NMR Restraints Grid

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

image

mrblock_id

pdb_id

bmrb_id

cing

in_recoord

in_dress

stage

position

program

type

subtype

subsubtype

3262

1df6

4461

cing

recoord

dress

1-original

1

XPLOR/CNS

distance

NOE

simple

! vo1559 NOE table 
!
! residue 1 (ser)
assign (resid 1 and name HN ) (resid 1 and name HA ) 0 0 3.5 !
assign (resid 1 and name HN ) (resid 1 and name HB* ) 0 0 3.7 !60
assign (resid 1 and name HN ) (resid 1 and name HB* ) 0 0 3.7 !61
assign (resid 1 and name HA ) (resid 1 and name HB* ) 0 0 3.7 !a49
assign (resid 1 and name HA ) (resid 1 and name HB* ) 0 0 3.7 !a48
assign (resid 1 and name HB1 ) (resid 1 and name HB2 ) 0 0 2.7 !a156
assign (resid 1 and name HB* ) (resid 2 and name HN ) 0 0 3.7 !159
assign (resid 1 and name HB* ) (resid 2 and name HN ) 0 0 3.7 !160
assign (resid 1 and name HA ) (resid 2 and name HN ) 0 0 3.5 !
assign (resid 1 and name HA ) (resid 2 and name HA ) 0 0 5.0 !a1
assign (resid 1 and name HB* ) (resid 3 and name HN ) 0 0 7.0 !207
assign (resid 1 and name HB* ) (resid 3 and name HN ) 0 0 7.0 !208
assign (resid 1 and name HB* ) (resid 3 and name HG2* ) 0 0 6.0 !a157
assign (resid 1 and name HA ) (resid 21 and name HA ) 0 0 2.7 !a46
assign (resid 1 and name HB* ) (resid 21 and name HA ) 0 0 4.5 !a110
assign (resid 1 and name HB* ) (resid 21 and name HA ) 0 0 4.5 !a111
assign (resid 1 and name HA ) (resid 22 and name HB* ) 0 0 6.0 !a54
assign (resid 1 and name HA ) (resid 22 and name HB* ) 0 0 6.0 !a55
assign (resid 1 and name HN ) (resid 30 and name HN ) 0 0 6.0 !58
assign (resid 1 and name HN ) (resid 30 and name HA ) 0 0 3.5 !59
assign (resid 1 and name HN ) (resid 30 and name HG* ) 0 0 4.5 !62
assign (resid 1 and name HN ) (resid 30 and name HG* ) 0 0 4.5 !63
assign (resid 1 and name HN ) (resid 30 and name HB* ) 0 0 4.5 !64
assign (resid 1 and name HN ) (resid 30 and name HB* ) 0 0 4.5 !65

! residue 2 (cys)
assign (resid 2 and name HN ) (resid 2 and name HA ) 0 0 3.5 !146
assign (resid 2 and name HN ) (resid 2 and name HB* ) 0 0 4.5 !162
assign (resid 2 and name HN ) (resid 2 and name HB* ) 0 0 4.5 !163
assign (resid 2 and name HA ) (resid 2 and name HB* ) 0 0 3.7 !a5
assign (resid 2 and name HA ) (resid 2 and name HB* ) 0 0 3.7 !a6
assign (resid 2 and name HB1 ) (resid 2 and name HB2 ) 0 0 2.7 !a219
assign (resid 2 and name HN ) (resid 3 and name HG2* ) 0 0 6.5 !153
assign (resid 2 and name HB* ) (resid 3 and name HN ) 0 0 6.0 !207
assign (resid 2 and name HB* ) (resid 3 and name HN ) 0 0 6.0 !208
assign (resid 2 and name HA ) (resid 3 and name HN ) 0 0 2.7 !206
assign (resid 2 and name HA ) (resid 3 and name HA ) 0 0 5.0 !a4
assign (resid 2 and name HA ) (resid 4 and name HN ) 0 0 6.0 !
assign (resid 2 and name HA ) (resid 5 and name HN ) 0 0 5.0 !266
assign (resid 2 and name HA ) (resid 5 and name HB ) 0 0 6.0 !a8
assign (resid 2 and name HA ) (resid 6 and name HA ) 0 0 5.0 !a2
assign (resid 2 and name HB* ) (resid 6 and name HA ) 0 0 4.5 !a105
assign (resid 2 and name HB* ) (resid 6 and name HA ) 0 0 4.5 !a106
assign (resid 2 and name HB* ) (resid 6 and name HB* ) 0 0 8.0 !a221
assign (resid 2 and name HB* ) (resid 7 and name HN ) 0 0 6.0 !123
assign (resid 2 and name HB* ) (resid 7 and name HN ) 0 0 6.0 !124
assign (resid 2 and name HB* ) (resid 7 and name HA ) 0 0 6.0 !a158
assign (resid 2 and name HB* ) (resid 7 and name HA ) 0 0 6.0 !a159
assign (resid 2 and name HB* ) (resid 17 and name HA ) 0 0 7.0 !a87
assign (resid 2 and name HB* ) (resid 17 and name HA ) 0 0 7.0 !a87-1
assign (resid 2 and name HB* ) (resid 17 and name HB* ) 0 0 5.5 !a220
assign (resid 2 and name HA ) (resid 20 and name HG* ) 0 0 6.0 !a9
assign (resid 2 and name HN ) (resid 21 and name HA ) 0 0 3.5 !158

! residue 3 (val)
assign (resid 3 and name HN ) (resid 3 and name HA ) 0 0 2.7 !209
assign (resid 3 and name HN ) (resid 3 and name HB ) 0 0 3.5 !212
assign (resid 3 and name HN ) (resid 3 and name HG2* ) 0 0 4.2 !215
assign (resid 3 and name HN ) (resid 3 and name HG1* ) 0 0 5.0 !216
assign (resid 3 and name HA ) (resid 3 and name HB ) 0 0 3.5 !a215
assign (resid 3 and name HA ) (resid 3 and name HG2* ) 0 0 4.2 !a217
assign (resid 3 and name HA ) (resid 3 and name HG1* ) 0 0 4.2 !a218
assign (resid 3 and name HB ) (resid 3 and name HG2* ) 0 0 4.2 !a306
assign (resid 3 and name HB ) (resid 3 and name HG1* ) 0 0 4.2 !a310
assign (resid 3 and name HG1* ) (resid 3 and name HG2* ) 0 0 5.7 !a317
assign (resid 3 and name HN ) (resid 4 and name HN ) 0 0 3.5 !143
assign (resid 3 and name HA ) (resid 4 and name HN ) 0 0 3.5 !161
assign (resid 3 and name HB ) (resid 4 and name HN ) 0 0 2.7 !150
assign (resid 3 and name HG2* ) (resid 4 and name HN ) 0 0 4.2 !153 
assign (resid 3 and name HG1* ) (resid 4 and name HN ) 0 0 4.2 !154 
assign (resid 3 and name HG1* ) (resid 4 and name HD* ) 0 0 6.2 !310   
assign (resid 3 and name HG2* ) (resid 4 and name HD* ) 0 0 7.0 !309-1 
assign (resid 3 and name HG1* ) (resid 4 and name HE* ) 0 0 6.2 !338
assign (resid 3 and name HB ) (resid 4 and name HD* ) 0 0 5.5 !308
assign (resid 3 and name HB ) (resid 4 and name HE* ) 0 0 8.0 !335
assign (resid 3 and name HG1* ) (resid 4 and name HB2 ) 0 0 6.5 !a224
assign (resid 3 and name HG1* ) (resid 4 and name HB1 ) 0 0 6.5 !a264
assign (resid 3 and name HG1* ) (resid 4 and name HA ) 0 0 5.0 !a70
assign (resid 3 and name HA ) (resid 5 and name HN ) 0 0 6.0 !267
assign (resid 3 and name HB ) (resid 5 and name HN ) 0 0 5.0 !273
assign (resid 3 and name HG1* ) (resid 5 and name HN ) 0 0 7.5 !277
assign (resid 3 and name HN ) (resid 5 and name HG1* ) 0 0 7.5 !213
assign (resid 3 and name HN ) (resid 5 and name HG2* ) 0 0 7.5 !214
assign (resid 3 and name HN ) (resid 20 and name HB* ) 0 0 6.0 !221
assign (resid 3 and name HA ) (resid 20 and name HD* ) 0 0 4.5 !a212
assign (resid 3 and name HA ) (resid 20 and name HB* ) 0 0 6.0 !a213
assign (resid 3 and name HA ) (resid 20 and name HB* ) 0 0 6.0 !a214
assign (resid 3 and name HA ) (resid 20 and name HG* ) 0 0 4.5 !a216
assign (resid 3 and name HG2* ) (resid 20 and name HA ) 0 0 6.5 !a211
assign (resid 3 and name HG1* ) (resid 20 and name HD* ) 0 0 6.0 !a235
assign (resid 3 and name HG1* ) (resid 20 and name HD* ) 0 0 6.0 !a245
assign (resid 3 and name HG2* ) (resid 20 and name HD* ) 0 0 6.0 !a234
assign (resid 3 and name HG2* ) (resid 20 and name HD* ) 0 0 6.0 !a244
assign (resid 3 and name HG1* ) (resid 20 and name HB* ) 0 0 7.5 !a277
assign (resid 3 and name HG1* ) (resid 20 and name HB* ) 0 0 7.5 !a298
assign (resid 3 and name HG2* ) (resid 20 and name HB* ) 0 0 7.5 !a276
assign (resid 3 and name HG2* ) (resid 20 and name HB* ) 0 0 7.5 !a296-1

! residue 4 (tyr)
assign (resid 4 and name HN ) (resid 4 and name HA ) 0 0 5.0 !147
assign (resid 4 and name HN ) (resid 4 and name HB1 ) 0 0 3.5 !148
assign (resid 4 and name HN ) (resid 4 and name HB2 ) 0 0 3.5 !149
assign (resid 4 and name HA ) (resid 4 and name HB2 ) 0 0 3.5 !a73
assign (resid 4 and name HA ) (resid 4 and name HB1 ) 0 0 2.7 !a72
assign (resid 4 and name HE* ) (resid 4 and name HB1 ) 0 0 8.0 !
assign (resid 4 and name HE* ) (resid 4 and name HB2 ) 0 0 8.0 !
assign (resid 4 and name HD* ) (resid 4 and name HB1 ) 0 0 4.7 !304
assign (resid 4 and name HD* ) (resid 4 and name HB2 ) 0 0 4.7 !306
assign (resid 4 and name HB1 ) (resid 4 and name HB2 ) 0 0 2.7 !a222
assign (resid 4 and name HB1 ) (resid 5 and name HN ) 0 0 3.5 !268
assign (resid 4 and name HB2 ) (resid 5 and name HN ) 0 0 3.5 !270
assign (resid 4 and name HN ) (resid 5 and name HN ) 0 0 2.7 !144
assign (resid 4 and name HN ) (resid 5 and name HG1* ) 0 0 6.0 !151
assign (resid 4 and name HN ) (resid 5 and name HG2* ) 0 0 6.5 !152
assign (resid 4 and name HN ) (resid 5 and name HB ) 0 0 5.0 !164
assign (resid 4 and name HD* ) (resid 5 and name HG1* ) 0 0 9.5 !309
assign (resid 4 and name HB1 ) (resid 5 and name HG2* ) 0 0 5.0 !a223
assign (resid 4 and name HB2 ) (resid 5 and name HG2* ) 0 0 5.0 !a263
assign (resid 4 and name HB1 ) (resid 20 and name HG* ) 0 0 7.0 !a222-1
assign (resid 4 and name HB2 ) (resid 20 and name HG* ) 0 0 7.0 !a261

! residue 5 (ile)
assign (resid 5 and name HN ) (resid 5 and name HA ) 0 0 2.7 !
assign (resid 5 and name HN ) (resid 5 and name HB ) 0 0 3.5 !272
assign (resid 5 and name HN ) (resid 5 and name HG1* ) 0 0 3.7 !274
assign (resid 5 and name HN ) (resid 5 and name HG2* ) 0 0 4.2 !275
assign (resid 5 and name HN ) (resid 5 and name HD1* ) 0 0 6.5 !276
assign (resid 5 and name HA ) (resid 5 and name HB ) 0 0 2.7 !a58
assign (resid 5 and name HA ) (resid 5 and name HG2* ) 0 0 4.2 !a63
assign (resid 5 and name HA ) (resid 6 and name HD* ) 0 0 3.7 !a50
assign (resid 5 and name HA ) (resid 6 and name HD* ) 0 0 3.7 !a51
assign (resid 5 and name HA ) (resid 6 and name HB* ) 0 0 7.0 !a56
assign (resid 5 and name HA ) (resid 6 and name HG* ) 0 0 6.0 !a59
assign (resid 5 and name HG* ) (resid 6 and name HD1 ) 0 0 5.0 !a183
assign (resid 5 and name HG* ) (resid 6 and name HD2 ) 0 0 5.0 !a204

! residue 6 (pro)
assign (resid 6 and name HA ) (resid 6 and name HB* ) 0 0 3.7 !a108
assign (resid 6 and name HA ) (resid 6 and name HG* ) 0 0 4.5 !a109
assign (resid 6 and name HA ) (resid 6 and name HG* ) 0 0 4.5 !a109-1
assign (resid 6 and name HA ) (resid 6 and name HD* ) 0 0 6.0 !a103
assign (resid 6 and name HA ) (resid 6 and name HD* ) 0 0 6.0 !a104
assign (resid 6 and name HD* ) (resid 6 and name HD2 ) 0 0 2.7 !a178
assign (resid 6 and name HD* ) (resid 6 and name HB* ) 0 0 5.5 !a179
assign (resid 6 and name HD* ) (resid 6 and name HG* ) 0 0 5.5 !a180
assign (resid 6 and name HD* ) (resid 6 and name HG* ) 0 0 5.5 !a181
assign (resid 6 and name HD* ) (resid 6 and name HB* ) 0 0 5.5 !a199
assign (resid 6 and name HD* ) (resid 6 and name HG* ) 0 0 5.5 !a200
assign (resid 6 and name HD* ) (resid 6 and name HG* ) 0 0 5.5 !a201
assign (resid 6 and name HB* ) (resid 7 and name HN ) 0 0 3.7 !128
assign (resid 6 and name HB* ) (resid 7 and name HN ) 0 0 3.7 !129
assign (resid 6 and name HG* ) (resid 7 and name HN ) 0 0 4.5 !130
assign (resid 6 and name HA ) (resid 7 and name HN ) 0 0 3.5 !121
assign (resid 6 and name HA ) (resid 7 and name HA ) 0 0 5.0 !a92
assign (resid 6 and name HG* ) (resid 8 and name HN ) 0 0 7.0 !85
assign (resid 6 and name HG* ) (resid 8 and name HN ) 0 0 7.0 !86
assign (resid 6 and name HD* ) (resid 20 and name HG* ) 0 0 8.0 !a182
assign (resid 6 and name HD* ) (resid 20 and name HG* ) 0 0 8.0 !a202

! residue 7 (cys)
assign (resid 7 and name HN ) (resid 7 and name HA ) 0 0 3.5 !122
assign (resid 7 and name HN ) (resid 7 and name HB2 ) 0 0 3.5 !126
assign (resid 7 and name HN ) (resid 7 and name HB1 ) 0 0 3.5 !127
assign (resid 7 and name HA ) (resid 7 and name HB2 ) 0 0 2.7 !a160
assign (resid 7 and name HA ) (resid 7 and name HB1 ) 0 0 3.5 !a162
assign (resid 7 and name HB1 ) (resid 7 and name HB2 ) 0 0 2.7 !a255
assign (resid 7 and name HB1 ) (resid 8 and name HN ) 0 0 6.0 !84
assign (resid 7 and name HB2 ) (resid 8 and name HN ) 0 0 5.0 !83
assign (resid 7 and name HN ) (resid 8 and name HG2* ) 0 0 7.5 !131
assign (resid 7 and name HN ) (resid 8 and name HN ) 0 0 5.0 !81
assign (resid 7 and name HA ) (resid 8 and name HG2* ) 0 0 7.5 !a165
assign (resid 7 and name HB* ) (resid 10 and name HN ) 0 0 7.0 !115
assign (resid 7 and name HA ) (resid 11 and name HB* ) 0 0 7.5 !a164
assign (resid 7 and name HB2 ) (resid 11 and name HB* ) 0 0 6.5 !a257
assign (resid 7 and name HB1 ) (resid 11 and name HB* ) 0 0 6.5 !a268
assign (resid 7 and name HA ) (resid 30 and name HG* ) 0 0 6.0 !a163
assign (resid 7 and name HA ) (resid 30 and name HG* ) 0 0 6.0 !a161

! residue 8 (thr)
assign (resid 8 and name HN ) (resid 8 and name HA ) 0 0 3.5 !82
assign (resid 8 and name HN ) (resid 8 and name HG2* ) 0 0 4.2 !88
assign (resid 8 and name HA ) (resid 8 and name HG2* ) 0 0 4.2 !a141
assign (resid 8 and name HB ) (resid 8 and name HG2* ) 0 0 4.2 !a152
assign (resid 8 and name HA ) (resid 8 and name HB ) 0 0 2.7 !a133-1
assign (resid 8 and name HN ) (resid 9 and name HG2* ) 0 0 6.5 !89 
assign (resid 8 and name HA ) (resid 9 and name HN ) 0 0 2.7 !68
assign (resid 8 and name HG2* ) (resid 9 and name HN ) 0 0 5.0 !71
assign (resid 8 and name HN ) (resid 9 and name HN ) 0 0 5.0 !66
assign (resid 8 and name HB ) (resid 9 and name HG2* ) 0 0 5.0 !a154
assign (resid 8 and name HG2* ) (resid 9 and name HA ) 0 0 6.5 !a167
assign (resid 8 and name HA ) (resid 10 and name HN ) 0 0 5.0 !113
assign (resid 8 and name HN ) (resid 10 and name HN ) 0 0 5.0 !80
assign (resid 8 and name HG2* ) (resid 10 and name HN ) 0 0 7.5 !117-1
assign (resid 8 and name HA ) (resid 11 and name HN ) 0 0 6.0 !201
assign (resid 8 and name HN ) (resid 11 and name HB* ) 0 0 7.5 !87
assign (resid 8 and name HA ) (resid 11 and name HB* ) 0 0 6.5 !a139-1
assign (resid 8 and name HB ) (resid 11 and name HB* ) 0 0 7.5 !a151

! residue 9 (val)
assign (resid 9 and name HN ) (resid 9 and name HA ) 0 0 3.5 !69
assign (resid 9 and name HN ) (resid 9 and name HB ) 0 0 3.5 !70 a
assign (resid 9 and name HN ) (resid 9 and name HG2* ) 0 0 4.2 !72
assign (resid 9 and name HN ) (resid 9 and name HG1* ) 0 0 6.5 !73
assign (resid 9 and name HA ) (resid 9 and name HB ) 0 0 3.5 !a166
assign (resid 9 and name HA ) (resid 9 and name HG2* ) 0 0 4.2 !a169
assign (resid 9 and name HA ) (resid 9 and name HG1* ) 0 0 4.2 !a170
assign (resid 9 and name HB ) (resid 9 and name HG2* ) 0 0 4.2 !a286
assign (resid 9 and name HB ) (resid 9 and name HG1* ) 0 0 4.2 !a287
assign (resid 9 and name HB ) (resid 10 and name HG2* ) 0 0 5.0 !a285
assign (resid 9 and name HA ) (resid 10 and name HG2* ) 0 0 6.5 !a168
assign (resid 9 and name HA ) (resid 10 and name HN ) 0 0 3.5 !114
assign (resid 9 and name HB ) (resid 10 and name HN ) 0 0 2.7 !116
assign (resid 9 and name HG2* ) (resid 10 and name HN ) 0 0 5.0 !119 
assign (resid 9 and name HG1* ) (resid 10 and name HN ) 0 0 4.2 !120 
assign (resid 9 and name HN ) (resid 10 and name HN ) 0 0 2.7 !67
assign (resid 9 and name HN ) (resid 10 and name HG2* ) 0 0 7.5 !71-1
assign (resid 9 and name HB ) (resid 10 and name HB ) 0 0 6.0 !a128-1

! residue 10 (thr)
assign (resid 10 and name HN ) (resid 10 and name HA ) 0 0 3.5 !112 a
assign (resid 10 and name HN ) (resid 10 and name HG2* ) 0 0 5.0 !118
assign (resid 10 and name HA ) (resid 10 and name HB ) 0 0 2.7 !a27
assign (resid 10 and name HA ) (resid 10 and name HG2* ) 0 0 4.2 !a37
assign (resid 10 and name HB ) (resid 10 and name HG2* ) 0 0 4.2 !a131
assign (resid 10 and name HN ) (resid 11 and name HN ) 0 0 3.5 !111
assign (resid 10 and name HN ) (resid 11 and name HB* ) 0 0 6.5 !117
assign (resid 10 and name HG2* ) (resid 11 and name HN ) 0 0 7.5 !204
assign (resid 10 and name HA ) (resid 11 and name HN ) 0 0 5.0 !200
assign (resid 10 and name HA ) (resid 12 and name HN ) 0 0 6.0 !219
assign (resid 10 and name HA ) (resid 13 and name HN ) 0 0 5.0 !279
assign (resid 10 and name HA ) (resid 13 and name HB* ) 0 0 6.0 !34
assign (resid 10 and name HA ) (resid 13 and name HB* ) 0 0 6.0 !35
assign (resid 10 and name HB ) (resid 13 and name HB* ) 0 0 6.0 !a129
assign (resid 10 and name HB ) (resid 13 and name HB* ) 0 0 6.0 !a128
assign (resid 10 and name HB ) (resid 13 and name HD* ) 0 0 6.5 !a133
assign (resid 10 and name HB ) (resid 13 and name HD* ) 0 0 6.5 !a132
assign (resid 10 and name HB ) (resid 13 and name HG ) 0 0 5.0 !a130
assign (resid 10 and name HA ) (resid 13 and name HG ) 0 0 5.0 !a36
assign (resid 10 and name HA ) (resid 13 and name HD* ) 0 0 6.5 !a38
assign (resid 10 and name HA ) (resid 15 and name HB* ) 0 0 4.5 !a33
assign (resid 10 and name HA ) (resid 15 and name HB* ) 0 0 4.5 !a28
assign (resid 10 and name HB ) (resid 15 and name HB* ) 0 0 6.0 !a124
assign (resid 10 and name HB ) (resid 15 and name HB* ) 0 0 7.0 !a127
assign (resid 10 and name HG2* ) (resid 15 and name HB* ) 0 0 7.5 !a203
assign (resid 10 and name HG2* ) (resid 22 and name HB* ) 0 0 7.5 !a250
assign (resid 10 and name HG2* ) (resid 22 and name HB* ) 0 0 7.5 !a269
assign (resid 10 and name HA ) (resid 28 and name HB* ) 0 0 4.5 !a29
assign (resid 10 and name HA ) (resid 28 and name HB* ) 0 0 4.5 !a30
assign (resid 10 and name HB ) (resid 28 and name HB* ) 0 0 7.0 !a125
assign (resid 10 and name HB ) (resid 28 and name HB* ) 0 0 7.0 !a126
assign (resid 10 and name HG2* ) (resid 28 and name HA ) 0 0 6.5 !a62
assign (resid 10 and name HG2* ) (resid 28 and name HB* ) 0 0 5.2 !a228
assign (resid 10 and name HG2* ) (resid 28 and name HB* ) 0 0 5.2 !a243
assign (resid 10 and name HG2* ) (resid 29 and name HN ) 0 0 7.5 !109
assign (resid 10 and name HG2* ) (resid 30 and name HN ) 0 0 7.5 !235
assign (resid 10 and name HG2* ) (resid 30 and name HA ) 0 0 6.5 !a120
assign (resid 10 and name HG2* ) (resid 30 and name HG* ) 0 0 7.5 !a262
assign (resid 10 and name HG2* ) (resid 30 and name HG* ) 0 0 7.5 !a272

! residue 11 (ala)
assign (resid 11 and name HN ) (resid 11 and name HA ) 0 0 2.7 !199
assign (resid 11 and name HN ) (resid 11 and name HB* ) 0 0 4.2 !203
assign (resid 11 and name HA ) (resid 11 and name HB* ) 0 0 4.2 !a100
assign (resid 11 and name HA ) (resid 12 and name HN ) 0 0 3.5 !218
assign (resid 11 and name HB* ) (resid 12 and name HN ) 0 0 4.2 !223
assign (resid 11 and name HB* ) (resid 13 and name HN ) 0 0 7.5 !284
assign (resid 11 and name HB* ) (resid 14 and name HN ) 0 0 7.5 !173
assign (resid 11 and name HB* ) (resid 15 and name HN ) 0 0 7.5 !262
assign (resid 11 and name HA ) (resid 15 and name HB* ) 0 0 7.0 !a96-1
assign (resid 11 and name HA ) (resid 15 and name HN ) 0 0 5.0 !255*

! resdiue 12 (leu)
assign (resid 12 and name HN ) (resid 12 and name HA ) 0 0 2.7 !220
assign (resid 12 and name HN ) (resid 12 and name HB* ) 0 0 3.7 !222
assign (resid 12 and name HN ) (resid 12 and name HG ) 0 0 3.5 !222-1
assign (resid 12 and name HN ) (resid 12 and name HD* ) 0 0 6.0 !215-1 [3.5+2.5]
assign (resid 12 and name HB* ) (resid 12 and name HD* ) 0 0 9.0 !a303
assign (resid 12 and name HB* ) (resid 12 and name HD* ) 0 0 9.0 !a304
assign (resid 12 and name HA ) (resid 13 and name HN ) 0 0 3.5 !280
assign (resid 12 and name HN ) (resid 13 and name HN ) 0 0 3.5 !217
assign (resid 12 and name HA ) (resid 14 and name HN ) 0 0 5.0 !168

! residue 13 (leu)
assign (resid 13 and name HN ) (resid 13 and name HA ) 0 0 2.7 !278
assign (resid 13 and name HN ) (resid 13 and name HB* ) 0 0 3.7 !281
assign (resid 13 and name HN ) (resid 13 and name HB* ) 0 0 3.7 !282
assign (resid 13 and name HN ) (resid 13 and name HG ) 0 0 3.5 !283
assign (resid 13 and name HN ) (resid 13 and name HD* ) 0 0 6.5 !285
assign (resid 13 and name HN ) (resid 13 and name HD* ) 0 0 6.5 !286
assign (resid 13 and name HA ) (resid 13 and name HB* ) 0 0 3.7 !a97
assign (resid 13 and name HA ) (resid 13 and name HB* ) 0 0 3.7 !a98
assign (resid 13 and name HA ) (resid 13 and name HG ) 0 0 3.5 !a99
assign (resid 13 and name HA ) (resid 13 and name HD* ) 0 0 6.5 !a102
assign (resid 13 and name HA ) (resid 13 and name HD* ) 0 0 6.5 !a101
assign (resid 13 and name HB1 ) (resid 13 and name HB2 ) 0 0 2.7 !a288
assign (resid 13 and name HB* ) (resid 13 and name HD* ) 0 0 6.7 !a292
assign (resid 13 and name HB* ) (resid 13 and name HD* ) 0 0 6.7 !a291
assign (resid 13 and name HB* ) (resid 13 and name HG ) 0 0 3.7 !a299
assign (resid 13 and name HB* ) (resid 13 and name HD* ) 0 0 6.7 !a300
assign (resid 13 and name HB* ) (resid 13 and name HD* ) 0 0 6.7 !a301
assign (resid 13 and name HG ) (resid 13 and name HD* ) 0 0 6.5 !a309
assign (resid 13 and name HG ) (resid 13 and name HD* ) 0 0 6.5 !a308
assign (resid 13 and name HN ) (resid 14 and name HN ) 0 0 3.5 !166
assign (resid 13 and name HA ) (resid 14 and name HN ) 0 0 3.5 !167
assign (resid 13 and name HB* ) (resid 14 and name HN ) 0 0 7.0 !171
assign (resid 13 and name HB* ) (resid 14 and name HN ) 0 0 7.0 !164-1
assign (resid 13 and name HA ) (resid 15 and name HN ) 0 0 5.0 !255
assign (resid 13 and name HN ) (resid 15 and name HN ) 0 0 5.0 !253
assign (resid 13 and name HB* ) (resid 15 and name HN ) 0 0 7.0 !260 
assign (resid 13 and name HB* ) (resid 15 and name HN ) 0 0 7.0 !261 
assign (resid 13 and name HB* ) (resid 24 and name HD22 ) 0 0 6.0 !
assign (resid 13 and name HB* ) (resid 24 and name HD21 ) 0 0 6.0 !343
assign (resid 13 and name HD* ) (resid 24 and name HD21 ) 0 0 9.0 !345 
assign (resid 13 and name HD* ) (resid 24 and name HD21 ) 0 0 9.0 !344
assign (resid 13 and name HD* ) (resid 26 and name HN ) 0 0 8.0 !252 

! residue 14 (gly)
assign (resid 14 and name HN ) (resid 14 and name HA1 ) 0 0 3.5 !169 a
assign (resid 14 and name HN ) (resid 14 and name HA2 ) 0 0 3.5 !170 a
assign (resid 14 and name HA* ) (resid 15 and name HN ) 0 0 6.0 !256
assign (resid 14 and name HA* ) (resid 15 and name HN ) 0 0 6.0 !257
assign (resid 14 and name HN ) (resid 15 and name HN ) 0 0 3.5 !165

! residue 15 (cys)
assign (resid 15 and name HN ) (resid 15 and name HA ) 0 0 3.5 !
assign (resid 15 and name HN ) (resid 15 and name HB1 ) 0 0 3.5 !258
assign (resid 15 and name HN ) (resid 15 and name HB2 ) 0 0 3.5 !259
assign (resid 15 and name HA ) (resid 15 and name HB* ) 0 0 3.7 !a41
assign (resid 15 and name HA ) (resid 15 and name HB* ) 0 0 3.7 !a45
assign (resid 15 and name HB* ) (resid 15 and name HB* ) 0 0 4.7 !a198
assign (resid 15 and name HA ) (resid 16 and name HN ) 0 0 3.5 !
assign (resid 15 and name HB* ) (resid 16 and name HN ) 0 0 4.5 !36
assign (resid 15 and name HB* ) (resid 16 and name HN ) 0 0 4.5 !40
assign (resid 15 and name HB* ) (resid 22 and name HA ) 0 0 6.0 !a66
assign (resid 15 and name HB* ) (resid 22 and name HA ) 0 0 6.0 !a69
assign (resid 15 and name HB* ) (resid 22 and name HB* ) 0 0 5.5 !a194
assign (resid 15 and name HB* ) (resid 22 and name HB* ) 0 0 5.5 !a197
assign (resid 15 and name HB* ) (resid 22 and name HB* ) 0 0 5.5 !a265
assign (resid 15 and name HB* ) (resid 22 and name HB* ) 0 0 5.5 !a247
assign (resid 15 and name HB1 ) (resid 23 and name HN ) 0 0 5.0 !6
assign (resid 15 and name HB2 ) (resid 23 and name HN ) 0 0 5.0 !11
assign (resid 15 and name HB* ) (resid 23 and name HA ) 0 0 7.0 !a20
assign (resid 15 and name HB* ) (resid 23 and name HB* ) 0 0 7.0 !a195
assign (resid 15 and name HA ) (resid 24 and name HB1 ) 0 0 5.0 !a43
assign (resid 15 and name HA ) (resid 24 and name HB2 ) 0 0 3.5 !a44
assign (resid 15 and name HB* ) (resid 28 and name HB* ) 0 0 5.5 !a193
assign (resid 15 and name HB* ) (resid 28 and name HB* ) 0 0 5.5 !a194-1
assign (resid 15 and name HB* ) (resid 28 and name HB* ) 0 0 5.5 !a226
assign (resid 15 and name HB* ) (resid 28 and name HB* ) 0 0 5.5 !a238

! residue 16 (ser)
assign (resid 16 and name HA ) (resid 16 and name HB* ) 0 0 3.7 !a71
assign (resid 16 and name HN ) (resid 16 and name HA ) 0 0 3.5 !34
assign (resid 16 and name HN ) (resid 16 and name HB* ) 0 0 3.7 !35
assign (resid 16 and name HB* ) (resid 17 and name HN ) 0 0 3.7 !77
assign (resid 16 and name HN ) (resid 17 and name HN ) 0 0 6.0 !33
assign (resid 16 and name HN ) (resid 22 and name HB* ) 0 0 6.0 !39
assign (resid 16 and name HN ) (resid 23 and name HN ) 0 0 3.5 !2
assign (resid 16 and name HB* ) (resid 23 and name HD* ) 0 0 9.0 !315
assign (resid 16 and name HB* ) (resid 23 and name HE* ) 0 0 9.0 !331
assign (resid 16 and name HN ) (resid 23 and name HB* ) 0 0 6.0 !37
assign (resid 16 and name HN ) (resid 23 and name HB* ) 0 0 6.0 !38

! residue 17 (cys)
assign (resid 17 and name HN ) (resid 17 and name HA ) 0 0 3.5 !76
assign (resid 17 and name HN ) (resid 17 and name HB* ) 0 0 3.7 !78
assign (resid 17 and name HA ) (resid 17 and name HB* ) 0 0 3.7 !a88
assign (resid 17 and name HB* ) (resid 18 and name HN ) 0 0 6.0 !18
assign (resid 17 and name HA ) (resid 18 and name HN ) 0 0 5.0 !16-1
assign (resid 17 and name HN ) (resid 18 and name HN ) 0 0 6.0 !12
assign (resid 17 and name HA ) (resid 22 and name HA ) 0 0 2.7 !a65
assign (resid 17 and name HA ) (resid 22 and name HB* ) 0 0 6.0 !a89

! residue 18 (ser)
assign (resid 18 and name HN ) (resid 18 and name HA ) 0 0 3.5 !16
assign (resid 18 and name HN ) (resid 18 and name HB* ) 0 0 3.7 !17
assign (resid 18 and name HA ) (resid 18 and name HB* ) 0 0 3.7 !a76
assign (resid 18 and name HA ) (resid 19 and name HN ) 0 0 2.7 !25
assign (resid 18 and name HB* ) (resid 19 and name HN ) 0 0 4.5 !28
assign (resid 18 and name HA ) (resid 19 and name HB1 ) 0 0 6.0 !a79
assign (resid 18 and name HA ) (resid 20 and name HN ) 0 0 6.0 !133
assign (resid 18 and name HN ) (resid 20 and name HN ) 0 0 6.0 !13
assign (resid 18 and name HN ) (resid 21 and name HB ) 0 0 5.0 !20
assign (resid 18 and name HN ) (resid 21 and name HG2* ) 0 0 6.5 !21
assign (resid 18 and name HN ) (resid 21 and name HG1* ) 0 0 7.5 !22
assign (resid 18 and name HB* ) (resid 21 and name HN ) 0 0 7.0 !188
assign (resid 18 and name HN ) (resid 21 and name HN ) 0 0 3.5 !14
assign (resid 18 and name HN ) (resid 23 and name HD* ) 0 0 7.0 !15
assign (resid 18 and name HN ) (resid 23 and name HN ) 0 0 6.0 !1
assign (resid 18 and name HB* ) (resid 23 and name HE* ) 0 0 8.0 !332
assign (resid 18 and name HB* ) (resid 23 and name HD* ) 0 0 5.7 !316
assign (resid 18 and name HA ) (resid 23 and name HB* ) 0 0 6.0 !a77
assign (resid 18 and name HA ) (resid 23 and name HB* ) 0 0 6.0 !a78

! residue 19 (asn)
assign (resid 19 and name HN ) (resid 19 and name HA ) 0 0 2.7 !27
assign (resid 19 and name HN ) (resid 19 and name HB2 ) 0 0 5.0 !30
assign (resid 19 and name HN ) (resid 19 and name HB1 ) 0 0 3.5 !31
assign (resid 19 and name HA ) (resid 19 and name HB1 ) 0 0 2.7 !a136
assign (resid 19 and name HA ) (resid 19 and name HB2 ) 0 0 2.7 !a135
assign (resid 19 and name HB1 ) (resid 19 and name HD21 ) 0 0 2.7 !271
assign (resid 19 and name HB2 ) (resid 19 and name HD21 ) 0 0 3.5 !269
assign (resid 19 and name HB1 ) (resid 19 and name HD22 ) 0 0 5.0 !326
assign (resid 19 and name HB2 ) (resid 19 and name HD22 ) 0 0 6.0 !325
assign (resid 19 and name HB1 ) (resid 19 and name HB2 ) 0 0 2.7 !a253
assign (resid 19 and name HN ) (resid 20 and name HN ) 0 0 2.7 !23
assign (resid 19 and name HA ) (resid 20 and name HN ) 0 0 2.7 !134
assign (resid 19 and name HB2 ) (resid 20 and name HN ) 0 0 5.0 !137
assign (resid 19 and name HB1 ) (resid 20 and name HN ) 0 0 5.0 !138
assign (resid 19 and name HN ) (resid 20 and name HA ) 0 0 5.0 !29
assign (resid 19 and name HN ) (resid 20 and name HG* ) 0 0 7.0 !32
assign (resid 19 and name HN ) (resid 21 and name HN ) 0 0 6.0 !24
assign (resid 19 and name HA ) (resid 21 and name HN ) 0 0 6.0 !187
assign (resid 19 and name HB2 ) (resid 21 and name HN ) 0 0 5.0 !190
assign (resid 19 and name HB1 ) (resid 21 and name HN ) 0 0 6.0 !191
assign (resid 19 and name HB2 ) (resid 21 and name HG1* ) 0 0 7.5 !a254-1
assign (resid 19 and name HB1 ) (resid 21 and name HG2* ) 0 0 6.5 !a254-2

! residue 20 (arg)
assign (resid 20 and name HN ) (resid 20 and name HA ) 0 0 2.7 !135
assign (resid 20 and name HN ) (resid 20 and name HB* ) 0 0 6.0 !139
assign (resid 20 and name HN ) (resid 20 and name HB* ) 0 0 6.0 !140
assign (resid 20 and name HN ) (resid 20 and name HG* ) 0 0 4.5 !141
assign (resid 20 and name HN ) (resid 20 and name HD* ) 0 0 6.0 !136
assign (resid 20 and name HA ) (resid 20 and name HD* ) 0 0 4.5 !a206
assign (resid 20 and name HA ) (resid 20 and name HB* ) 0 0 4.5 !a207 a
assign (resid 20 and name HA ) (resid 20 and name HB* ) 0 0 4.5 !a208 a
assign (resid 20 and name HA ) (resid 20 and name HG* ) 0 0 3.7 !a210
assign (resid 20 and name HD* ) (resid 20 and name HB* ) 0 0 5.5 !a231
assign (resid 20 and name HD* ) (resid 20 and name HB* ) 0 0 5.5 !a232
assign (resid 20 and name HD* ) (resid 20 and name HG* ) 0 0 4.7 !a233
assign (resid 20 and name HD* ) (resid 20 and name HB* ) 0 0 5.5 !a239
assign (resid 20 and name HD* ) (resid 20 and name HB* ) 0 0 5.5 !a240
assign (resid 20 and name HD* ) (resid 20 and name HG* ) 0 0 4.7 !a242
assign (resid 20 and name HB* ) (resid 20 and name HB* ) 0 0 4.7 !a274
assign (resid 20 and name HB* ) (resid 20 and name HG* ) 0 0 4.7 !a275
assign (resid 20 and name HB* ) (resid 20 and name HG* ) 0 0 4.7 !a294
assign (resid 20 and name HN ) (resid 21 and name HN ) 0 0 3.5 !132
assign (resid 20 and name HB* ) (resid 21 and name HN ) 0 0 6.0 !192
assign (resid 20 and name HB* ) (resid 21 and name HN ) 0 0 6.0 !194
assign (resid 20 and name HG* ) (resid 21 and name HN ) 0 0 6.0 !195
assign (resid 20 and name HA ) (resid 21 and name HN ) 0 0 2.7 !189

! residue 21 (val)
assign (resid 21 and name HN ) (resid 21 and name HA ) 0 0 3.5 !186
assign (resid 21 and name HN ) (resid 21 and name HB ) 0 0 2.7 !193
assign (resid 21 and name HN ) (resid 21 and name HG2* ) 0 0 4.2 !196
assign (resid 21 and name HN ) (resid 21 and name HG1* ) 0 0 6.5 !197
assign (resid 21 and name HA ) (resid 21 and name HB ) 0 0 3.5 !a116 a
assign (resid 21 and name HA ) (resid 21 and name HG2* ) 0 0 4.2 !a121
assign (resid 21 and name HA ) (resid 21 and name HG1* ) 0 0 4.2 !a122
assign (resid 21 and name HG2* ) (resid 22 and name HN ) 0 0 6.5 !184 
assign (resid 21 and name HG1* ) (resid 22 and name HN ) 0 0 4.2 !185
assign (resid 21 and name HB ) (resid 22 and name HN ) 0 0 5.0 !181
assign (resid 21 and name HA ) (resid 22 and name HN ) 0 0 3.5 !176
assign (resid 21 and name HG2* ) (resid 22 and name HB* ) 0 0 8.5 !a251
assign (resid 21 and name HG2* ) (resid 23 and name HE* ) 0 0 8.5 !336 
assign (resid 21 and name HG1* ) (resid 23 and name HE* ) 0 0 7.0 !337
assign (resid 21 and name HB ) (resid 23 and name HE* ) 0 0 5.5 !333
assign (resid 21 and name HG1* ) (resid 23 and name HD* ) 0 0 7.0 !323
assign (resid 21 and name HG2* ) (resid 23 and name HD* ) 0 0 8.5 !322
assign (resid 21 and name HB ) (resid 23 and name HD* ) 0 0 7.0 !320
assign (resid 21 and name HG1* ) (resid 23 and name HA ) 0 0 6.5 !a24
assign (resid 21 and name HG1* ) (resid 28 and name HN ) 0 0 6.5 !57 
assign (resid 21 and name HG2* ) (resid 28 and name HN ) 0 0 7.5 !56 
assign (resid 21 and name HG1* ) (resid 30 and name HN ) 0 0 7.5 !236
assign (resid 21 and name HG2* ) (resid 30 and name HN ) 0 0 7.5 !235-1

! residue 22 (cys)
assign (resid 22 and name HN ) (resid 22 and name HA ) 0 0 3.5 !
assign (resid 22 and name HN ) (resid 22 and name HB* ) 0 0 4.5 !179
assign (resid 22 and name HN ) (resid 22 and name HB* ) 0 0 4.5 !180
assign (resid 22 and name HA ) (resid 22 and name HB* ) 0 0 3.7 !a74
assign (resid 22 and name HA ) (resid 22 and name HB* ) 0 0 3.7 !a67
assign (resid 22 and name HB1 ) (resid 22 and name HB2 ) 0 0 2.7 !a246
assign (resid 22 and name HB* ) (resid 23 and name HN ) 0 0 4.5 !11
assign (resid 22 and name HA ) (resid 23 and name HN ) 0 0 2.7 !
assign (resid 22 and name HB* ) (resid 23 and name HA ) 0 0 6.0 !a19
assign (resid 22 and name HB* ) (resid 28 and name HB* ) 0 0 5.5 !a225
assign (resid 22 and name HB* ) (resid 28 and name HB* ) 0 0 5.5 !a225-1
assign (resid 22 and name HB* ) (resid 28 and name HB* ) 0 0 5.5 !a237
assign (resid 22 and name HB* ) (resid 28 and name HB* ) 0 0 5.5 !a237-1
assign (resid 22 and name HB* ) (resid 30 and name HN ) 0 0 7.0 !228
assign (resid 22 and name HB* ) (resid 30 and name HN ) 0 0 7.0 !230
assign (resid 22 and name HB* ) (resid 30 and name HB* ) 0 0 5.5 !a248
assign (resid 22 and name HB* ) (resid 30 and name HB* ) 0 0 5.5 !a249
assign (resid 22 and name HB* ) (resid 30 and name HB* ) 0 0 5.5 !a266
assign (resid 22 and name HB* ) (resid 30 and name HB* ) 0 0 5.5 !a267

! residue 23 (tyr)
assign (resid 23 and name HN ) (resid 23 and name HA ) 0 0 5.0 !4
assign (resid 23 and name HN ) (resid 23 and name HB* ) 0 0 3.7 !8
assign (resid 23 and name HN ) (resid 23 and name HB* ) 0 0 3.7 !9
assign (resid 23 and name HN ) (resid 23 and name HD* ) 0 0 7.0 !3
assign (resid 23 and name HA ) (resid 23 and name HD* ) 0 0 7.0 !302
assign (resid 23 and name HB* ) (resid 23 and name HD* ) 0 0 5.7 !317
assign (resid 23 and name HB* ) (resid 23 and name HD* ) 0 0 5.7 !318
assign (resid 23 and name HB* ) (resid 24 and name HN ) 0 0 4.5 !95
assign (resid 23 and name HD* ) (resid 24 and name HN ) 0 0 7.0 !92
assign (resid 23 and name HA ) (resid 24 and name HN ) 0 0 3.5 !93
assign (resid 23 and name HA ) (resid 25 and name HA ) 0 0 5.0 !a14
assign (resid 23 and name HD* ) (resid 26 and name HB ) 0 0 7.0 !321
assign (resid 23 and name HE* ) (resid 26 and name HB ) 0 0 7.0 !334
assign (resid 23 and name HD* ) (resid 27 and name HA ) 0 0 5.5 !314
assign (resid 23 and name HD* ) (resid 27 and name HB* ) 0 0 8.0 !319
assign (resid 23 and name HA ) (resid 27 and name HA ) 0 0 2.7 !a13 
assign (resid 23 and name HA ) (resid 27 and name HB* ) 0 0 4.5 !a21
assign (resid 23 and name HA ) (resid 27 and name HG1 ) 0 0 6.0 !a23
assign (resid 23 and name HA ) (resid 27 and name HG2 ) 0 0 6.0 !a22
assign (resid 23 and name HA ) (resid 28 and name HN ) 0 0 5.0 !45
assign (resid 23 and name HA ) (resid 28 and name HB* ) 0 0 7.0 !a15
assign (resid 23 and name HA ) (resid 28 and name HB* ) 0 0 7.0 !a16

! residue 24 (asn)
assign (resid 24 and name HN ) (resid 24 and name HA ) 0 0 3.5 !
assign (resid 24 and name HN ) (resid 24 and name HB1 ) 0 0 3.5 !96
assign (resid 24 and name HN ) (resid 24 and name HB2 ) 0 0 3.5 !97
assign (resid 24 and name HA ) (resid 24 and name HB1 ) 0 0 3.5 !a39
assign (resid 24 and name HA ) (resid 24 and name HB2 ) 0 0 3.5 !a40
assign (resid 24 and name HB2 ) (resid 24 and name HD21 ) 0 0 2.7 !307
assign (resid 24 and name HB1 ) (resid 24 and name HD21 ) 0 0 2.7 !305
assign (resid 24 and name HB1 ) (resid 24 and name HD22 ) 0 0 3.5 !341
assign (resid 24 and name HB2 ) (resid 24 and name HD22 ) 0 0 3.5 !342
assign (resid 24 and name HB1 ) (resid 24 and name HB2 ) 0 0 2.7 !a252
assign (resid 24 and name HN ) (resid 25 and name HN ) 0 0 5.0 !90
assign (resid 24 and name HA ) (resid 25 and name HN ) 0 0 2.7 !
assign (resid 24 and name HN ) (resid 26 and name HN ) 0 0 3.5 !91
assign (resid 24 and name HN ) (resid 26 and name HG2* ) 0 0 6.5 !99
assign (resid 24 and name HN ) (resid 28 and name HN ) 0 0 6.0 !41

! residue 25 (gly)
assign (resid 25 and name HN ) (resid 25 and name HA1 ) 0 0 2.7 !
assign (resid 25 and name HN ) (resid 25 and name HA2 ) 0 0 2.7 !
assign (resid 25 and name HA1 ) (resid 25 and name HA2 ) 0 0 2.7 !a90
assign (resid 25 and name HA* ) (resid 26 and name HN ) 0 0 4.5 !245
assign (resid 25 and name HA* ) (resid 26 and name HN ) 0 0 4.5 !248
assign (resid 25 and name HN ) (resid 26 and name HN ) 0 0 5.0 !237

! residue 26 (ile)
assign (resid 26 and name HN ) (resid 26 and name HA ) 0 0 3.5 !244
assign (resid 26 and name HN ) (resid 26 and name HB ) 0 0 3.5 !249
assign (resid 26 and name HN ) (resid 26 and name HG2* ) 0 0 4.2 !251
assign (resid 26 and name HA ) (resid 26 and name HB ) 0 0 2.7 !a81
assign (resid 26 and name HA ) (resid 26 and name HG2* ) 0 0 4.2 !a84
assign (resid 26 and name HA ) (resid 27 and name HG* ) 0 0 6.5 !a82
assign (resid 26 and name HA ) (resid 27 and name HB2 ) 0 0 6.0 !a80
assign (resid 26 and name HA ) (resid 27 and name HB1 ) 0 0 5.0 !a80-1
assign (resid 26 and name HA ) (resid 27 and name HD1 ) 0 0 3.5 !a85-2
assign (resid 26 and name HA ) (resid 27 and name HD2 ) 0 0 3.5 !a85-3
assign (resid 26 and name HG2* ) (resid 27 and name HD1 ) 0 0 5.0 !a176
assign (resid 26 and name HG2* ) (resid 27 and name HD2 ) 0 0 5.0 !a189

! residue 27 (pro)
assign (resid 27 and name HA ) (resid 27 and name HD2 ) 0 0 5.0 !a141-1
assign (resid 27 and name HA ) (resid 27 and name HD1 ) 0 0 3.5 !a141-3
assign (resid 27 and name HA ) (resid 27 and name HB1 ) 0 0 2.7 !a144
assign (resid 27 and name HA ) (resid 27 and name HB2 ) 0 0 2.7 !a145
assign (resid 27 and name HA ) (resid 27 and name HG2 ) 0 0 5.0 !a146
assign (resid 27 and name HA ) (resid 27 and name HG1 ) 0 0 5.0 !a147
assign (resid 27 and name HD1 ) (resid 27 and name HD2 ) 0 0 2.7 !a171
assign (resid 27 and name HD1 ) (resid 27 and name HB2 ) 0 0 5.0 !a172
assign (resid 27 and name HD1 ) (resid 27 and name HB1 ) 0 0 3.5 !a172-1
assign (resid 27 and name HD1 ) (resid 27 and name HG1 ) 0 0 2.7 !a173
assign (resid 27 and name HD1 ) (resid 27 and name HG2 ) 0 0 3.5 !a174
assign (resid 27 and name HD2 ) (resid 27 and name HB1 ) 0 0 5.0 !a185
assign (resid 27 and name HD2 ) (resid 27 and name HB2 ) 0 0 5.0 !a185-1
assign (resid 27 and name HD2 ) (resid 27 and name HG1 ) 0 0 2.7 !a186
assign (resid 27 and name HD2 ) (resid 27 and name HG2 ) 0 0 3.5 !a187
assign (resid 27 and name HB1 ) (resid 27 and name HB2 ) 0 0 2.7 !a277-1
assign (resid 27 and name HB1 ) (resid 27 and name HG1 ) 0 0 3.5 !a278
assign (resid 27 and name HB1 ) (resid 27 and name HG2 ) 0 0 2.7 !a279
assign (resid 27 and name HB2 ) (resid 27 and name HG1 ) 0 0 2.7 !a281
assign (resid 27 and name HB2 ) (resid 27 and name HG2 ) 0 0 3.5 !a282
assign (resid 27 and name HA ) (resid 28 and name HN ) 0 0 3.5 !47
assign (resid 27 and name HB1 ) (resid 28 and name HN ) 0 0 3.5 !52
assign (resid 27 and name HG* ) (resid 28 and name HN ) 0 0 4.5 !54
assign (resid 27 and name HA ) (resid 28 and name HA ) 0 0 5.0 !a47
assign (resid 27 and name HB1 ) (resid 29 and name HN ) 0 0 5.0 !105
assign (resid 27 and name HG2 ) (resid 29 and name HN ) 0 0 5.0 !106

! residue 28 (cys)
assign (resid 28 and name HN ) (resid 28 and name HA ) 0 0 5.0 !46
assign (resid 28 and name HN ) (resid 28 and name HB* ) 0 0 3.7 !48
assign (resid 28 and name HN ) (resid 28 and name HB* ) 0 0 3.7 !49
assign (resid 28 and name HA ) (resid 28 and name HB* ) 0 0 3.7 !a53
assign (resid 28 and name HA ) (resid 28 and name HB* ) 0 0 3.7 !a52
assign (resid 28 and name HB1 ) (resid 28 and name HB2 ) 0 0 2.7 !a224-1
assign (resid 28 and name HB* ) (resid 29 and name HN ) 0 0 4.5 !103
assign (resid 28 and name HB* ) (resid 29 and name HN ) 0 0 4.5 !104
assign (resid 28 and name HA ) (resid 29 and name HN ) 0 0 5.0 !101
assign (resid 28 and name HA ) (resid 29 and name HB* ) 0 0 6.5 !a61
assign (resid 28 and name HN ) (resid 29 and name HN ) 0 0 5.0 !42
assign (resid 28 and name HB* ) (resid 29 and name HB* ) 0 0 8.5 !a227-1
assign (resid 28 and name HN ) (resid 30 and name HN ) 0 0 6.0 !43
assign (resid 28 and name HB* ) (resid 30 and name HB* ) 0 0 7.0 !a227
assign (resid 28 and name HB* ) (resid 30 and name HB* ) 0 0 7.0 !a227-1
assign (resid 28 and name HB* ) (resid 30 and name HB* ) 0 0 7.0 !a241
assign (resid 28 and name HB* ) (resid 30 and name HB* ) 0 0 7.0 !a241-1

! residue 29 (ala)
assign (resid 29 and name HN ) (resid 29 and name HA ) 0 0 2.7 !102
assign (resid 29 and name HN ) (resid 29 and name HB* ) 0 0 4.2 !108
assign (resid 29 and name HA ) (resid 29 and name HB* ) 0 0 4.2 !a140
assign (resid 29 and name HB* ) (resid 30 and name HN ) 0 0 4.2 !234
assign (resid 29 and name HA ) (resid 30 and name HN ) 0 0 2.7 !225
assign (resid 29 and name HN ) (resid 30 and name HN ) 0 0 5.0 !100
assign (resid 29 and name HB* ) (resid 30 and name HA ) 0 0 6.5 !a119

! residue 30 (glu)
assign (resid 30 and name HN ) (resid 30 and name HA ) 0 0 2.7 !224
assign (resid 30 and name HN ) (resid 30 and name HB* ) 0 0 3.7 !232
assign (resid 30 and name HN ) (resid 30 and name HB* ) 0 0 3.7 !233
assign (resid 30 and name HN ) (resid 30 and name HG* ) 0 0 6.0 !229
assign (resid 30 and name HN ) (resid 30 and name HG* ) 0 0 6.0 !231
assign (resid 30 and name HA ) (resid 30 and name HB* ) 0 0 3.7 !a118
assign (resid 30 and name HA ) (resid 30 and name HB* ) 0 0 3.7 !a117
assign (resid 30 and name HA ) (resid 30 and name HG* ) 0 0 3.7 !a115
assign (resid 30 and name HA ) (resid 30 and name HG* ) 0 0 3.7 !a114
assign (resid 30 and name HG* ) (resid 30 and name HG* ) 0 0 4.7 !a258
assign (resid 30 and name HG* ) (resid 30 and name HB* ) 0 0 4.7 !a259
assign (resid 30 and name HG* ) (resid 30 and name HB* ) 0 0 4.7 !a260
assign (resid 30 and name HG* ) (resid 30 and name HB* ) 0 0 4.7 !a270
assign (resid 30 and name HG* ) (resid 30 and name HB* ) 0 0 4.7 !a271

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