 704 and name   HN) 3.70 0.50 0.50
assign (segid AN3 and resid 706 and name   HN) (segid AN3 and resid 705 and name   HA) 3.60 0.50 0.50
assign (segid AN3 and resid 706 and name   HN) (segid AN3 and resid 705 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 706 and name   HN) (segid AN3 and resid 706 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 706 and name   HN) (segid AN3 and resid 707 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 707 and name   HN) (segid AN3 and resid 704 and name   HA) 2.80 0.50 0.50
assign (segid AN3 and resid 707 and name   HN) (segid AN3 and resid 706 and name   HA) 3.50 0.50 0.50
assign (segid AN3 and resid 707 and name   HN) (segid AN3 and resid 706 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 707 and name   HN) (segid AN3 and resid 707 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 707 and name   HN) (segid AN3 and resid 708 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 707 and name   HN) (segid AN3 and resid 707 and name  HB#) 2.50 1.00 0.50
assign (segid AN3 and resid 707 and name   HN) (segid AN3 and resid 707 and name  HG#) 3.50 1.00 0.50
assign (segid AN3 and resid 707 and name   HN) (segid AN3 and resid 707 and name  HD#) 3.50 1.00 0.50
assign (segid AN3 and resid 707 and name   HE) (segid AN3 and resid 704 and name  HD#) 4.00 1.00 1.00

assign (segid AN3 and resid 708 and name   HN) (segid AN3 and resid 707 and name   HA) 3.00 0.50 0.50
assign (segid AN3 and resid 708 and name   HN) (segid AN3 and resid 707 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 708 and name   HN) (segid AN3 and resid 708 and name   HA) 2.50 0.50 0.50
assign (segid AN3 and resid 708 and name   HN) (segid AN3 and resid 709 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 709 and name   HN) (segid AN3 and resid 708 and name   HN) 2.50 1.00 1.00

!--- NOE restraints taken from the NMR structure of TMD (PDB deposition: 5JYN) ------
assign (segid AN3 and resid 686 and name HD1#) (segid AN3 and resid 683 and name   HA) 3.50 1.00 0.50
assign (segid AN3 and resid 686 and name HD1#) (segid AN3 and resid 685 and name   HN) 4.00 1.00 0.50
assign (segid AN3 and resid 686 and name HD1#) (segid AN3 and resid 685 and name  HD#) 4.00 1.00 1.00
assign (segid AN3 and resid 686 and name HD1#) (segid AN3 and resid 686 and name   HN) 2.50 1.00 0.50

assign (segid AN3 and resid 687 and name HD1#) (segid AN3 and resid 684 and name HD1#) 4.00 1.00 1.00
assign (segid AN3 and resid 687 and name HG2#) (segid AN3 and resid 691 and name   HG) 3.00 1.00 1.00

assign (segid AN3 and resid 688 and name HD1#) (segid AN3 and resid 684 and name HD1#) 4.00 1.00 1.00
assign (segid AN3 and resid 688 and name HG2#) (segid AN3 and resid 692 and name   HG) 4.50 1.00 1.00

assign (segid AN3 and resid 689 and name HG2#) (segid AN3 and resid 685 and name   HA) 4.00 1.00 0.50
assign (segid AN3 and resid 689 and name HG2#) (segid AN3 and resid 685 and name  HD#) 3.50 1.00 1.00
assign (segid AN3 and resid 689 and name HG2#) (segid AN3 and resid 685 and name  HE#) 3.50 1.00 1.00

assign (segid AN3 and resid 690 and name   HN) (segid AN3 and resid 689 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 690 and name   HN) (segid AN3 and resid 691 and name   HN) 2.50 0.50 0.50

assign (segid AN3 and resid 692 and name HD1#) (segid AN3 and resid 689 and name   HA) 3.00 0.50 0.50
assign (segid AN3 and resid 692 and name HD1#) (segid AN3 and resid 689 and name HG2#) 4.00 1.00 1.00
assign (segid AN3 and resid 692 and name HD1#) (segid AN3 and resid 691 and name  HB#) 3.50 1.00 0.50
assign (segid AN3 and resid 692 and name HD1#) (segid AN3 and resid 696 and name  HH#) 3.00 1.00 1.00
assign (segid AN3 and resid 692 and name HD2#) (segid AN3 and resid 696 and name  HH#) 3.50 1.00 1.00

assign (segid AN3 and resid 693 and name HD1#) (segid AN3 and resid 694 and name  HA#) 3.00 1.00 0.50
assign (segid AN3 and resid 693 and name HD1#) (segid AN3 and resid 697 and name   HN) 4.00 1.00 0.50
assign (segid AN3 and resid 693 and name HG2#) (segid AN3 and resid 690 and name  HA#) 3.00 1.00 0.50
assign (segid AN3 and resid 693 and name HG2#) (segid AN3 and resid 693 and name   HN) 2.20 1.00 0.50
assign (segid AN3 and resid 693 and name HG2#) (segid AN3 and resid 694 and name   HN) 3.50 1.00 0.50
assign (segid AN3 and resid 693 and name HG2#) (segid AN3 and resid 696 and name  HG#) 4.00 1.00 1.00

assign (segid AN3 and resid 695 and name   HN) (segid AN3 and resid 691 and name   HA) 4.50 0.50 0.50
assign (segid AN3 and resid 695 and name   HN) (segid AN3 and resid 694 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 695 and name HD1#) (segid AN3 and resid 691 and name  HB#) 3.50 1.00 0.50
assign (segid AN3 and resid 695 and name HD2#) (segid AN3 and resid 696 and name  HD#) 3.00 1.00 1.00
assign (segid AN3 and resid 695 and name HD2#) (segid AN3 and resid 698 and name   HB) 4.00 0.50 0.50 
assign (segid AN3 and resid 695 and name HD2#) (segid AN3 and resid 698 and name   HN) 4.00 0.50 0.50 
assign (segid AN3 and resid 695 and name HD2#) (segid AN3 and resid 699 and name  HE#) 2.50 1.00 1.00

assign (segid AN3 and resid 696 and name   HN) (segid AN3 and resid 693 and name   HA) 3.20 0.50 0.50
assign (segid AN3 and resid 696 and name   HN) (segid AN3 and resid 695 and name   HN) 2.50 0.50 0.50
assign (segid AN3 and resid 696 and name   HN) (segid AN3 and resid 696 and name   HE) 3.00 1.00 1.00

assign (segid AN3 and resid 697 and name HG2#) (segid AN3 and resid 694 and name  HA#) 4.00 1.00 0.50
assign (segid AN3 and resid 697 and name HG2#) (segid AN3 and resid 698 and name   HA) 3.80 1.00 0.50
assign (segid AN3 and resid 697 and name HG2#) (segid AN3 and resid 700 and name  HB#) 4.00 1.00 0.50

assign (segid AN3 and resid 698 and name HG1#) (segid AN3 and resid 695 and name   HA) 3.50 0.50 0.50 
assign (segid AN3 and resid 698 and name HG1#) (segid AN3 and resid 695 and name   HG) 4.50 0.50 0.50 
assign (segid AN3 and resid 698 and name HG1#) (segid AN3 and resid 699 and name  HD#) 3.00 0.50 1.00 
assign (segid AN3 and resid 698 and name HG1#) (segid AN3 and resid 702 and name  HB#) 3.50 1.00 0.50 

assign (segid AN3 and resid 699 and name   HN) (segid AN3 and resid 698 and name   HN) 2.50 0.50 0.50 
assign (segid AN3 and resid 699 and name   HN) (segid AN3 and resid 699 and name   HA) 2.50 0.50 0.50 
assign (segid AN3 and resid 699 and name   HN) (segid AN3 and resid 700 and name   HN) 2.50 0.50 0.50 

assign (segid AN3 and resid 700 and name   HN) (segid AN3 and resid 697 and name   HA) 3.80 0.50 0.50 
assign (segid AN3 and resid 700 and name   HN) (segid AN3 and resid 699 and name   HA) 2.80 0.50 0.50 
assign (segid AN3 and resid 700 and name   HN) (segid AN3 and resid 699 and name   HN) 2.50 0.50 0.50 
assign (segid AN3 and resid 700 and name   HN) (segid AN3 and resid 700 and name   HA) 2.50 0.50 0.50 
assign (segid AN3 and resid 700 and name   HN) (segid AN3 and resid 701 and name   HN) 2.50 0.50 0.50 
assign (segid AN3 and resid 700 and name  HB#) (segid AN3 and resid 697 and name   HA) 4.00 0.50 0.50
assign (segid AN3 and resid 700 and name  HB#) (segid AN3 and resid 703 and name  HB#) 4.50 0.50 0.50

assign (segid AN3 and resid 701 and name   HN) (segid AN3 and resid 698 and name   HA) 2.80 0.50 0.50 
assign (segid AN3 and resid 701 and name   HN) (segid AN3 and resid 700 and name   HN) 2.50 0.50 0.50 
assign (segid AN3 and resid 701 and name   HN) (segid AN3 and resid 701 and name   HA) 2.50 0.50 0.50 
assign (segid AN3 and resid 701 and name HG1#) (segid AN3 and resid 698 and name   HA) 3.00 1.00 0.50 
assign (segid AN3 and resid 701 and name HG2#) (segid AN3 and resid 698 and name   HA) 3.20 1.00 0.50 

!--- Inter-monomer NOE restraints ------------------------
!--- NOE restraints obtained from the current study ------
assign (segid AN1 and resid 661 and name  HD#) (segid AN3 and resid 680 and name  HE1) 4.00 2.00 2.00
assign (segid AN3 and resid 661 and name  HD#) (segid AN2 and resid 680 and name  HE1) 4.00 2.00 2.00
assign (segid AN2 and resid 661 and name  HD#) (segid AN1 and resid 680 and name  HE1) 4.00 2.00 2.00

assign (segid AN1 and resid 663 and name   HN) (segid AN2 and resid 661 and name  HB#) 4.00 2.00 2.00
assign (segid AN2 and resid 663 and name   HN) (segid AN3 and resid 661 and name  HB#) 4.00 2.00 2.00
assign (segid AN3 and resid 663 and name   HN) (segid AN1 and resid 661 and name  HB#) 4.00 2.00 2.00

assign (segid AN1 and resid 664 and name   HN) (segid AN2 and resid 660 and name  HB#) 4.00 2.00 2.00
assign (segid AN2 and resid 664 and name   HN) (segid AN3 and resid 660 and name  HB#) 4.00 2.00 2.00
assign (segid AN3 and resid 664 and name   HN) (segid AN1 and resid 660 and name  HB#) 4.00 2.00 2.00

assign (segid AN1 and resid 666 and name  HE1) (segid AN3 and resid 666 and name  HZ2) 4.00 2.00 2.00
assign (segid AN3 and resid 666 and name  HE1) (segid AN2 and resid 666 and name  HZ2) 4.00 2.00 2.00
assign (segid AN2 and resid 666 and name  HE1) (segid AN1 and resid 666 and name  HZ2) 4.00 2.00 2.00

assign (segid AN1 and resid 666 and name  HE1) (segid AN3 and resid 666 and name  HD1) 4.00 2.00 2.00
assign (segid AN3 and resid 666 and name  HE1) (segid AN2 and resid 666 and name  HD1) 4.00 2.00 2.00
assign (segid AN2 and resid 666 and name  HE1) (segid AN1 and resid 666 and name  HD1) 4.00 2.00 2.00

assign (segid AN1 and resid 670 and name  HE1) (segid AN2 and resid 660 and name  HB#) 4.00 2.00 2.00
assign (segid AN2 and resid 670 and name  HE1) (segid AN3 and resid 660 and name  HB#) 4.00 2.00 2.00
assign (segid AN3 and resid 670 and name  HE1) (segid AN1 and resid 660 and name  HB#) 4.00 2.00 2.00

assign (segid AN1 and resid 678 and name  HE1) (segid AN3 and resid 683 and name   HE) 4.50 1.00 1.00
assign (segid AN3 and resid 678 and name  HE1) (segid AN2 and resid 683 and name   HE) 4.50 1.00 1.00
assign (segid AN2 and resid 678 and name  HE1) (segid AN1 and resid 683 and name   HE) 4.50 1.00 1.00

assign (segid AN1 and resid 678 and name  HE1) (segid AN3 and resid 687 and name HD1#) 2.50 1.00 1.00
assign (segid AN3 and resid 678 and name  HE1) (segid AN2 and resid 687 and name HD1#) 2.50 1.00 1.00
assign (segid AN2 and resid 678 and name  HE1) (segid AN1 and resid 687 and name HD1#) 2.50 1.00 1.00

assign (segid AN1 and resid 702 and name  HD2#) (segid AN3 and resid 700 and name  HB#) 3.50 1.00 0.50
assign (segid AN3 and resid 702 and name  HD2#) (segid AN2 and resid 700 and name  HB#) 3.50 1.00 0.50
assign (segid AN2 and resid 702 and name  HD2#) (segid AN1 and resid 700 and name  HB#) 3.50 1.00 0.50

assign (segid AN1 and resid 707 and name    HN) (segid AN3 and resid 704 and name  HD#) 4.50 1.00 1.00
assign (segid AN3 and resid 707 and name    HN) (segid AN2 and resid 704 and name  HD#) 4.50 1.00 1.00
assign (segid AN2 and resid 707 and name    HN) (segid AN1 and resid 704 and name  HD#) 4.50 1.00 1.00

!--- NOE restraints taken from the NMR structure of TMD (PDB deposition: 5JYN) ------
assign (segid AN1 and resid 686 and name   HN) (segid AN3 and resid 686 and name HG2#) 4.00 1.00 1.00
assign (segid AN3 and resid 686 and name   HN) (segid AN2 and resid 686 and name HG2#) 4.00 1.00 1.00
assign (segid AN2 and resid 686 and name   HN) (segid AN1 and resid 686 and name HG2#) 4.00 1.00 1.00

assign (segid AN1 and resid 687 and name   HN) (segid AN2 and resid 686 and name HD1#) 4.00 1.00 1.00
assign (segid AN2 and resid 687 and name   HN) (segid AN3 and resid 686 and name HD1#) 4.00 1.00 1.00
assign (segid AN3 and resid 687 and name   HN) (segid AN1 and resid 686 and name HD1#) 4.00 1.00 1.00

assign (segid AN1 and resid 687 and name HG2#) (segid AN2 and resid 689 and name HG2#) 4.50 1.00 1.00
assign (segid AN2 and resid 687 and name HG2#) (segid AN3 and resid 689 and name HG2#) 4.50 1.00 1.00
assign (segid AN3 and resid 687 and name HG2#) (segid AN1 and resid 689 and name HG2#) 4.50 1.00 1.00

assign (segid AN1 and resid 690 and name   HN) (segid AN2 and resid 689 and name HG1#) 3.50 1.00 1.00
assign (segid AN2 and resid 690 and name   HN) (segid AN3 and resid 689 and name HG1#) 3.50 1.00 1.00
assign (segid AN3 and resid 690 and name   HN) (segid AN1 and resid 689 and name HG1#) 3.50 1.00 1.00

assign (segid AN1 and resid 692 and name HD2#) (segid AN3 and resid 694 and name   HN) 4.00 1.00 0.50
assign (segid AN3 and resid 692 and name HD2#) (segid AN2 and resid 694 and name   HN) 4.00 1.00 0.50
assign (segid AN2 and resid 692 and name HD2#) (segid AN1 and resid 694 and name   HN) 4.00 1.00 0.50

assign (segid AN1 and resid 693 and name   HN) (segid AN3 and resid 693 and name HG1#) 4.50 1.00 1.00
assign (segid AN3 and resid 693 and name   HN) (segid AN2 and resid 693 and name HG1#) 4.50 1.00 1.00
assign (segid AN2 and resid 693 and name   HN) (segid AN1 and resid 693 and name HG1#) 4.50 1.00 1.00

assign (segid AN1 and resid 693 and name   HN) (segid AN3 and resid 693 and name HD1#) 3.50 1.00 1.00
assign (segid AN3 and resid 693 and name   HN) (segid AN2 and resid 693 and name HD1#) 3.50 1.00 1.00
assign (segid AN2 and resid 693 and name   HN) (segid AN1 and resid 693 and name HD1#) 3.50 1.00 1.00

assign (segid AN1 and resid 693 and name HD1#) (segid AN2 and resid 696 and name  HH#) 3.50 1.00 0.50
assign (segid AN2 and resid 693 and name HD1#) (segid AN3 and resid 696 and name  HH#) 3.50 1.00 0.50
assign (segid AN3 and resid 693 and name HD1#) (segid AN1 and resid 696 and name  HH#) 3.50 1.00 0.50

assign (segid AN1 and resid 694 and name   HN) (segid AN2 and resid 692 and name HD2#) 4.00 1.00 1.00
assign (segid AN2 and resid 694 and name   HN) (segid AN3 and resid 692 and name HD2#) 4.00 1.00 1.00
assign (segid AN3 and resid 694 and name   HN) (segid AN1 and resid 692 and name HD2#) 4.00 1.00 1.00

assign (segid AN1 and resid 696 and name   HN) (segid AN3 and resid 693 and name HD1#) 3.50 1.00 1.00
assign (segid AN3 and resid 696 and name   HN) (segid AN2 and resid 693 and name HD1#) 3.50 1.00 1.00
assign (segid AN2 and resid 696 and name   HN) (segid AN1 and resid 693 and name HD1#) 3.50 1.00 1.00

assign (segid AN1 and resid 696 and name   HE) (segid AN3 and resid 694 and name  HA#) 4.00 1.00 1.00
assign (segid AN3 and resid 696 and name   HE) (segid AN2 and resid 694 and name  HA#) 4.00 1.00 1.00
assign (segid AN2 and resid 696 and name   HE) (segid AN1 and resid 694 and name  HA#) 4.00 1.00 1.00

assign (segid AN1 and resid 700 and name  HB#) (segid AN2 and resid 699 and name   HD#) 4.50 1.00 1.00
assign (segid AN2 and resid 700 and name  HB#) (segid AN3 and resid 699 and name   HD#) 4.50 1.00 1.00
assign (segid AN3 and resid 700 and name  HB#) (segid AN1 and resid 699 and name   HD#) 4.50 1.00 1.00




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