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
624344 5x0s 36047 cing 1-original 1 XPLOR/CNS distance NOE simple


# Restraints file 1: EG53_NOE.tbl
! E1
assign (resid 1 and name ha)(resid 2 and name hg1#) 1.8 0.0 4.2
assign (resid 1 and name ha)(resid 2 and name hg2#) 1.8 0.0 4.2

! V2
assign (resid 2 and name hn)(resid 1 and name ha) 1.8 0.0 2.2
assign (resid 2 and name hn)(resid 1 and name hb1) 1.8 0.0 3.2
assign (resid 2 and name hn)(resid 1 and name hb2) 1.8 0.0 3.2
assign (resid 2 and name hn)(resid 1 and name hg1) 1.8 0.0 4.2
assign (resid 2 and name hn)(resid 1 and name hg2) 1.8 0.0 4.2
assign (resid 2 and name hn)(resid 2 and name ha) 1.8 0.0 1.2
assign (resid 2 and name hn)(resid 2 and name hb) 1.8 0.0 2.2
assign (resid 2 and name hn)(resid 2 and name hg1#) 1.8 0.0 4.2
assign (resid 2 and name hn)(resid 2 and name hg2#) 1.8 0.0 4.2

assign (resid 2 and name hn)(resid 3 and name hn) 1.8 0.0 3.2

assign (resid 2 and name ha)(resid 3 and name hg1#) 1.8 0.0 4.2
assign (resid 2 and name ha)(resid 3 and name hg2#) 1.8 0.0 4.2
assign (resid 2 and name ha)(resid 3 and name hd1#) 1.8 0.0 4.2

!I3
assign (resid 3 and name hn)(resid 2 and name ha) 1.8 0.0 2.2
assign (resid 3 and name hn)(resid 2 and name hb) 1.8 0.0 3.2
assign (resid 3 and name hn)(resid 2 and name hg1#) 1.8 0.0 4.2
assign (resid 3 and name hn)(resid 2 and name hg2#) 1.8 0.0 4.2
assign (resid 3 and name hn)(resid 3 and name ha) 1.8 0.0 1.2
assign (resid 3 and name hn)(resid 3 and name hb) 1.8 0.0 3.2
assign (resid 3 and name hn)(resid 3 and name hg11) 1.8 0.0 4.2
assign (resid 3 and name hn)(resid 3 and name hg12) 1.8 0.0 4.2
assign (resid 3 and name hn)(resid 3 and name hg2#) 1.8 0.0 4.2
assign (resid 3 and name hn)(resid 3 and name hd1#) 1.8 0.0 4.2

assign (resid 3 and name ha)(resid 2 and name hb) 1.8 0.0 4.2
assign (resid 3 and name ha)(resid 2 and name hg2#) 1.8 0.0 4.2
assign (resid 3 and name ha)(resid 4 and name ha) 1.8 0.0 4.2
assign (resid 3 and name ha)(resid 4 and name hd#) 1.8 0.0 4.2

! K4
assign (resid 4 and name hn)(resid 3 and name ha) 1.8 0.0 2.2
assign (resid 4 and name hn)(resid 3 and name hb) 1.8 0.0 3.2
assign (resid 4 and name hn)(resid 3 and name hg11) 1.8 0.0 4.2
assign (resid 4 and name hn)(resid 3 and name hg12) 1.8 0.0 4.2
assign (resid 4 and name hn)(resid 3 and name hg2#) 1.8 0.0 4.2
assign (resid 4 and name hn)(resid 3 and name hd1#) 1.8 0.0 4.2
assign (resid 4 and name hn)(resid 4 and name ha) 1.8 0.0 1.2
assign (resid 4 and name hn)(resid 4 and name hb1) 1.8 0.0 3.2
assign (resid 4 and name hn)(resid 4 and name hb2) 1.8 0.0 3.2
assign (resid 4 and name hn)(resid 4 and name hg1) 1.8 0.0 4.2
assign (resid 4 and name hn)(resid 4 and name hg2) 1.8 0.0 4.2
assign (resid 4 and name hn)(resid 4 and name hd1) 1.8 0.0 4.2
assign (resid 4 and name hn)(resid 4 and name hd2) 1.8 0.0 4.2
assign (resid 4 and name hn)(resid 3 and name hn) 1.8 0.0 3.2

assign (resid 4 and name ha)(resid 47 and name hg2#) 1.8 0.0 4.2
assign (resid 4 and name ha)(resid 49 and name ha) 1.8 0.0 3.2

! K5
assign (resid 5 and name hn)(resid 4 and name ha) 1.8 0.0 1.2
assign (resid 5 and name hn)(resid 4 and name hb1) 1.8 0.0 3.2
assign (resid 5 and name hn)(resid 4 and name hb2) 1.8 0.0 3.2
assign (resid 5 and name hn)(resid 4 and name hg1) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 4 and name hg2) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 4 and name hd1) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 4 and name hd2) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 5 and name ha) 1.8 0.0 1.2
assign (resid 5 and name hn)(resid 5 and name hb1) 1.8 0.0 3.2
assign (resid 5 and name hn)(resid 5 and name hb2) 1.8 0.0 3.2
assign (resid 5 and name hn)(resid 5 and name hg1) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 5 and name hg2) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 5 and name hd1) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 5 and name hd2) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 6 and name ha) 1.8 0.0 3.2  !!!
assign (resid 5 and name hn)(resid 47 and name ha) 1.8 0.0 4.2  !!!
assign (resid 5 and name hn)(resid 47 and name hg2#) 1.8 0.0 4.2  !!!
assign (resid 5 and name hn)(resid 48 and name hb1) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 48 and name hb2) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 49 and name ha) 1.8 0.0 2.2
assign (resid 5 and name hn)(resid 49 and name hb#) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 49 and name hd#) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 49 and name he#) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 4 and name hn) 1.8 0.0 3.2
assign (resid 5 and name hn)(resid 6 and name hn) 1.8 0.0 3.2
assign (resid 5 and name hn)(resid 48 and name hn) 1.8 0.0 2.7
assign (resid 5 and name hn)(resid 49 and name hn) 1.8 0.0 4.2
assign (resid 5 and name hn)(resid 50 and name hn) 1.8 0.0 2.7

! D6
assign (resid 6 and name hn)(resid 5 and name ha) 1.8 0.0 1.2
assign (resid 6 and name hn)(resid 5 and name hb1) 1.8 0.0 4.2
assign (resid 6 and name hn)(resid 5 and name hb2) 1.8 0.0 4.2
assign (resid 6 and name hn)(resid 5 and name hg1) 1.8 0.0 4.2
assign (resid 6 and name hn)(resid 5 and name hg2) 1.8 0.0 4.2
assign (resid 6 and name hn)(resid 5 and name hd1) 1.8 0.0 4.2
assign (resid 6 and name hn)(resid 5 and name hd2) 1.8 0.0 4.2
assign (resid 6 and name hn)(resid 6 and name ha) 1.8 0.0 1.2
assign (resid 6 and name hn)(resid 6 and name hb1) 1.8 0.0 3.2
assign (resid 6 and name hn)(resid 6 and name hb2) 1.8 0.0 3.2
!assign (resid 6 and name hn)(resid 12 and name hd1) 1.8 0.0 4.2
!assign (resid 6 and name hn)(resid 12 and name hd2) 1.8 0.0 4.2
assign (resid 6 and name hn)(resid 7 and name hn) 1.8 0.0 3.2

assign (resid 6 and name hn)(resid 47 and name ha) 1.8 0.0 4.2 !!!
assign (resid 6 and name hn)(resid 47 and name hb) 1.8 0.0 4.2 !!!
assign (resid 6 and name hn)(resid 47 and name hg2#) 1.8 0.0 4.2 !!!
assign (resid 6 and name ha)(resid 47 and name ha) 1.8 0.0 2.7
assign (resid 6 and name ha)(resid 47 and name hg2#) 1.8 0.0 4.2 !!!

! T7
assign (resid 7 and name hn)(resid 6 and name ha) 1.8 0.0 1.2
assign (resid 7 and name hn)(resid 6 and name hb1) 1.8 0.0 3.2
assign (resid 7 and name hn)(resid 6 and name hb2) 1.8 0.0 3.2
assign (resid 7 and name hn)(resid 7 and name ha) 1.8 0.0 1.2
assign (resid 7 and name hn)(resid 7 and name hb) 1.8 0.0 2.2
assign (resid 7 and name hn)(resid 7 and name hg2#) 1.8 0.0 4.2

assign (resid 7 and name hn)(resid 21 and name ha) 1.8 0.0 4.2 !!!
assign (resid 7 and name hn)(resid 23 and name hb#) 1.8 0.0 4.2
assign (resid 7 and name hn)(resid 24 and name hb#) 1.8 0.0 4.2
assign (resid 7 and name hg2#)(resid 23 and name hb#) 1.8 0.0 3.2
assign (resid 7 and name hg2#)(resid 24 and name ha) 1.8 0.0 2.7

assign (resid 7 and name hn)(resid 45 and name ha) 1.8 0.0 4.2
assign (resid 7 and name hn)(resid 47 and name ha) 1.8 0.0 2.2
assign (resid 7 and name hn)(resid 47 and name hb) 1.8 0.0 4.2
assign (resid 7 and name hn)(resid 47 and name hg2#) 1.8 0.0 4.2
assign (resid 7 and name hn)(resid 47 and name hn) 1.8 0.0 4.2
assign (resid 7 and name hn)(resid 46 and name hn) 1.8 0.0 2.7
assign (resid 7 and name hn)(resid 48 and name hn) 1.8 0.0 2.7

! P8

! Y9
assign (resid 9 and name hn)(resid 8 and name ha) 1.8 0.0 2.2
assign (resid 9 and name hn)(resid 8 and name hb1) 1.8 0.0 3.2
assign (resid 9 and name hn)(resid 8 and name hb2) 1.8 0.0 3.2
assign (resid 9 and name hn)(resid 8 and name hg1) 1.8 0.0 4.2
assign (resid 9 and name hn)(resid 8 and name hg2) 1.8 0.0 4.2
assign (resid 9 and name hn)(resid 9 and name ha) 1.8 0.0 1.2
assign (resid 9 and name hn)(resid 9 and name hb1) 1.8 0.0 2.2
assign (resid 9 and name hn)(resid 9 and name hb2) 1.8 0.0 2.2
assign (resid 9 and name hn)(resid 9 and name hd#) 1.8 0.0 3.2
!assign (resid 9 and name hn)(resid 9 and name he#) 1.8 0.0 4.2
assign (resid 9 and name hn)(resid 45 and name ha) 1.8 0.0 2.2
assign (resid 9 and name hn)(resid 10 and name hn) 1.8 0.0 4.2
assign (resid 9 and name hn)(resid 46 and name hn) 1.8 0.0 3.2

assign (resid 9 and name hn)(resid 10 and name ha) 1.8 0.0 4.2 !!!
assign (resid 9 and name hn)(resid 10 and name hb1) 1.8 0.0 4.2 !!!
assign (resid 9 and name hn)(resid 10 and name hb2) 1.8 0.0 4.2 !!!
assign (resid 9 and name hn)(resid 10 and name hg#) 1.8 0.0 4.2 !!!
assign (resid 9 and name hn)(resid 44 and name hb1) 1.8 0.0 4.2 !!!
assign (resid 9 and name hn)(resid 44 and name hb2) 1.8 0.0 4.2 !!!

assign (resid 9 and name hd#)(resid 23 and name hb#) 1.8 0.0 4.2

! K10
assign (resid 10 and name hn)(resid 8 and name ha) 1.8 0.0 3.2
assign (resid 10 and name hn)(resid 8 and name hb#) 1.8 0.0 3.2
assign (resid 10 and name hn)(resid 9 and name ha) 1.8 0.0 2.2
assign (resid 10 and name hn)(resid 9 and name hb1) 1.8 0.0 3.2
assign (resid 10 and name hn)(resid 9 and name hb2) 1.8 0.0 3.2
assign (resid 10 and name hn)(resid 9 and name hd#) 1.8 0.0 4.2
assign (resid 10 and name hn)(resid 9 and name he#) 1.8 0.0 4.2
assign (resid 10 and name hn)(resid 10 and name ha) 1.8 0.0 1.2
assign (resid 10 and name hn)(resid 10 and name hb1) 1.8 0.0 2.2
assign (resid 10 and name hn)(resid 10 and name hb2) 1.8 0.0 2.2
assign (resid 10 and name hn)(resid 10 and name hg1) 1.8 0.0 4.2
assign (resid 10 and name hn)(resid 10 and name hg2) 1.8 0.0 4.2
assign (resid 10 and name hn)(resid 10 and name hd1) 1.8 0.0 4.2
assign (resid 10 and name hn)(resid 10 and name hd2) 1.8 0.0 4.2

assign (resid 10 and name hn)(resid 11 and name ha) 1.8 0.0 4.2
assign (resid 10 and name hn)(resid 11 and name hn) 1.8 0.0 3.2
assign (resid 10 and name hn)(resid 12 and name hn) 1.8 0.0 4.2
assign (resid 10 and name hn)(resid 44 and name ha) 1.8 0.0 3.2

! K11
assign (resid 11 and name hn)(resid 9 and name ha) 1.8 0.0 3.2
assign (resid 11 and name hn)(resid 10 and name ha) 1.8 0.0 2.2
assign (resid 11 and name hn)(resid 10 and name hb1) 1.8 0.0 3.2
assign (resid 11 and name hn)(resid 10 and name hb2) 1.8 0.0 3.2
assign (resid 11 and name hn)(resid 10 and name hg1) 1.8 0.0 4.2
assign (resid 11 and name hn)(resid 10 and name hg2) 1.8 0.0 4.2
assign (resid 11 and name hn)(resid 10 and name hd1) 1.8 0.0 4.2
assign (resid 11 and name hn)(resid 10 and name hd2) 1.8 0.0 4.2
assign (resid 11 and name hn)(resid 11 and name ha) 1.8 0.0 1.2
assign (resid 11 and name hn)(resid 11 and name hb1) 1.8 0.0 3.2
assign (resid 11 and name hn)(resid 11 and name hb2) 1.8 0.0 3.2
assign (resid 11 and name hn)(resid 11 and name hg1) 1.8 0.0 4.2
assign (resid 11 and name hn)(resid 11 and name hg2) 1.8 0.0 4.2
assign (resid 11 and name hn)(resid 11 and name hd1) 1.8 0.0 4.2
assign (resid 11 and name hn)(resid 11 and name hd2) 1.8 0.0 4.2
assign (resid 11 and name hn)(resid 11 and name he1) 1.8 0.0 4.2
assign (resid 11 and name hn)(resid 11 and name he2) 1.8 0.0 4.2
!assign (resid 11 and name hn)(resid 2 and name hb) 1.8 0.0 3.2
!assign (resid 11 and name hn)(resid 2 and name hg2#) 1.8 0.0 4.2
!assign (resid 11 and name hn)(resid 3 and name ha) 1.8 0.0 3.2
!assign (resid 11 and name hn)(resid 4 and name hg#) 1.8 0.0 4.2
!assign (resid 11 and name hn)(resid 4 and name hd#) 1.8 0.0 4.2
!assign (resid 11 and name hn)(resid 4 and name he#) 1.8 0.0 4.2
!assign (resid 11 and name hn)(resid 47 and name hg2#) 1.8 0.0 4.2

! R12
assign (resid 12 and name hn)(resid 9 and name ha) 1.8 0.0 4.2
assign (resid 12 and name hn)(resid 10 and name ha) 1.8 0.0 3.7
assign (resid 12 and name hn)(resid 11 and name ha) 1.8 0.0 2.2
assign (resid 12 and name hn)(resid 11 and name hb1) 1.8 0.0 3.2
assign (resid 12 and name hn)(resid 11 and name hb2) 1.8 0.0 3.2
assign (resid 12 and name hn)(resid 11 and name hg1) 1.8 0.0 4.2
assign (resid 12 and name hn)(resid 11 and name hg2) 1.8 0.0 4.2
assign (resid 12 and name hn)(resid 11 and name hd1) 1.8 0.0 4.2
assign (resid 12 and name hn)(resid 11 and name hd2) 1.8 0.0 4.2
assign (resid 12 and name hn)(resid 12 and name ha) 1.8 0.0 1.2
assign (resid 12 and name hn)(resid 12 and name hb1) 1.8 0.0 2.2
assign (resid 12 and name hn)(resid 12 and name hb2) 1.8 0.0 2.2
assign (resid 12 and name hn)(resid 12 and name hg1) 1.8 0.0 4.2
assign (resid 12 and name hn)(resid 12 and name hg2) 1.8 0.0 4.2
assign (resid 12 and name hn)(resid 12 and name hd1) 1.8 0.0 4.2
assign (resid 12 and name hn)(resid 12 and name hd2) 1.8 0.0 4.2

assign (resid 12 and name hn)(resid 11 and name hn) 1.8 0.0 3.2
assign (resid 12 and name hn)(resid 9 and name hb1) 1.8 0.0 4.2
assign (resid 12 and name hn)(resid 9 and name hb2) 1.8 0.0 4.2
assign (resid 12 and name hn)(resid 9 and name hd#) 1.8 0.0 3.2
assign (resid 12 and name hn)(resid 9 and name he#) 1.8 0.0 3.2
assign (resid 12 and name hn)(resid 19 and name hg#) 1.8 0.0 4.2 !!!

! K13

! F14

! P15

! Y16
assign (resid 16 and name hn)(resid 15 and name ha) 1.8 0.0 2.2
assign (resid 16 and name hn)(resid 15 and name hd1) 1.8 0.0 4.2
assign (resid 16 and name hn)(resid 15 and name hd2) 1.8 0.0 4.2
assign (resid 16 and name hn)(resid 16 and name ha) 1.8 0.0 1.2
assign (resid 16 and name hn)(resid 16 and name hb1) 1.8 0.0 2.2
assign (resid 16 and name hn)(resid 16 and name hb2) 1.8 0.0 2.2
assign (resid 16 and name hn)(resid 16 and name hd#) 1.8 0.0 3.2

assign (resid 16 and name hn)(resid 17 and name ha) 1.8 0.0 4.2
assign (resid 16 and name hn)(resid 17 and name hb1) 1.8 0.0 4.2
assign (resid 16 and name hn)(resid 17 and name hb2) 1.8 0.0 4.2

!assign (resid 16 and name hn)(resid 7 and name hg2#) 1.8 0.0 3.2
!assign (resid 16 and name hn)(resid 26 and name hg2#) 1.8 0.0 3.2
!assign (resid 16 and name hn)(resid 19 and name hg#) 1.8 0.0 4.2
!assign (resid 16 and name hn)(resid 24 and name ha) 1.8 0.0 3.2
!assign (resid 16 and name hn)(resid 25 and name ha) 1.8 0.0 4.2

assign (resid 16 and name hn)(resid 17 and name hn) 1.8 0.0 2.2
assign (resid 16 and name hn)(resid 18 and name hn) 1.8 0.0 3.2
!assign (resid 16 and name hn)(resid 24 and name hn) 1.8 0.0 4.2
assign (resid 16 and name hn)(resid 20 and name hn) 1.8 0.0 4.2
!assign (resid 16 and name hn)(resid 26 and name hn) 1.8 0.0 3.2


! K17
assign (resid 17 and name hn)(resid 16 and name ha) 1.8 0.0 2.2
assign (resid 17 and name hn)(resid 16 and name hb1) 1.8 0.0 3.2
assign (resid 17 and name hn)(resid 16 and name hb2) 1.8 0.0 3.2
assign (resid 17 and name hn)(resid 16 and name hd#) 1.8 0.0 4.2
assign (resid 17 and name hn)(resid 17 and name ha) 1.8 0.0 1.2
assign (resid 17 and name hn)(resid 17 and name hb1) 1.8 0.0 2.2
assign (resid 17 and name hn)(resid 17 and name hb2) 1.8 0.0 2.2

assign (resid 17 and name hn)(resid 15 and name ha) 1.8 0.0 4.2
!assign (resid 17 and name hn)(resid 24 and name ha) 1.8 0.0 4.2
!assign (resid 17 and name hn)(resid 25 and name ha) 1.8 0.0 4.2
!assign (resid 17 and name hn)(resid 36 and name hg2#) 1.8 0.0 4.2
!assign (resid 17 and name hn)(resid 36 and name hd1#) 1.8 0.0 4.2

assign (resid 17 and name hn)(resid 18 and name hn) 1.8 0.0 3.2
assign (resid 17 and name hn)(resid 20 and name ha) 1.8 0.0 4.2
!assign (resid 17 and name hn)(resid 24 and name hn) 1.8 0.0 4.2

! S18
assign (resid 18 and name hn)(resid 16 and name ha) 1.8 0.0 2.7
assign (resid 18 and name hn)(resid 16 and name hb1) 1.8 0.0 4.2
assign (resid 18 and name hn)(resid 16 and name hb2) 1.8 0.0 4.2
assign (resid 18 and name hn)(resid 17 and name ha) 1.8 0.0 2.2
assign (resid 18 and name hn)(resid 17 and name hb1) 1.8 0.0 3.2
assign (resid 18 and name hn)(resid 17 and name hb2) 1.8 0.0 3.2
assign (resid 18 and name hn)(resid 18 and name ha) 1.8 0.0 1.2
assign (resid 18 and name hn)(resid 18 and name hb1) 1.8 0.0 2.2
assign (resid 18 and name hn)(resid 18 and name hb2) 1.8 0.0 2.2

assign (resid 18 and name hn)(resid 16 and name hd#) 1.8 0.0 4.2

assign (resid 18 and name hn)(resid 20 and name hn) 1.8 0.0 2.7
assign (resid 18 and name ha)(resid 21 and name hb#) 1.8 0.0 2.2

! E19
assign (resid 19 and name hn)(resid 16 and name ha) 1.8 0.0 3.2
assign (resid 19 and name hn)(resid 18 and name ha) 1.8 0.0 2.2
assign (resid 19 and name hn)(resid 18 and name hb1) 1.8 0.0 3.2
assign (resid 19 and name hn)(resid 18 and name hb2) 1.8 0.0 3.2
assign (resid 19 and name hn)(resid 19 and name ha) 1.8 0.0 1.2
assign (resid 19 and name hn)(resid 19 and name hb1) 1.8 0.0 2.2
assign (resid 19 and name hn)(resid 19 and name hb2) 1.8 0.0 2.2
assign (resid 19 and name hn)(resid 19 and name hg#) 1.8 0.0 3.2
assign (resid 19 and name hn)(resid 20 and name hb1) 1.8 0.0 4.2
assign (resid 19 and name hn)(resid 20 and name hb2) 1.8 0.0 4.2

assign (resid 19 and name hn)(resid 20 and name hn) 1.8 0.0 1.2
assign (resid 19 and name hn)(resid 21 and name hn) 1.8 0.0 2.7
assign (resid 19 and name hn)(resid 22 and name hn) 1.8 0.0 3.7

assign (resid 19 and name ha)(resid 22 and name hb1) 1.8 0.0 2.2
assign (resid 19 and name ha)(resid 22 and name hb2) 1.8 0.0 2.2
assign (resid 19 and name ha)(resid 22 and name he#) 1.8 0.0 4.2

! C20
assign (resid 20 and name hn)(resid 19 and name ha) 1.8 0.0 2.2
assign (resid 20 and name hn)(resid 19 and name hb1) 1.8 0.0 2.2
assign (resid 20 and name hn)(resid 19 and name hb2) 1.8 0.0 2.2
assign (resid 20 and name hn)(resid 19 and name hg#) 1.8 0.0 3.2
assign (resid 20 and name hn)(resid 20 and name ha) 1.8 0.0 1.2
assign (resid 20 and name hn)(resid 20 and name hb1) 1.8 0.0 2.2
assign (resid 20 and name hn)(resid 20 and name hb2) 1.8 0.0 2.2

!assign (resid 20 and name hn)(resid 9 and name ha) 1.8 0.0 4.2 !!!
assign (resid 20 and name hn)(resid 16 and name ha) 1.8 0.0 4.2
assign (resid 20 and name hn)(resid 16 and name hd#) 1.8 0.0 4.2
assign (resid 20 and name hn)(resid 18 and name ha) 1.8 0.0 3.2
assign (resid 20 and name hn)(resid 21 and name ha) 1.8 0.0 4.2
assign (resid 20 and name hn)(resid 21 and name hb1) 1.8 0.0 3.2
assign (resid 20 and name hn)(resid 21 and name hb2) 1.8 0.0 3.2
assign (resid 20 and name hn)(resid 21 and name hd1#) 1.8 0.0 4.2
assign (resid 20 and name hn)(resid 21 and name hd2#) 1.8 0.0 4.2

assign (resid 20 and name hn)(resid 21 and name hn) 1.8 0.0 1.2
assign (resid 20 and name hn)(resid 22 and name hn) 1.8 0.0 2.7
assign (resid 20 and name hn)(resid 23 and name hn) 1.8 0.0 3.7
assign (resid 20 and name hn)(resid 41 and name ha) 1.8 0.0 4.2
assign (resid 20 and name hn)(resid 41 and name hb#) 1.8 0.0 4.2

assign (resid 20 and name ha)(resid 23 and name hb#) 1.8 0.0 2.7

! L21
assign (resid 21 and name hn)(resid 17 and name ha) 1.8 0.0 3.2
assign (resid 21 and name hn)(resid 18 and name ha) 1.8 0.0 2.2
assign (resid 21 and name hn)(resid 19 and name ha) 1.8 0.0 3.2
assign (resid 21 and name hn)(resid 19 and name hb#) 1.8 0.0 4.2
assign (resid 21 and name hn)(resid 20 and name ha) 1.8 0.0 2.2
assign (resid 21 and name hn)(resid 20 and name hb1) 1.8 0.0 2.2
assign (resid 21 and name hn)(resid 20 and name hb2) 1.8 0.0 2.2
assign (resid 21 and name hn)(resid 21 and name ha) 1.8 0.0 1.2
assign (resid 21 and name hn)(resid 21 and name hb1) 1.8 0.0 2.2
assign (resid 21 and name hn)(resid 21 and name hb2) 1.8 0.0 2.2
assign (resid 21 and name hn)(resid 21 and name hg) 1.8 0.0 4.2
assign (resid 21 and name hn)(resid 21 and name hd1#) 1.8 0.0 4.2
assign (resid 21 and name hn)(resid 21 and name hd2#) 1.8 0.0 4.2

assign (resid 21 and name hn)(resid 22 and name hb#) 1.8 0.0 4.2
assign (resid 21 and name hn)(resid 22 and name hn) 1.8 0.0 1.2
assign (resid 21 and name hn)(resid 23 and name hn) 1.8 0.0 2.7
assign (resid 21 and name hn)(resid 24 and name hn) 1.8 0.0 3.7

assign (resid 21 and name ha)(resid 24 and name hb1) 1.8 0.0 2.7
assign (resid 21 and name ha)(resid 24 and name hb2) 1.8 0.0 2.7

! K22
assign (resid 22 and name hn)(resid 21 and name ha) 1.8 0.0 2.2
assign (resid 22 and name hn)(resid 21 and name hb1) 1.8 0.0 3.2
assign (resid 22 and name hn)(resid 21 and name hb2) 1.8 0.0 3.2
assign (resid 22 and name hn)(resid 21 and name hg) 1.8 0.0 4.2
assign (resid 22 and name hn)(resid 21 and name hd1#) 1.8 0.0 4.2
assign (resid 22 and name hn)(resid 21 and name hd2#) 1.8 0.0 4.2
assign (resid 22 and name hn)(resid 22 and name ha) 1.8 0.0 1.2
assign (resid 22 and name hn)(resid 22 and name hb1) 1.8 0.0 2.2
assign (resid 22 and name hn)(resid 22 and name hb2) 1.8 0.0 2.2
assign (resid 22 and name hn)(resid 22 and name hg1) 1.8 0.0 3.2
assign (resid 22 and name hn)(resid 22 and name hg2) 1.8 0.0 3.2

assign (resid 22 and name hn)(resid 18 and name ha) 1.8 0.0 3.2
assign (resid 22 and name hn)(resid 19 and name ha) 1.8 0.0 2.2
assign (resid 22 and name hn)(resid 20 and name ha) 1.8 0.0 3.2
assign (resid 22 and name hn)(resid 23 and name ha) 1.8 0.0 4.2

assign (resid 22 and name hn)(resid 23 and name hn) 1.8 0.0 1.2
assign (resid 22 and name hn)(resid 24 and name hn) 1.8 0.0 2.7
assign (resid 22 and name hn)(resid 25 and name hn) 1.8 0.0 3.7

assign (resid 22 and name hn)(resid 25 and name hb#) 1.8 0.0 4.2

assign (resid 22 and name ha)(resid 25 and name hb#) 1.8 0.0 2.2

! A23
assign (resid 23 and name hn)(resid 22 and name ha) 1.8 0.0 2.2
assign (resid 23 and name hn)(resid 22 and name hb1) 1.8 0.0 3.2
assign (resid 23 and name hn)(resid 22 and name hb2) 1.8 0.0 3.2
assign (resid 23 and name hn)(resid 22 and name hg1) 1.8 0.0 4.2
assign (resid 23 and name hn)(resid 22 and name hg2) 1.8 0.0 4.2
assign (resid 23 and name hn)(resid 22 and name hd1) 1.8 0.0 4.2
assign (resid 23 and name hn)(resid 22 and name hd2) 1.8 0.0 4.2
assign (resid 23 and name hn)(resid 23 and name ha) 1.8 0.0 1.2
assign (resid 23 and name hn)(resid 23 and name hb#) 1.8 0.0 2.2

assign (resid 23 and name hn)(resid 19 and name ha) 1.8 0.0 3.2
assign (resid 23 and name hn)(resid 20 and name ha) 1.8 0.0 2.2
assign (resid 23 and name hn)(resid 20 and name hb#) 1.8 0.0 4.2
assign (resid 23 and name hn)(resid 21 and name ha) 1.8 0.0 3.2
assign (resid 23 and name hn)(resid 24 and name hn) 1.8 0.0 1.2
assign (resid 23 and name hn)(resid 24 and name ha) 1.8 0.0 4.2
assign (resid 23 and name hn)(resid 24 and name hb1) 1.8 0.0 4.2
assign (resid 23 and name hn)(resid 24 and name hb2) 1.8 0.0 4.2
assign (resid 23 and name hn)(resid 25 and name hn) 1.8 0.0 2.7
assign (resid 23 and name hn)(resid 26 and name hn) 1.8 0.0 3.7

assign (resid 23 and name hn)(resid 7 and name hg2#) 1.8 0.0 4.2
assign (resid 23 and name hn)(resid 25 and name hb#) 1.8 0.0 4.2

assign (resid 23 and name ha)(resid 26 and name hb) 1.8 0.0 2.2

! C24
assign (resid 24 and name hn)(resid 23 and name ha) 1.8 0.0 2.2
assign (resid 24 and name hn)(resid 23 and name hb#) 1.8 0.0 3.2
assign (resid 24 and name hn)(resid 24 and name ha) 1.8 0.0 1.2
assign (resid 24 and name hn)(resid 24 and name hb1) 1.8 0.0 3.2
assign (resid 24 and name hn)(resid 24 and name hb2) 1.8 0.0 3.2

assign (resid 24 and name hn)(resid 7 and name hg2#) 1.8 0.0 3.2
assign (resid 24 and name hn)(resid 25 and name ha) 1.8 0.0 4.2
assign (resid 24 and name hn)(resid 25 and name hb#) 1.8 0.0 3.2
assign (resid 24 and name hn)(resid 36 and name hg1#) 1.8 0.0 4.2
assign (resid 24 and name hn)(resid 36 and name hg2#) 1.8 0.0 4.2
assign (resid 24 and name hn)(resid 36 and name hd1#) 1.8 0.0 4.2

assign (resid 24 and name hn)(resid 20 and name ha) 1.8 0.0 3.2
assign (resid 24 and name hn)(resid 21 and name ha) 1.8 0.0 2.2
assign (resid 24 and name hn)(resid 21 and name hb#) 1.8 0.0 4.2
assign (resid 24 and name hn)(resid 21 and name hd1#) 1.8 0.0 4.2
assign (resid 24 and name hn)(resid 21 and name hd2#) 1.8 0.0 4.2
assign (resid 24 and name hn)(resid 22 and name ha) 1.8 0.0 3.2
assign (resid 24 and name hn)(resid 22 and name hb#) 1.8 0.0 4.2
assign (resid 24 and name hn)(resid 25 and name hn) 1.8 0.0 1.2
assign (resid 24 and name hn)(resid 26 and name hn) 1.8 0.0 2.7
assign (resid 24 and name hn)(resid 26 and name hb) 1.8 0.0 4.2
assign (resid 24 and name hn)(resid 27 and name hn) 1.8 0.0 3.7
assign (resid 24 and name hn)(resid 27 and name hb#) 1.8 0.0 4.2

assign (resid 24 and name ha)(resid 27 and name hb#) 1.8 0.0 2.2
assign (resid 24 and name ha)(resid 36 and name hd1#) 1.8 0.0 4.2
assign (resid 24 and name hb1)(resid 36 and name hd1#) 1.8 0.0 4.2
assign (resid 24 and name hb2)(resid 36 and name hd1#) 1.8 0.0 4.2

! A25
assign (resid 25 and name hn)(resid 5 and name hd1) 1.8 0.0 4.2
assign (resid 25 and name hn)(resid 5 and name hd2) 1.8 0.0 4.2
assign (resid 25 and name hn)(resid 5 and name he#) 1.8 0.0 4.2

assign (resid 25 and name hn)(resid 7 and name hg2#) 1.8 0.0 4.2

assign (resid 25 and name hn)(resid 22 and name hb#) 1.8 0.0 4.2 !!!
assign (resid 25 and name hn)(resid 22 and name hg#) 1.8 0.0 4.2 !!!

assign (resid 25 and name hn)(resid 24 and name ha) 1.8 0.0 2.2
assign (resid 25 and name hn)(resid 24 and name hb1) 1.8 0.0 3.2
assign (resid 25 and name hn)(resid 24 and name hb2) 1.8 0.0 3.2
assign (resid 25 and name hn)(resid 25 and name ha) 1.8 0.0 1.2
assign (resid 25 and name hn)(resid 25 and name hb#) 1.8 0.0 2.2

assign (resid 25 and name hn)(resid 26 and name hb) 1.8 0.0 4.2
assign (resid 25 and name hn)(resid 36 and name hb) 1.8 0.0 4.2
assign (resid 25 and name hn)(resid 36 and name hg1#) 1.8 0.0 4.2
assign (resid 25 and name hn)(resid 36 and name hg2#) 1.8 0.0 4.2
assign (resid 25 and name hn)(resid 36 and name hd1#) 1.8 0.0 4.2
assign (resid 25 and name ha)(resid 36 and name hg1#) 1.8 0.0 4.2
assign (resid 25 and name ha)(resid 36 and name hg2#) 1.8 0.0 3.7
assign (resid 25 and name ha)(resid 36 and name hd1#) 1.8 0.0 3.2
assign (resid 25 and name ha)(resid 35 and name hb#) 1.8 0.0 4.2

assign (resid 25 and name hn)(resid 21 and name ha) 1.8 0.0 3.2
assign (resid 25 and name hn)(resid 22 and name ha) 1.8 0.0 2.2
assign (resid 25 and name hn)(resid 23 and name ha) 1.8 0.0 3.2
assign (resid 25 and name hn)(resid 26 and name hn) 1.8 0.0 1.2
assign (resid 25 and name hn)(resid 27 and name hn) 1.8 0.0 3.2
assign (resid 25 and name hn)(resid 27 and name hb#) 1.8 0.0 4.2
assign (resid 25 and name hn)(resid 35 and name hn) 1.8 0.0 4.2

! T26
assign (resid 26 and name hn)(resid 25 and name ha) 1.8 0.0 2.2
assign (resid 26 and name hn)(resid 25 and name hb#) 1.8 0.0 3.2
assign (resid 26 and name hn)(resid 26 and name ha) 1.8 0.0 1.2
assign (resid 26 and name hn)(resid 26 and name hb) 1.8 0.0 2.2
assign (resid 26 and name hn)(resid 26 and name hg2#) 1.8 0.0 3.2

assign (resid 26 and name hn)(resid 22 and name ha) 1.8 0.0 3.2
assign (resid 26 and name hn)(resid 23 and name ha) 1.8 0.0 2.2
assign (resid 26 and name hn)(resid 23 and name hb#) 1.8 0.0 4.2
assign (resid 26 and name hn)(resid 24 and name ha) 1.8 0.0 3.2
assign (resid 26 and name hn)(resid 27 and name ha) 1.8 0.0 4.2
assign (resid 26 and name hn)(resid 27 and name hb1) 1.8 0.0 4.2
assign (resid 26 and name hn)(resid 27 and name hb2) 1.8 0.0 4.2

assign (resid 26 and name hn)(resid 27 and name hn) 1.8 0.0 3.2
assign (resid 26 and name hn)(resid 36 and name hg2#) 1.8 0.0 4.2
assign (resid 26 and name hn)(resid 36 and name hd1#) 1.8 0.0 4.2

! S27
assign (resid 27 and name hn)(resid 26 and name ha) 1.8 0.0 2.2
assign (resid 27 and name hn)(resid 26 and name hb) 1.8 0.0 3.2
assign (resid 27 and name hn)(resid 26 and name hg2#) 1.8 0.0 3.2
assign (resid 27 and name hn)(resid 27 and name ha) 1.8 0.0 1.2
assign (resid 27 and name hn)(resid 27 and name hb1) 1.8 0.0 2.2
assign (resid 27 and name hn)(resid 27 and name hb2) 1.8 0.0 2.2

assign (resid 27 and name hn)(resid 23 and name ha) 1.8 0.0 3.2
assign (resid 27 and name hn)(resid 24 and name ha) 1.8 0.0 2.2
assign (resid 27 and name hn)(resid 25 and name ha) 1.8 0.0 3.2
assign (resid 27 and name hn)(resid 25 and name hb#) 1.8 0.0 4.2
assign (resid 27 and name hn)(resid 28 and name hb1) 1.8 0.0 4.2
assign (resid 27 and name hn)(resid 28 and name hb2) 1.8 0.0 4.2

assign (resid 27 and name hn)(resid 36 and name hg2#) 1.8 0.0 4.2
assign (resid 27 and name hn)(resid 36 and name hd1#) 1.8 0.0 4.2

assign (resid 27 and name hn)(resid 28 and name hn) 1.8 0.0 3.2
assign (resid 27 and name hn)(resid 29 and name hn) 1.8 0.0 4.2

! F28
assign (resid 28 and name hn)(resid 27 and name ha) 1.8 0.0 2.2
assign (resid 28 and name hn)(resid 27 and name hb1) 1.8 0.0 3.2
assign (resid 28 and name hn)(resid 27 and name hb2) 1.8 0.0 3.2
assign (resid 28 and name hn)(resid 28 and name ha) 1.8 0.0 1.2
assign (resid 28 and name hn)(resid 28 and name hb1) 1.8 0.0 2.2
assign (resid 28 and name hn)(resid 28 and name hb2) 1.8 0.0 2.2

assign (resid 28 and name hn)(resid 26 and name ha) 1.8 0.0 4.2
assign (resid 28 and name hn)(resid 25 and name ha) 1.8 0.0 3.2
assign (resid 28 and name hn)(resid 25 and name hb#) 1.8 0.0 4.2

assign (resid 28 and name hn)(resid 29 and name hn) 1.8 0.0 3.2

! T29
assign (resid 29 and name hn)(resid 35 and name hd#) 1.8 0.0 4.2
assign (resid 29 and name hn)(resid 30 and name hn) 1.8 0.0 4.2
assign (resid 29 and name hn)(resid 31 and name hn) 1.8 0.0 4.2

! G30

! G31

! D32
assign (resid 32 and name hn)(resid 30 and name hn) 1.8 0.0 4.2

! E33
assign (resid 33 and name ha)(resid 36 and name hb) 1.8 0.0 2.7
assign (resid 33 and name hn)(resid 34 and name hb#) 1.8 0.0 4.2

! S34
assign (resid 34 and name hn)(resid 33 and name ha) 1.8 0.0 2.2
assign (resid 34 and name hn)(resid 33 and name hb1) 1.8 0.0 3.2
assign (resid 34 and name hn)(resid 33 and name hb2) 1.8 0.0 3.2
assign (resid 34 and name hn)(resid 33 and name hg1) 1.8 0.0 4.2
assign (resid 34 and name hn)(resid 33 and name hg2) 1.8 0.0 4.2
assign (resid 34 and name hn)(resid 34 and name ha) 1.8 0.0 1.2
assign (resid 34 and name hn)(resid 34 and name hb1) 1.8 0.0 2.2
assign (resid 34 and name hn)(resid 34 and name hb2) 1.8 0.0 2.2

assign (resid 34 and name hn)(resid 33 and name hn) 1.8 0.0 3.2
assign (resid 34 and name hn)(resid 35 and name hn) 1.8 0.0 3.2
assign (resid 34 and name hn)(resid 35 and name hd#) 1.8 0.0 4.2
assign (resid 34 and name hn)(resid 35 and name hb#) 1.8 0.0 4.2
assign (resid 34 and name hn)(resid 36 and name hn) 1.8 0.0 4.2
assign (resid 34 and name hn)(resid 37 and name hb#) 1.8 0.0 4.2
assign (resid 34 and name hn)(resid 37 and name hg#) 1.8 0.0 4.2

! R35
assign (resid 35 and name hn)(resid 34 and name ha) 1.8 0.0 1.2
assign (resid 35 and name hn)(resid 34 and name hb1) 1.8 0.0 2.7
assign (resid 35 and name hn)(resid 34 and name hb2) 1.8 0.0 2.7
assign (resid 35 and name hn)(resid 35 and name ha) 1.8 0.0 1.2
assign (resid 35 and name hn)(resid 35 and name hb1) 1.8 0.0 2.2
assign (resid 35 and name hn)(resid 35 and name hb2) 1.8 0.0 2.2
assign (resid 35 and name hn)(resid 35 and name hg1) 1.8 0.0 4.2
assign (resid 35 and name hn)(resid 35 and name hg2) 1.8 0.0 4.2
assign (resid 35 and name hn)(resid 35 and name hd1) 1.8 0.0 4.2
assign (resid 35 and name hn)(resid 35 and name hd2) 1.8 0.0 4.2

assign (resid 35 and name hn)(resid 3 and name hg2#) 1.8 0.0 4.2
assign (resid 35 and name hn)(resid 3 and name hd1#) 1.8 0.0 4.2
assign (resid 35 and name hn)(resid 33 and name ha) 1.8 0.0 4.2
assign (resid 35 and name hn)(resid 36 and name ha) 1.8 0.0 3.2
assign (resid 35 and name hn)(resid 36 and name hg2#) 1.8 0.0 4.2
assign (resid 35 and name hn)(resid 36 and name hd1#) 1.8 0.0 4.2
assign (resid 35 and name hn)(resid 49 and name ha) 1.8 0.0 4.2
assign (resid 35 and name hn)(resid 50 and name ha) 1.8 0.0 4.2

assign (resid 35 and name hn)(resid 3 and name hn) 1.8 0.0 3.2
assign (resid 35 and name hn)(resid 5 and name hg#) 1.8 0.0 4.2
assign (resid 35 and name hn)(resid 36 and name hn) 1.8 0.0 3.2
assign (resid 35 and name hn)(resid 37 and name hn) 1.8 0.0 3.2
!assign (resid 35 and name hn)(resid 48 and name hn) 1.8 0.0 4.2
!assign (resid 35 and name hn)(resid 50 and name hn) 1.8 0.0 3.2
assign (resid 35 and name hn)(resid 51 and name hn) 1.8 0.0 4.2
assign (resid 35 and name hn)(resid 50 and name hb1) 1.8 0.0 3.2
assign (resid 35 and name hn)(resid 50 and name hb2) 1.8 0.0 3.2
assign (resid 35 and name hn)(resid 52 and name hg2#) 1.8 0.0 3.2

assign (resid 35 and name he)(resid 36 and name hg2#) 1.8 0.0 4.2
assign (resid 35 and name he)(resid 52 and name hg2#) 1.8 0.0 4.2
assign (resid 35 and name he)(resid 51 and name hn) 1.8 0.0 4.2

! I36
assign (resid 36 and name hn)(resid 5 and name hg#) 1.8 0.0 4.2
assign (resid 36 and name hn)(resid 33 and name ha) 1.8 0.0 2.2
assign (resid 36 and name hn)(resid 34 and name ha) 1.8 0.0 3.2
assign (resid 36 and name hn)(resid 34 and name hb#) 1.8 0.0 4.2
assign (resid 36 and name hn)(resid 35 and name ha) 1.8 0.0 2.2
assign (resid 36 and name hn)(resid 35 and name hb1) 1.8 0.0 3.2
assign (resid 36 and name hn)(resid 35 and name hb2) 1.8 0.0 3.2
assign (resid 36 and name hn)(resid 35 and name hg1) 1.8 0.0 4.2
assign (resid 36 and name hn)(resid 35 and name hg2) 1.8 0.0 4.2
assign (resid 36 and name hn)(resid 35 and name hd#) 1.8 0.0 4.2
assign (resid 36 and name hn)(resid 36 and name ha) 1.8 0.0 1.2
assign (resid 36 and name hn)(resid 36 and name hb) 1.8 0.0 3.2
assign (resid 36 and name hn)(resid 36 and name hg1#) 1.8 0.0 3.2
assign (resid 36 and name hn)(resid 36 and name hg2#) 1.8 0.0 4.2
assign (resid 36 and name hn)(resid 36 and name hd1#) 1.8 0.0 4.2

assign (resid 36 and name hn)(resid 37 and name ha) 1.8 0.0 4.2
assign (resid 36 and name hn)(resid 37 and name hb1) 1.8 0.0 4.2
assign (resid 36 and name hn)(resid 37 and name hb2) 1.8 0.0 4.2
assign (resid 36 and name hn)(resid 37 and name hg#) 1.8 0.0 4.2

! Q37
assign (resid 37 and name hn)(resid 34 and name ha) 1.8 0.0 3.2
assign (resid 37 and name hn)(resid 36 and name ha) 1.8 0.0 2.2
assign (resid 37 and name hn)(resid 36 and name hb) 1.8 0.0 3.2
assign (resid 37 and name hn)(resid 36 and name hg1#) 1.8 0.0 4.2
assign (resid 37 and name hn)(resid 36 and name hg2#) 1.8 0.0 4.2
assign (resid 37 and name hn)(resid 36 and name hd1#) 1.8 0.0 4.2

assign (resid 37 and name hn)(resid 37 and name ha) 1.8 0.0 1.2
assign (resid 37 and name hn)(resid 37 and name hb1) 1.8 0.0 2.2
assign (resid 37 and name hn)(resid 37 and name hb2) 1.8 0.0 2.2
assign (resid 37 and name hn)(resid 37 and name hg1) 1.8 0.0 3.2
assign (resid 37 and name hn)(resid 37 and name hg2) 1.8 0.0 3.2

assign (resid 37 and name hn)(resid 25 and name hb#) 1.8 0.0 4.2
assign (resid 37 and name hn)(resid 35 and name hb#) 1.8 0.0 4.2

assign (resid 37 and name hn)(resid 34 and name hn) 1.8 0.0 4.2
assign (resid 37 and name hn)(resid 36 and name hn) 1.8 0.0 3.2
assign (resid 37 and name hn)(resid 38 and name hn) 1.8 0.0 2.2

! E38
assign (resid 38 and name hn)(resid 37 and name ha) 1.8 0.0 2.2
assign (resid 38 and name hn)(resid 37 and name hb1) 1.8 0.0 3.2
assign (resid 38 and name hn)(resid 37 and name hb2) 1.8 0.0 3.2
assign (resid 38 and name hn)(resid 37 and name hg1) 1.8 0.0 3.2
assign (resid 38 and name hn)(resid 37 and name hg2) 1.8 0.0 3.2
assign (resid 38 and name hn)(resid 38 and name ha) 1.8 0.0 1.2
assign (resid 38 and name hn)(resid 38 and name hb1) 1.8 0.0 2.2
assign (resid 38 and name hn)(resid 38 and name hb2) 1.8 0.0 2.2
assign (resid 38 and name hn)(resid 38 and name hg1) 1.8 0.0 3.2
assign (resid 38 and name hn)(resid 38 and name hg2) 1.8 0.0 3.2

assign (resid 38 and name hn)(resid 36 and name ha) 1.8 0.0 3.2
assign (resid 38 and name hn)(resid 36 and name hg2#) 1.8 0.0 4.2
assign (resid 38 and name hn)(resid 36 and name hd1#) 1.8 0.0 4.2
assign (resid 38 and name hn)(resid 48 and name ha) 1.8 0.0 4.2
assign (resid 38 and name hn)(resid 48 and name hb#) 1.8 0.0 4.2
assign (resid 38 and name hn)(resid 49 and name ha) 1.8 0.0 4.2
assign (resid 38 and name hn)(resid 49 and name hb1) 1.8 0.0 4.2
assign (resid 38 and name hn)(resid 49 and name hb2) 1.8 0.0 4.2
assign (resid 38 and name hn)(resid 50 and name ha) 1.8 0.0 3.2

assign (resid 38 and name hn)(resid 39 and name hn) 1.8 0.0 3.2
assign (resid 38 and name hn)(resid 49 and name hn) 1.8 0.0 2.2

! G39
assign (resid 39 and name hn)(resid 38 and name ha) 1.8 0.0 1.2
assign (resid 39 and name hn)(resid 38 and name hb1) 1.8 0.0 2.2
assign (resid 39 and name hn)(resid 38 and name hb2) 1.8 0.0 2.2
assign (resid 39 and name hn)(resid 38 and name hg#) 1.8 0.0 3.2
assign (resid 39 and name hn)(resid 39 and name ha1) 1.8 0.0 1.2
assign (resid 39 and name hn)(resid 39 and name ha2) 1.8 0.0 1.2

assign (resid 39 and name hn)(resid 21 and name hd1#) 1.8 0.0 4.2
assign (resid 39 and name hn)(resid 21 and name hd2#) 1.8 0.0 4.2
assign (resid 39 and name hn)(resid 36 and name hg2#) 1.8 0.0 4.2
assign (resid 39 and name hn)(resid 36 and name hb) 1.8 0.0 4.2
assign (resid 39 and name hn)(resid 40 and name hn) 1.8 0.0 4.2

! K40
assign (resid 40 and name hn)(resid 38 and name hg#) 1.8 0.0 4.2
assign (resid 40 and name hn)(resid 39 and name ha1) 1.8 0.0 1.2
assign (resid 40 and name hn)(resid 39 and name ha2) 1.8 0.0 1.2
assign (resid 40 and name hn)(resid 40 and name ha) 1.8 0.0 1.2
assign (resid 40 and name hn)(resid 40 and name hb1) 1.8 0.0 2.2
assign (resid 40 and name hn)(resid 40 and name hb2) 1.8 0.0 2.2
assign (resid 40 and name hn)(resid 40 and name hg1) 1.8 0.0 3.2
assign (resid 40 and name hn)(resid 40 and name hg2) 1.8 0.0 3.2

assign (resid 40 and name hn)(resid 46 and name ha) 1.8 0.0 4.2
assign (resid 40 and name hn)(resid 46 and name hb#) 1.8 0.0 4.2
assign (resid 40 and name hn)(resid 47 and name hb) 1.8 0.0 4.2
assign (resid 40 and name hn)(resid 47 and name hg2#) 1.8 0.0 4.2
assign (resid 40 and name hn)(resid 48 and name ha) 1.8 0.0 1.2

assign (resid 40 and name hn)(resid 47 and name hn) 1.8 0.0 2.7
assign (resid 40 and name hn)(resid 49 and name hn) 1.8 0.0 2.7
assign (resid 40 and name hn)(resid 49 and name he#) 1.8 0.0 4.2

! P41
assign (resid 41 and name ha)(resid 20 and name hb#) 1.8 0.0 2.7

! G42
assign (resid 42 and name hn)(resid 41 and name ha) 1.8 0.0 1.2
assign (resid 42 and name hn)(resid 41 and name hb1) 1.8 0.0 2.2
assign (resid 42 and name hn)(resid 41 and name hb2) 1.8 0.0 2.2
assign (resid 42 and name hn)(resid 41 and name hg1) 1.8 0.0 3.2
assign (resid 42 and name hn)(resid 41 and name hg2) 1.8 0.0 3.2
assign (resid 42 and name hn)(resid 41 and name hd1) 1.8 0.0 4.2
assign (resid 42 and name hn)(resid 41 and name hd2) 1.8 0.0 4.2
assign (resid 42 and name hn)(resid 42 and name ha1) 1.8 0.0 1.2
assign (resid 42 and name hn)(resid 42 and name ha2) 1.8 0.0 1.2

assign (resid 42 and name hn)(resid 46 and name ha) 1.8 0.0 1.2
assign (resid 42 and name hn)(resid 46 and name hn) 1.8 0.0 4.2
assign (resid 42 and name hn)(resid 43 and name hn) 1.8 0.0 3.2
assign (resid 42 and name hn)(resid 45 and name hn) 1.8 0.0 2.7
assign (resid 42 and name hn)(resid 47 and name hn) 1.8 0.0 2.7

! F43
assign (resid 43 and name hn)(resid 42 and name ha1) 1.8 0.0 2.2
assign (resid 43 and name hn)(resid 42 and name ha2) 1.8 0.0 2.2
assign (resid 43 and name hn)(resid 43 and name ha) 1.8 0.0 1.2
assign (resid 43 and name hn)(resid 43 and name hb1) 1.8 0.0 3.2
assign (resid 43 and name hn)(resid 43 and name hb2) 1.8 0.0 3.2

assign (resid 43 and name hn)(resid 44 and name hn) 1.8 0.0 3.2
assign (resid 43 and name hn)(resid 45 and name hd#) 1.8 0.0 4.2

! F44
assign (resid 44 and name hn)(resid 10 and name hg#) 1.8 0.0 4.2
assign (resid 44 and name hn)(resid 11 and name hb#) 1.8 0.0 4.2
assign (resid 44 and name hn)(resid 43 and name ha) 1.8 0.0 1.2
assign (resid 44 and name hn)(resid 43 and name hb1) 1.8 0.0 3.2
assign (resid 44 and name hn)(resid 43 and name hb2) 1.8 0.0 3.2
assign (resid 44 and name hn)(resid 44 and name ha) 1.8 0.0 1.2
assign (resid 44 and name hn)(resid 44 and name hb1) 1.8 0.0 2.2
assign (resid 44 and name hn)(resid 44 and name hb2) 1.8 0.0 2.2

!assign (resid 44 and name hn)(resid 3 and name hb) 1.8 0.0 3.2
!assign (resid 44 and name hn)(resid 25 and name hb#) 1.8 0.0 4.2

assign (resid 44 and name hn)(resid 45 and name hn) 1.8 0.0 2.7
assign (resid 44 and name hn)(resid 9 and name he#) 1.8 0.0 4.2
assign (resid 44 and name hn)(resid 12 and name hn) 1.8 0.0 4.2

! K45
assign (resid 45 and name hn)(resid 11 and name hb#) 1.8 0.0 4.2
assign (resid 45 and name hn)(resid 44 and name ha) 1.8 0.0 1.7
assign (resid 45 and name hn)(resid 44 and name hb1) 1.8 0.0 2.7
assign (resid 45 and name hn)(resid 44 and name hb2) 1.8 0.0 2.7
assign (resid 45 and name hn)(resid 45 and name ha) 1.8 0.0 1.2
assign (resid 45 and name hn)(resid 45 and name hb1) 1.8 0.0 2.2
assign (resid 45 and name hn)(resid 45 and name hb2) 1.8 0.0 2.2
assign (resid 45 and name hn)(resid 45 and name hg1) 1.8 0.0 3.2
assign (resid 45 and name hn)(resid 45 and name hg2) 1.8 0.0 3.2
assign (resid 45 and name hn)(resid 45 and name hd1) 1.8 0.0 4.2
assign (resid 45 and name hn)(resid 45 and name hd2) 1.8 0.0 4.2

assign (resid 45 and name hn)(resid 9 and name hb1) 1.8 0.0 4.2
assign (resid 45 and name hn)(resid 9 and name hb2) 1.8 0.0 4.2
assign (resid 45 and name hn)(resid 42 and name ha1) 1.8 0.0 4.2
assign (resid 45 and name hn)(resid 42 and name ha2) 1.8 0.0 4.2
assign (resid 45 and name hn)(resid 43 and name ha) 1.8 0.0 3.2

assign (resid 45 and name hn)(resid 9 and name hn) 1.8 0.0 4.2
assign (resid 45 and name hn)(resid 43 and name hn) 1.8 0.0 4.2

! C46
assign (resid 46 and name hn)(resid 45 and name ha) 1.8 0.0 2.2
assign (resid 46 and name hn)(resid 45 and name hb1) 1.8 0.0 2.2
assign (resid 46 and name hn)(resid 45 and name hb2) 1.8 0.0 2.2
assign (resid 46 and name hn)(resid 45 and name hg1) 1.8 0.0 3.2
assign (resid 46 and name hn)(resid 45 and name hg2) 1.8 0.0 3.2
assign (resid 46 and name hn)(resid 45 and name hd1) 1.8 0.0 4.2
assign (resid 46 and name hn)(resid 45 and name hd2) 1.8 0.0 4.2
assign (resid 46 and name hn)(resid 46 and name ha) 1.8 0.0 1.2
assign (resid 46 and name hn)(resid 46 and name hb1) 1.8 0.0 2.2
assign (resid 46 and name hn)(resid 46 and name hb2) 1.8 0.0 2.2

assign (resid 46 and name hn)(resid 6 and name ha) 1.8 0.0 4.2
assign (resid 46 and name hn)(resid 7 and name hg2#) 1.8 0.0 4.2
assign (resid 46 and name hn)(resid 8 and name ha) 1.8 0.0 2.2
assign (resid 46 and name hn)(resid 9 and name hb1) 1.8 0.0 4.2
assign (resid 46 and name hn)(resid 9 and name hb2) 1.8 0.0 4.2
assign (resid 46 and name hn)(resid 45 and name hn) 1.8 0.0 3.2
assign (resid 46 and name hn)(resid 47 and name hn) 1.8 0.0 4.2

! T47
assign (resid 47 and name hn)(resid 46 and name ha) 1.8 0.0 1.2
assign (resid 47 and name hn)(resid 46 and name hb1) 1.8 0.0 3.2
assign (resid 47 and name hn)(resid 46 and name hb2) 1.8 0.0 3.2
assign (resid 47 and name hn)(resid 47 and name ha) 1.8 0.0 1.2
assign (resid 47 and name hn)(resid 47 and name hb) 1.8 0.0 2.2
assign (resid 47 and name hn)(resid 47 and name hg2#) 1.8 0.0 3.2

assign (resid 47 and name hn)(resid 6 and name ha) 1.8 0.0 4.2
assign (resid 47 and name hn)(resid 7 and name hg2#) 1.8 0.0 4.2
assign (resid 47 and name hn)(resid 40 and name ha) 1.8 0.0 4.2
assign (resid 47 and name hn)(resid 40 and name hb1) 1.8 0.0 4.2
assign (resid 47 and name hn)(resid 40 and name hb2) 1.8 0.0 4.2
assign (resid 47 and name hn)(resid 40 and name hg#) 1.8 0.0 4.2
assign (resid 47 and name hn)(resid 41 and name ha) 1.8 0.0 2.2

assign (resid 47 and name hn)(resid 40 and name hn) 1.8 0.0 2.7
assign (resid 47 and name hn)(resid 42 and name hn) 1.8 0.0 2.7

assign (resid 47 and name hb)(resid 40 and name hb1) 1.8 0.0 4.2
assign (resid 47 and name hb)(resid 40 and name hb2) 1.8 0.0 4.2

! C48
assign (resid 48 and name hn)(resid 47 and name ha) 1.8 0.0 1.2
assign (resid 48 and name hn)(resid 47 and name hb) 1.8 0.0 3.2
assign (resid 48 and name hn)(resid 47 and name hg2#) 1.8 0.0 3.2
assign (resid 48 and name hn)(resid 48 and name ha) 1.8 0.0 1.2
assign (resid 48 and name hn)(resid 48 and name hb1) 1.8 0.0 2.2
assign (resid 48 and name hn)(resid 48 and name hb2) 1.8 0.0 2.2

assign (resid 48 and name hn)(resid 4 and name ha) 1.8 0.0 4.2
assign (resid 48 and name hn)(resid 5 and name ha) 1.8 0.0 4.2
assign (resid 48 and name hn)(resid 5 and name hg#) 1.8 0.0 4.2
assign (resid 48 and name hn)(resid 6 and name ha) 1.8 0.0 2.2
assign (resid 48 and name hn)(resid 6 and name hb1) 1.8 0.0 4.2
assign (resid 48 and name hn)(resid 6 and name hb2) 1.8 0.0 4.2
assign (resid 48 and name hn)(resid 6 and name hn) 1.8 0.0 4.2
assign (resid 48 and name hn)(resid 7 and name hg2#) 1.8 0.0 4.2
assign (resid 48 and name hn)(resid 47 and name hn) 1.8 0.0 3.2
assign (resid 48 and name hn)(resid 49 and name hn) 1.8 0.0 3.2

assign (resid 48 and name ha)(resid 39 and name ha#) 1.8 0.0 3.2
assign (resid 48 and name ha)(resid 36 and name hg2#) 1.8 0.0 4.2

! Y49
assign (resid 49 and name hn)(resid 48 and name ha) 1.8 0.0 1.2
assign (resid 49 and name hn)(resid 48 and name hb1) 1.8 0.0 3.2
assign (resid 49 and name hn)(resid 48 and name hb2) 1.8 0.0 3.2
assign (resid 49 and name hn)(resid 49 and name ha) 1.8 0.0 1.2
assign (resid 49 and name hn)(resid 49 and name hb1) 1.8 0.0 2.2
assign (resid 49 and name hn)(resid 49 and name hb2) 1.8 0.0 2.2
assign (resid 49 and name hn)(resid 50 and name ha) 1.8 0.0 3.2

assign (resid 49 and name hn)(resid 5 and name hg#) 1.8 0.0 4.2
assign (resid 49 and name hn)(resid 5 and name hd#) 1.8 0.0 4.2
assign (resid 49 and name hn)(resid 38 and name ha) 1.8 0.0 4.2
assign (resid 49 and name hn)(resid 38 and name hb1) 1.8 0.0 4.2
assign (resid 49 and name hn)(resid 38 and name hb2) 1.8 0.0 4.2
assign (resid 49 and name hn)(resid 39 and name ha1) 1.8 0.0 2.2
assign (resid 49 and name hn)(resid 39 and name ha2) 1.8 0.0 2.2
assign (resid 49 and name hn)(resid 39 and name hn) 1.8 0.0 4.2
assign (resid 49 and name hn)(resid 40 and name hg1) 1.8 0.0 4.2
assign (resid 49 and name hn)(resid 40 and name hg2) 1.8 0.0 4.2

assign (resid 49 and name hn)(resid 50 and name hn) 1.8 0.0 3.2
assign (resid 49 and name hn)(resid 51 and name hn) 1.8 0.0 3.7

assign (resid 49 and name ha)(resid 2 and name hg2#) 1.8 0.0 4.2
assign (resid 49 and name ha)(resid 3 and name hd1#) 1.8 0.0 4.2

! F50
assign (resid 50 and name hn)(resid 49 and name ha) 1.8 0.0 1.2
assign (resid 50 and name hn)(resid 49 and name hb1) 1.8 0.0 3.2
assign (resid 50 and name hn)(resid 49 and name hb2) 1.8 0.0 3.2
assign (resid 50 and name hn)(resid 49 and name hd#) 1.8 0.0 4.2
assign (resid 50 and name hn)(resid 49 and name he#) 1.8 0.0 4.2
assign (resid 50 and name hn)(resid 50 and name ha) 1.8 0.0 1.2
assign (resid 50 and name hn)(resid 50 and name hb1) 1.8 0.0 2.2
assign (resid 50 and name hn)(resid 50 and name hb2) 1.8 0.0 2.2

assign (resid 50 and name hn)(resid 2 and name ha) 1.8 0.0 4.2
assign (resid 50 and name hn)(resid 4 and name ha) 1.8 0.0 3.2
assign (resid 50 and name hn)(resid 2 and name hg1#) 1.8 0.0 4.2
assign (resid 50 and name hn)(resid 2 and name hg2#) 1.8 0.0 4.2
assign (resid 50 and name hn)(resid 3 and name hg2#) 1.8 0.0 4.2
assign (resid 50 and name hn)(resid 3 and name hd1#) 1.8 0.0 4.2

assign (resid 50 and name ha)(resid 35 and name hn) 1.8 0.0 3.2
assign (resid 50 and name ha)(resid 36 and name ha) 1.8 0.0 3.2
assign (resid 50 and name ha)(resid 36 and name hd1#) 1.8 0.0 4.2
assign (resid 50 and name ha)(resid 36 and name hg2#) 1.8 0.0 4.2
assign (resid 50 and name hb1)(resid 36 and name hd1#) 1.8 0.0 4.2
assign (resid 50 and name hb2)(resid 36 and name hd1#) 1.8 0.0 4.2
assign (resid 50 and name ha)(resid 37 and name ha) 1.8 0.0 4.2
assign (resid 50 and name ha)(resid 37 and name hb1) 1.8 0.0 4.2
assign (resid 50 and name ha)(resid 37 and name hb2) 1.8 0.0 4.2
assign (resid 50 and name ha)(resid 37 and name hn) 1.8 0.0 3.2
assign (resid 50 and name ha)(resid 52 and name hg2#) 1.8 0.0 4.2

! T51
assign (resid 51 and name hn)(resid 50 and name ha) 1.8 0.0 2.2
assign (resid 51 and name hn)(resid 50 and name hb1) 1.8 0.0 3.2
assign (resid 51 and name hn)(resid 50 and name hb2) 1.8 0.0 3.2
assign (resid 51 and name hn)(resid 51 and name ha) 1.8 0.0 1.2
assign (resid 51 and name hn)(resid 51 and name hb) 1.8 0.0 2.2
assign (resid 51 and name hn)(resid 51 and name hg2#) 1.8 0.0 3.2

assign (resid 51 and name hn)(resid 36 and name ha) 1.8 0.0 4.2
assign (resid 51 and name hn)(resid 36 and name hg2#) 1.8 0.0 3.2
assign (resid 51 and name hn)(resid 36 and name hd1#) 1.8 0.0 4.2
assign (resid 51 and name hn)(resid 35 and name hn) 1.8 0.0 3.2

assign (resid 51 and name hn)(resid 50 and name hn) 1.8 0.0 4.2
assign (resid 51 and name hn)(resid 52 and name hn) 1.8 0.0 4.2

assign (resid 51 and name ha)(resid 2 and name hb) 1.8 0.0 4.2 !!!
assign (resid 51 and name ha)(resid 2 and name hg1#) 1.8 0.0 4.2 !!!
assign (resid 51 and name ha)(resid 2 and name hg2#) 1.8 0.0 4.2 !!!

! T52
assign (resid 52 and name hn)(resid 51 and name ha) 1.8 0.0 2.2
assign (resid 52 and name hn)(resid 51 and name hb) 1.8 0.0 3.2
assign (resid 52 and name hn)(resid 51 and name hg2#) 1.8 0.0 4.2
assign (resid 52 and name hn)(resid 52 and name ha) 1.8 0.0 1.2
assign (resid 52 and name hn)(resid 52 and name hb) 1.8 0.0 2.2
assign (resid 52 and name hn)(resid 52 and name hg2#) 1.8 0.0 3.2

assign (resid 52 and name hn)(resid 2 and name ha) 1.8 0.0 2.7
assign (resid 52 and name hn)(resid 2 and name hg1#) 1.8 0.0 3.7
assign (resid 52 and name hn)(resid 2 and name hg2#) 1.8 0.0 4.2
assign (resid 52 and name hn)(resid 3 and name hg2#) 1.8 0.0 4.2
assign (resid 52 and name hn)(resid 3 and name hd1#) 1.8 0.0 4.2

assign (resid 52 and name hn)(resid 53 and name hn) 1.8 0.0 3.2
assign (resid 52 and name hn)(resid 3 and name hn) 1.8 0.0 4.2

assign (resid 52 and name hb)(resid 3 and name hg2#) 1.8 0.0 4.2
assign (resid 52 and name hb)(resid 3 and name hd1#) 1.8 0.0 4.2

! G53
assign (resid 53 and name hn)(resid 52 and name ha) 1.8 0.0 1.2
assign (resid 53 and name hn)(resid 52 and name hb) 1.8 0.0 2.2
assign (resid 53 and name hn)(resid 52 and name hg2#) 1.8 0.0 4.2
assign (resid 53 and name hn)(resid 53 and name ha1) 1.8 0.0 1.2
assign (resid 53 and name hn)(resid 53 and name ha2) 1.8 0.0 1.2

assign (resid 53 and name hn)(resid 51 and name ha) 1.8 0.0 4.2


!!!!
assign (resid 16 and name hn)(resid 43 and name ha) 1.8 0.0 4.2
assign (resid 17 and name hn)(resid 43 and name ha) 1.8 0.0 4.2

assign (resid 23 and name hn)(resid 9 and name hd#) 1.8 0.0 4.2
assign (resid 23 and name hn)(resid 9 and name he#) 1.8 0.0 4.2
assign (resid 45 and name hn)(resid 9 and name hd#) 1.8 0.0 4.2
assign (resid 45 and name hn)(resid 9 and name he#) 1.8 0.0 4.2


!16-32:
!assign (resid 32 and name hn)(resid 7 and name hg2#) 1.8 0.0 3.2
!assign (resid 32 and name hn)(resid 26 and name hg2#) 1.8 0.0 3.2
!assign (resid 32 and name hn)(resid 19 and name hg#) 1.8 0.0 4.2
!assign (resid 32 and name hn)(resid 24 and name ha) 1.8 0.0 3.2
!assign (resid 32 and name hn)(resid 25 and name ha) 1.8 0.0 4.2
!assign (resid 32 and name hn)(resid 24 and name hn) 1.8 0.0 4.2
!assign (resid 32 and name hn)(resid 26 and name hn) 1.8 0.0 3.2

!17-33:
!assign (resid 33 and name hn)(resid 24 and name ha) 1.8 0.0 4.2
!assign (resid 33 and name hn)(resid 25 and name ha) 1.8 0.0 4.2
!assign (resid 33 and name hn)(resid 36 and name hg2#) 1.8 0.0 4.2
!assign (resid 33 and name hn)(resid 36 and name hd1#) 1.8 0.0 4.2
!assign (resid 33 and name hn)(resid 24 and name hn) 1.8 0.0 4.2


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