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
	646227	6ucj	50007	cing	1-original	4	XPLOR/CNS	distance	NOE	ambi

# Restraints file 7: D_1000244371_mr_P2.xplor-nih.V1
## pIAPP-K4D, DPC micelles, pH 4.5
## error 25%
## spin1 spin2 R LB UB

#intraresidue
#assign ( residue 3 and name HN ) and assign ( (residue 3 and name HG2#) or (residue 3 and name HG2*) ) 4.7176321594 1.1794080399 1.1794080399 #intra "S2 < 0.6"
#assign ( residue 3 and name HN ) and assign ( (residue 3 and name HD1#) or (residue 3 and name HD1*) ) 4.7831875605 1.1957968901 1.1957968901 #intra "S2 < 0.6"
#assign ( residue 4 and name HN ) and assign ( residue 4 and name HB2 ) 3.7110754625 0.9277688656 0.9277688656 #intra "S2 < 0.6"
#assign ( residue 4 and name HN ) and assign ( residue 4 and name HB1 ) 4.4777467308 1.1194366827 1.1194366827 #intra "S2 < 0.6"
#assign ( residue 5 and name HN ) and assign ( (residue 5 and name HA) or (residue 4 and name HA) ) 3.8822708624 0.9705677156 0.9705677156 #intra "S2 < 0.6"
#assign ( residue 5 and name HN ) and assign ( (residue 5 and name HB#) or (residue 5 and name HB*) ) 4.16466392 1.04116598 1.04116598 #intra "S2 < 0.6"
#assign ( residue 6 and name HN ) and assign ( residue 6 and name HB2 ) 4.1676061661 1.0419015415 1.0419015415 #intra "S2 < 0.6"
#assign ( residue 6 and name HN ) and assign ( residue 6 and name HB1 ) 5.0653784528 1.2663446132 1.2663446132 #intra "S2 < 0.6"
#assign ( residue 6 and name HN ) and assign ( residue 6 and name HA ) 3.8371782107 0.9592945527 0.9592945527 #intra "S2 < 0.6"
#assign ( residue 7 and name HN ) and assign ( residue 7 and name HA ) 3.4428676189 0.8607169047 0.8607169047 #intra "S2 < 0.6"
#assign ( residue 7 and name HN ) and assign ( (residue 7 and name HG#) or (residue 7 and name HG*) ) 4.1945366391 1.0486341598 1.0486341598 #intra "S2 < 0.6"
#assign ( residue 7 and name HN ) and assign ( (residue 7 and name HB#) or (residue 7 and name HB*) ) 3.2528637859 0.8132159465 0.8132159465 #intra "S2 < 0.6"
#assign ( residue 8 and name HN ) and assign ( residue 8 and name HB ) 2.7527012832 0.6881753208 0.6881753208 #intra "S2 < 0.6"
#assign ( residue 8 and name HN ) and assign ( residue 8 and name HA ) 3.1612922552 0.7903230638 0.7903230638 #intra "S2 < 0.6"
#assign ( residue 8 and name HN ) and assign ( (residue 8 and name HG#) or (residue 8 and name HG*) ) 3.0910506276 0.7727626569 0.7727626569 #intra "S2 < 0.6"
#assign ( residue 9 and name HN ) and assign ( residue 9 and name HG2 ) 4.0270352956 1.0067588239 1.0067588239 #intra "S2 < 0.6"
#assign ( residue 9 and name HN ) and assign ( residue 9 and name HG1 ) 4.0270352956 1.0067588239 1.0067588239 #intra "S2 < 0.6"
#assign ( residue 9 and name HN ) and assign ( residue 9 and name HB2 ) 2.8771107725 0.7192776931 0.7192776931 #intra "S2 < 0.6"
#assign ( residue 9 and name HN ) and assign ( residue 9 and name HB1 ) 3.1663398968 0.7915849742 0.7915849742 #intra "S2 < 0.6"
#assign ( residue 9 and name HN ) and assign ( residue 9 and name HA ) 3.1489332534 0.7872333134 0.7872333134 #intra "S2 < 0.6"
#assign ( residue 10 and name HN ) and assign ( (residue 10 and name HD#) or (residue 10 and name HD*) ) 3.5538374465 0.8884593616 0.8884593616 #intra "S2 < 0.6"
#assign ( residue 10 and name HN ) and assign ( (residue 10 and name HG#) or (residue 10 and name HG*) ) 4.3893425829 1.0973356457 1.0973356457 #intra "S2 < 0.6"
#assign ( residue 10 and name HN ) and assign ( (residue 10 and name HB#) or (residue 10 and name HB*) ) 2.8667638245 0.7166909561 0.7166909561 #intra "S2 < 0.6"
#assign ( residue 10 and name HN ) and assign ( residue 10 and name HA ) 2.1123710369 0.5280927592 0.5280927592 #intra "S2 < 0.6"
#assign ( residue 12 and name HN ) and assign ( (residue 12 and name HG#) or (residue 12 and name HG*) ) 4.0508658824 1.0127164706 1.0127164706 #intra "S2 < 0.6"
#assign ( residue 12 and name HN ) and assign ( residue 12 and name HA ) 2.0501687364 0.5125421841 0.5125421841 #intra "S2 < 0.6"
#assign ( residue 12 and name HN ) and assign ( (residue 12 and name HB#) or (residue 12 and name HB*) ) 2.6740574902 0.6685143725 0.6685143725 #intra "S2 < 0.6"
assign ( residue 13 and name HN ) and assign ( residue 13 and name HA ) 3.188977936 0.797244484 0.797244484 #intra
assign ( residue 13 and name HN ) and assign ( (residue 13 and name HB#) or (residue 13 and name HB*) ) 2.7787972308 0.6946993077 0.6946993077 #intra
assign ( residue 14 and name HN ) and assign ( residue 14 and name HA ) 3.4073286774 0.8518321694 0.8518321694 #intra
assign ( residue 14 and name HN ) and assign ( residue 14 and name HB* ) 4.0409597816 1.0102399454 1.0102399454 #intra
assign ( residue 14 and name HN ) and assign ( residue 14 and name HB* ) 3.9443255522 0.9860813881 0.9860813881 #intra
assign ( residue 15 and name HN ) and assign ( (residue 15 and name HG2#) or (residue 15 and name HG2*) ) 3.4485053186 1.1621263296 1.1621263296 #intra terminal methyl
#assign ( residue 15 and name HN ) and assign ( residue 15 and name HB ) 3.4244469504 0.8561117376 0.8561117376 #intra overlap with water
assign ( residue 15 and name HN ) and assign ( residue 15 and name HA ) 3.3297980449 0.8324495112 0.8324495112 #intra
assign ( residue 16 and name HN ) and assign ( (residue 16 and name HB#) or (residue 16 and name HB*) ) 2.5197399732 0.9299349933 0.9299349933 #intra terminal methyl
assign ( residue 16 and name HN ) and assign ( residue 16 and name HA ) 3.2140080897 0.8035020224 0.8035020224 #intra
assign ( residue 17 and name HN ) and assign ( residue 17 and name HB ) 2.8598034334 0.7149508583 0.7149508583 #intra
assign ( residue 17 and name HN ) and assign ( residue 17 and name HA ) 3.0954371254 0.7738592814 0.7738592814 #intra
assign ( residue 17 and name HN ) and assign ( (residue 17 and name HG2#) or (residue 17 and name HG2*) ) 3.5198865048 1.1799716262 1.1799716262 #intra terminal methyl
assign ( residue 18 and name HN ) and assign ( (residue 18 and name HB#) or (residue 18 and name HB*) ) 3.0583657539 0.7645914385 0.7645914385 #intra
assign ( residue 18 and name HN ) and assign ( residue 18 and name HA ) 3.4386924176 0.8596731044 0.8596731044 #intra
assign ( residue 19 and name HN ) and assign ( (residue 19 and name HB#) or (residue 19 and name HB*) ) 2.3326772299 0.8831693075 0.8831693075 #intra terminal methyl
assign ( residue 20 and name HN ) and assign ( (residue 20 and name HG2#) or (residue 20 and name HG2*) ) 2.9984276779 1.0496069195 1.0496069195 #intra terminal methyl
assign ( residue 20 and name HN ) and assign ( residue 20 and name HB ) 3.3651795968 0.8412948992 0.8412948992 #intra
assign ( residue 20 and name HN ) and assign ( residue 20 and name HA ) 2.8952280198 0.723807005 0.723807005 #intra
assign ( residue 21 and name HN ) and assign ( residue 21 and name HG2 ) 3.7766755482 0.944168887 0.944168887 #intra
assign ( residue 21 and name HN ) and assign ( residue 21 and name HG1 ) 3.2869260223 0.8217315056 0.8217315056 #intra
assign ( residue 21 and name HN ) and assign ( residue 21 and name HB2 ) 2.9564987335 0.7391246834 0.7391246834 #intra
assign ( residue 21 and name HN ) and assign ( residue 21 and name HB1 ) 2.8554786121 0.713869653 0.713869653 #intra
assign ( residue 21 and name HN ) and assign ( residue 21 and name HA ) 2.809906059 0.7024765147 0.7024765147 #intra
assign ( residue 22 and name HN ) and assign ( residue 22 and name HB1 ) 3.089066572 0.772266643 0.772266643 #intra
assign ( residue 22 and name HN ) and assign ( (residue 22 and name HG#) or (residue 22 and name HG*) ) 3.7688118283 0.9422029571 0.9422029571 #intra
assign ( residue 22 and name HN ) and assign ( residue 22 and name HB2 ) 2.9223688147 0.7305922037 0.7305922037 #intra
assign ( residue 23 and name HN ) and assign ( (residue 23 and name HB#) or (residue 23 and name HB*) or (residue 23 and name HG) ) 2.5041473926 0.6260368482 0.6260368482 #intra
assign ( residue 23 and name HN ) and assign ( residue 23 and name HA ) 2.7709412858 0.6927353214 0.6927353214 #intra
assign ( residue 23 and name HN ) and assign ( (residue 23 and name HD1#) or (residue 23 and name HD2#) ) 4.0405667026 1.3101416756 1.3101416756 #intra terminal methyl
assign ( residue 24 and name HN ) and assign ( (residue 24 and name HB#) or (residue 24 and name HB*) ) 2.3624008527 0.8906002132 0.8906002132 #intra terminal methyl
assign ( residue 24 and name HN ) and assign ( residue 24 and name HA ) 2.7857178604 0.6964294651 0.6964294651 #intra
assign ( residue 25 and name HN ) and assign ( residue 25 and name HB2 ) 2.7436411482 0.685910287 0.685910287 #intra
assign ( residue 25 and name HN ) and assign ( residue 25 and name HB1 ) 2.589601875 0.6474004687 0.6474004687 #intra
assign ( residue 25 and name HN ) and assign ( residue 25 and name HA ) 2.7361110761 0.684027769 0.684027769 #intra
assign ( residue 26 and name HN ) and assign ( residue 26 and name HA ) 2.6749145749 0.6687286437 0.6687286437 #intra
assign ( residue 26 and name HN ) and assign ( residue 26 and name HB2 ) 2.6993817586 0.6748454397 0.6748454397 #intra
assign ( residue 26 and name HN ) and assign ( residue 26 and name HB1 ) 2.6196058755 0.6549014689 0.6549014689 #intra
assign ( residue 26 and name HN ) and assign (( residue 26 and name HD#) or (residue 26 and name HD*) ) 3.6209352613 0.9052338153 0.9052338153 #intra
assign ( residue 27 and name HN ) and assign ( residue 27 and name HA ) 3.2490050714 0.8122512679 0.8122512679 #intra
assign ( residue 27 and name HN ) and assign ( residue 27 and name HG ) 3.3974328473 0.8493582118 0.8493582118 #intra
assign ( residue 27 and name HN ) and assign ( (residue 27 and name HD1#) or (residue 27 and name HD2#) ) 3.0937356247 1.0734339062 1.0734339062 #intra terminal methyl
assign ( residue 28 and name HN ) and assign ( (residue 28 and name HG2#) or (residue 28 and name HG1#) ) 3.4464539318 1.161613483 1.161613483 #intra terminal methyl
assign ( residue 28 and name HN ) and assign ( (residue 28 and name HG1#) or (residue 28 and name HG2#) ) 2.7610352857 0.9902588214 0.9902588214 #intra terminal methyl
assign ( residue 28 and name HN ) and assign ( residue 28 and name HB ) 2.6815943647 0.6703985912 0.6703985912 #intra
assign ( residue 28 and name HN ) and assign ( residue 28 and name HA ) 2.9452511577 0.7363127894 0.7363127894 #intra
assign ( residue 29 and name HN ) and assign ( residue 29 and name HB2 ) 2.9670419952 0.7417604988 0.7417604988 #intra
assign ( residue 29 and name HN ) and assign ( residue 29 and name HD1 ) 4.488572355 1.1221430888 1.1221430888 #intra
assign ( residue 29 and name HN ) and assign ( residue 29 and name HA ) 2.8195712083 0.7048928021 0.7048928021 #intra 
assign ( residue 29 and name HN ) and assign ( residue 29 and name HB1 ) 3.2384321342 0.8096080336 0.8096080336 #intra
assign ( residue 30 and name HN ) and assign ( (residue 30 and name HB#) or (residue 30 and name HB*) ) 2.5697732368 0.6424433092 0.6424433092 #intra
assign ( residue 30 and name HN ) and assign ( residue 30 and name HA ) 2.8701652469 0.7175413117 0.7175413117 #intra
assign ( residue 31 and name HN ) and assign ( (residue 31 and name HB#) or (residue 31 and name HB*) ) 2.6134133669 0.6533533417 0.6533533417 #intra
assign ( residue 31 and name HN ) and assign ( residue 31 and name HA ) 2.7074587431 0.6768646858 0.6768646858 #intra
assign ( residue 32 and name HN ) and assign ( residue 32 and name HD2* ) 4.492438637 1.1231096593 1.1231096593 #intra
assign ( residue 32 and name HN ) and assign ( (residue 32 and name HB#) or (residue 32 and name HB*) ) 2.2998106465 0.5749526616 0.5749526616 #intra
assign ( residue 32 and name HN ) and assign ( residue 32 and name HA ) 2.4599451481 0.614986287 0.614986287 #intra
assign ( residue 33 and name HN ) and assign ( residue 33 and name HD2* ) 5.0147211464 1.2536802866 1.2536802866 #intra
#assign ( residue 33 and name HN ) and assign ( residue 33 and name HA ) 2.4523093381 0.6130773345 0.6130773345 #intra water peak overlap
assign ( residue 33 and name HN ) and assign ( (residue 33 and name HB#) or (residue 33 and name HB*) ) 2.9400209426 0.7350052357 0.7350052357 #intra
assign ( residue 33 and name HN ) and assign ( residue 33 and name HD2* ) 4.2207969455 1.0551992364 1.0551992364 #intra
assign ( residue 34 and name HN ) and assign ( (residue 34 and name HB#) or (residue 34 and name HB*) ) 2.131192526 0.5327981315 0.5327981315 #intra
assign ( residue 34 and name HN ) and assign ( residue 34 and name HA ) 2.5268687411 0.6317171853 0.6317171853 #intra
assign ( residue 34 and name HN ) and assign ( (residue 34 and name HD#) or (residue 34 and name HD*) ) 3.51334713 0.8783367825 0.8783367825 #intra
assign ( residue 35 and name HN ) and assign ( residue 35 and name HA* ) 2.3555654944 0.5888913736 0.5888913736 #intra
assign ( residue 35 and name HN ) and assign ( residue 35 and name HA* ) 2.5538546842 0.6384636711 0.6384636711 #intra
assign ( residue 36 and name HN ) and assign ( (residue 36 and name HB#) or (residue 36 and name HB*) ) 2.0047414507 0.8011853627 0.8011853627 #intra terminal methyl
assign ( residue 36 and name HN ) and assign ( residue 36 and name HA ) 2.3690176359 0.592254409 0.592254409 #intra
assign ( residue 37 and name HN ) and assign ( (residue 37 and name HG2#) or (residue 37 and name HG2*) ) 2.902566253 1.0256415632 1.0256415632 #intra terminal methyl
assign ( residue 37 and name HN ) and assign ( residue 37 and name HG1* ) 2.6992322106 0.6748080527 0.6748080527 #intra
assign ( residue 37 and name HN ) and assign ( residue 37 and name HB ) 2.2582875811 0.5645718953 0.5645718953 #intra
assign ( residue 37 and name HN ) and assign ( (residue 37 and name HD1#) or (residue 37 and name HD1*) ) 2.8336920908 1.0084230227 1.0084230227 #intra terminal methyl
assign ( residue 37 and name HN ) and assign ( residue 37 and name HG1* ) 3.2202099597 0.8050524899 0.8050524899 #intra
assign ( residue 37 and name HN ) and assign ( residue 37 and name HA ) 2.5949078393 0.6487269598 0.6487269598 #intra
#assign ( residue 38 and name HN ) and assign ( residue 38 and name HG ) 2.9292675675 0.7323168919 0.7323168919 #intra too much overlap with L38 HB#
assign ( residue 38 and name HN ) and assign ( (residue 38 and name HB#) or (residue 38 and name HB*) or (residue 38 and name HG) ) 2.4171326484 0.9042831621 0.9042831621 #intra linear combination
assign ( residue 38 and name HN ) and assign ( residue 38 and name HA ) 2.67615645 0.6690391125 0.6690391125 #intra
assign ( residue 39 and name HN ) and assign ( residue 39 and name HA ) 2.4816445395 0.6204111349 0.6204111349 #intra
#assign ( residue 40 and name HN ) and assign ( (residue 40 and name HB#) or (residue 40 and name HB*) ) 2.5846415646 0.6461603911 0.6461603911 #intra "S2 < 0.6"
#assign ( residue 40 and name HN ) and assign ( residue 40 and name HA ) 2.5842895004 0.6460723751 0.6460723751 #intra "S2 < 0.6"
#assign ( residue 41 and name HN ) and assign ( residue 41 and name HA ) 2.8051618331 0.7012904583 0.7012904583 #intra "S2 < 0.6"
#assign ( residue 41 and name HN ) and assign ( (residue 41 and name HG2#) or (residue 41 and name HG2*) ) 2.5421090813 0.6355272703 0.6355272703 #intra "S2 < 0.6"
#assign ( residue 41 and name HN ) and assign ( residue 41 and name HB ) 2.6556866529 0.6639216632 0.6639216632 #intra "S2 < 0.6"
#assign ( residue 42 and name HN ) and assign ( residue 42 and name HD2* ) 5.3212178816 1.3303044704 1.3303044704 #intra "S2 < 0.6"
#assign ( residue 42 and name HN ) and assign ( residue 42 and name HB2 ) 3.024712831 0.7561782077 0.7561782077 #intra "S2 < 0.6"
#assign ( residue 42 and name HN ) and assign ( residue 42 and name HB1 ) 2.6120381102 0.6530095276 0.6530095276 #intra "S2 < 0.6"
#assign ( residue 42 and name HN ) and assign ( residue 42 and name HA ) 2.3537913197 0.5884478299 0.5884478299 #intra "S2 < 0.6"
#assign ( residue 43 and name HN ) and assign ( (residue 43 and name HG#) or (residue 43 and name HG*) ) 2.0990425629 0.5247606407 0.5247606407 #intra "S2 < 0.6"
#assign ( residue 43 and name HN ) and assign ( residue 43 and name HB ) 2.3152164513 0.5788041128 0.5788041128 #intra "S2 < 0.6"
#assign ( residue 43 and name HN ) and assign ( residue 43 and name HA ) 2.4129167071 0.6032291768 0.6032291768 #intra "S2 < 0.6"
#assign ( residue 45 and name HN ) and assign ( residue 45 and name HA ) 2.4878939543 0.6219734886 0.6219734886 #intra "S2 < 0.6"
#assign ( residue 46 and name HN ) and assign ( residue 46 and name HA ) 2.3770794123 0.5942698531 0.5942698531 #intra "S2 < 0.6"
#assign ( residue 46 and name HN ) and assign ( (residue 46 and name HB#) or (residue 46 and name HB*) ) 2.3618466099 0.5904616525 0.5904616525 #intra "S2 < 0.6"
#assign ( residue 47 and name HN ) and assign ( (residue 47 and name HG2#) or (residue 47 and name HG2*) ) 2.903423608 0.725855902 0.725855902 #intra "S2 < 0.6"
#assign ( residue 47 and name HN ) and assign ( residue 47 and name HB ) 2.4970608885 0.6242652221 0.6242652221 #intra "S2 < 0.6"
#assign ( residue 47 and name HN ) and assign ( residue 47 and name HA ) 2.554452365 0.6386130913 0.6386130913 #intra "S2 < 0.6"
#assign ( residue 48 and name HN ) and assign ( (residue 48 and name HD#) or (residue 48 and name HD*) ) 3.0806851587 0.7701712897 0.7701712897 #intra "S2 < 0.6"
#assign ( residue 48 and name HN ) and assign ( residue 48 and name HB1 ) 2.6644796033 0.6661199008 0.6661199008 #intra "S2 < 0.6"
#assign ( residue 48 and name HN ) and assign ( residue 48 and name HB2 ) 2.4079057892 0.6019764473 0.6019764473 #intra "S2 < 0.6"
#assign ( residue 48 and name HN ) and assign ( residue 48 and name HA ) 2.4750161503 0.6187540376 0.6187540376 #intra "S2 < 0.6"
#assign ( residue 49 and name HN ) and assign ( (residue 49 and name HA#) or (residue 49 and name HA*) ) 2.1257061816 0.5314265454 0.5314265454 #intra "S2 < 0.6"
#assign ( residue 50 and name HN ) and assign ( residue 50 and name HG1 ) 3.4731119905 0.8682779976 0.8682779976 #intra "S2 < 0.6"
#assign ( residue 50 and name HN ) and assign ( (residue 50 and name HD#) or (residue 50 and name HD*) ) 3.6426464653 0.9106616163 0.9106616163 #intra "S2 < 0.6"
#assign ( residue 50 and name HN ) and assign ( residue 50 and name HG2 ) 3.7355515262 0.9338878816 0.9338878816 #intra "S2 < 0.6"
#assign ( residue 50 and name HN ) and assign ( residue 50 and name HA ) 2.7763049742 0.6940762436 0.6940762436 #intra "S2 < 0.6"
assign ( residue 51 and name HN ) and assign ( residue 51 and name HA ) 2.2858069173 0.5714517293 0.5714517293 #intra
assign ( residue 51 and name HN ) and assign ( (residue 51 and name HD#) or (residue 51 and name HD*) ) 4.7717681135 1.1929420284 1.1929420284 #intra
assign ( residue 51 and name HN ) and assign ( (residue 51 and name HG#) or (residue 51 and name HG*) ) 3.3497292668 0.8374323167 0.8374323167 #intra
assign ( residue 51 and name HN ) and assign ( (residue 51 and name HB#) or (residue 51 and name HB*) ) 2.1785761736 0.5446440434 0.5446440434 #intra
assign ( residue 52 and name HN ) and assign ( residue 52 and name HA ) 2.665379613 0.6663449033 0.6663449033 #intra
assign ( residue 52 and name HN ) and assign ( (residue 52 and name HB#) or (residue 52 and name HB*) ) 2.5798145875 0.6449536469 0.6449536469 #intra
assign ( residue 53 and name HN ) and assign ( (residue 53 and name HB#) or (residue 53 and name HB*) ) 2.2708922072 0.5677230518 0.5677230518 #intra
assign ( residue 53 and name HN ) and assign ( residue 53 and name HA ) 2.8450933819 0.7112733455 0.7112733455 #intra
assign ( residue 54 and name HN ) and assign ( (residue 54 and name HB) or (residue 55 and name HB*) or (residue 55 and name HB#) or (residue 56 and name HB) ) 2.3796278017 0.8949069504 0.8949069504 #intra linear combination
assign ( residue 54 and name HN ) and assign ( (residue 54 and name HG#) or (residue 54 and name HG*) or (residue 56 and name HG*) or (residue 56 and name HG#) ) 2.4350826264 1.0087706566 1.0087706566 #intra terminal methyl & linear combination
assign ( residue 54 and name HN ) and assign ( residue 54 and name HA ) 2.7208194492 0.6802048623 0.6802048623 #intra
assign ( residue 54 and name HN ) and assign ( (residue 54 and name HG#) or (residue 54 and name HG*) or (residue 56 and name HG*) or (residue 56 and name HG#) ) 3.2751724675 1.1187931169 1.1187931169 #intra terminal methyl & linear combination
assign ( residue 55 and name HN ) and assign ( (residue 55 and name HB#) or (residue 55 and name HB*) ) 2.35540342 0.588850855 0.588850855 #intra
assign ( residue 55 and name HN ) and assign ( residue 55 and name HA ) 2.7726641751 0.6931660438 0.6931660438 #intra
assign ( residue 55 and name HN ) and assign ( (residue 55 and name HG#) or (residue 55 and name HG*) ) 2.9959286633 0.7489821658 0.7489821658 #intra
assign ( residue 56 and name HN ) and assign ( (residue 56 and name HG#) or (residue 56 and name HG*) or (residue 54 and name HG#) or (residue 54 and name HG*) ) 2.6307183301 1.0576795825 1.0576795825 #intra terminal methyl & linear combination
assign ( residue 56 and name HN ) and assign ( (residue 56 and name HG#) or (residue 56 and name HG*) or (residue 54 and name HG#) or (residue 54 and name HG*) ) 3.4158819435 1.2539704859 1.2539704859 #intra terminal methyl & linear combination
assign ( residue 56 and name HN ) and assign ( (residue 56 and name HB) or (residue 54 and name HB) or (residue 55 and name HB#) or (residue 55 and name HB*) ) 2.4718196385 0.9179549096 0.9179549096 #intra linear combination
assign ( residue 56 and name HN ) and assign ( residue 56 and name HA ) 2.8942733697 0.7235683424 0.7235683424 #intra
assign ( residue 57 and name HN ) and assign ( (residue 57 and name HD#) or (residue 57 and name HD*) ) 3.5496999063 1.1874249766 1.1874249766 #intra terminal methyl
assign ( residue 57 and name HN ) and assign ( residue 57 and name HA ) 2.8618101873 0.7154525468 0.7154525468 #intra
assign ( residue 57 and name HN ) and assign ( (residue 57 and name HB#) or (residue 57 and name HB*) or (residue 58 and name HD*) or (residue 62 and name HG) ) 3.2410994641 0.810274866 0.810274866 #intra
assign ( residue 58 and name HN ) and assign ( residue 58 and name HD* ) 4.2031961651 1.0507990413 1.0507990413 #intra
assign ( residue 58 and name HN ) and assign ( (residue 58 and name HG#) or (residue 58 and name HG*) ) 3.4824513965 0.8706128491 0.8706128491 #intra
assign ( residue 58 and name HN ) and assign ( (residue 58 and name HB#) or (residue 58 and name HB*) ) 2.7351789592 0.6837947398 0.6837947398 #intra
assign ( residue 58 and name HN ) and assign ( residue 58 and name HA ) 2.7898358409 0.6974589602 0.6974589602 #intra
assign ( residue 58 and name HN ) and assign ( (residue 58 and name HD*) or (residue 57 and name HB*) ) 3.2041503897 0.8010375974 0.8010375974 #intra
assign ( residue 59 and name HN ) and assign ( residue 59 and name HA ) 3.2124901244 0.8031225311 0.8031225311 #intra
assign ( residue 59 and name HN ) and assign ( (residue 59 and name HG#) or (residue 59 and name HG*) ) 3.8087322285 0.9521830571 0.9521830571 #intra
assign ( residue 59 and name HN ) and assign ( (residue 59 and name HB#) or (residue 59 and name HB*) ) 2.8284558519 0.707113963 0.707113963 #intra
assign ( residue 60 and name HN ) and assign ( residue 60 and name HG* ) 3.7691953618 0.9422988404 0.9422988404 #intra
assign ( residue 60 and name HN ) and assign ( (residue 60 and name HB#) or (residue 60 and name HB*) ) 2.6031931284 0.6507982821 0.6507982821 #intra
assign ( residue 60 and name HN ) and assign ( residue 60 and name HA ) 2.7722758513 0.6930689628 0.6930689628 #intra
assign ( residue 60 and name HN ) and assign ( residue 60 and name HG* ) 3.6012999032 0.9003249758 0.9003249758 #intra
assign ( residue 62 and name HN ) and assign ( (residue 62 and name HB#) or (residue 62 and name HB*) ) 2.4550779464 0.6137694866 0.6137694866 #intra
assign ( residue 62 and name HN ) and assign ( residue 62 and name HA ) 2.8481007232 0.7120251808 0.7120251808 #intra
assign ( residue 62 and name HN ) and assign ( (residue 62 and name HD2#) or (residue 62 and name HD1#) ) 3.808921316 1.252230329 1.252230329 #intra terminal methyl
assign ( residue 62 and name HN ) and assign ( (residue 62 and name HD1#) or (residue 62 and name HD2#) ) 4.0212618821 1.3053154705 1.3053154705 #intra terminal methyl
assign ( residue 62 and name HN ) and assign ( residue 62 and name HG ) 3.2779779405 0.8194944851 0.8194944851 #intra
assign ( residue 63 and name HN ) and assign ( (residue 63 and name HB#) or (residue 63 and name HB*) ) 2.5295138064 0.6323784516 0.6323784516 #intra
assign ( residue 63 and name HN ) and assign ( residue 63 and name HA ) 2.6933884467 0.6733471117 0.6733471117 #intra
#assign ( residue 64 and name HN ) and assign ( residue 64 and name HB1 ) 2.6818667718 0.6704666929 0.6704666929 #intra "S2 < 0.6"
#assign ( residue 64 and name HN ) and assign ( residue 64 and name HA ) 2.7223362939 0.6805840735 0.6805840735 #intra "S2 < 0.6"
#assign ( residue 64 and name HN ) and assign ( residue 64 and name HB2 ) 3.0845220324 0.7711305081 0.7711305081 #intra "S2 < 0.6"
#assign ( residue 64 and name HN ) and assign ( (residue 64 and name HE#) or (residue 64 and name HE*) ) 4.8072787376 1.2018196844 1.2018196844 #intra "S2 < 0.6"
#assign ( residue 64 and name HN ) and assign ( (residue 64 and name HD#) or (residue 64 and name HD*) ) 2.989765812 0.747441453 0.747441453 #intra "S2 < 0.6"
#assign ( residue 65 and name HN ) and assign ( (residue 65 and name HB#) or (residue 65 and name HB*) ) 3.2776126974 0.8194031743 0.8194031743 #intra "S2 < 0.6"
#assign ( residue 65 and name HN ) and assign ( residue 65 and name HA ) 2.8020889183 0.7005222296 0.7005222296 #intra "S2 < 0.6"
#assign ( residue 65 and name HN ) and assign ( (residue 65 and name HD#) or (residue 65 and name HD*) ) 3.3778023971 0.8444505993 0.8444505993 #intra "S2 < 0.6"
#assign ( residue 65 and name HN ) and assign ( (residue 65 and name HG) or (residue 62 and name HB*) or (residue 68 and name HB*) ) 2.2949606226 0.5737401557 0.5737401557 #intra "S2 < 0.6"
#assign ( residue 67 and name HN ) and assign ( (residue 67 and name HB#) or (residue 67 and name HB*) ) 2.2956464634 0.5739116159 0.5739116159 #intra "S2 < 0.6"
#assign ( residue 67 and name HN ) and assign ( residue 67 and name HG ) 2.2956464634 0.5739116159 0.5739116159 #intra "S2 < 0.6"
#assign ( residue 67 and name HN ) and assign ( residue 67 and name HA ) 2.6599668686 0.6649917171 0.6649917171 #intra "S2 < 0.6"
#assign ( residue 67 and name HN ) and assign ( (residue 67 and name HD1#) or (residue 67 and name HD2#) ) 3.8490989865 0.9622747466 0.9622747466 #intra "S2 < 0.6"
#assign ( residue 68 and name HN ) and assign ( residue 68 and name HA ) 2.0566563132 0.5141640783 0.5141640783 #intra "S2 < 0.6"
#assign ( residue 68 and name HN ) and assign ( residue 68 and name HB2 ) 2.7471737806 0.6867934452 0.6867934452 #intra "S2 < 0.6"
#assign ( residue 68 and name HN ) and assign ( (residue 68 and name HG#) or (residue 68 and name HG*) ) 3.6587801403 0.9146950351 0.9146950351 #intra "S2 < 0.6"
#assign ( residue 68 and name HN ) and assign ( (residue 68 and name HD#) or (residue 68 and name HD*) ) 3.2064169742 0.8016042435 0.8016042435 #intra "S2 < 0.6"
#assign ( residue 68 and name HN ) and assign ( residue 68 and name HB1 ) 3.0124062099 0.7531015525 0.7531015525 #intra "S2 < 0.6"
#assign ( residue 69 and name HN ) and assign ( (residue 69 and name HD#) or (residue 69 and name HD*) ) 4.3835283239 1.095882081 1.095882081 #intra "S2 < 0.6"
#assign ( residue 69 and name HN ) and assign ( residue 69 and name HB2 ) 2.7806595489 0.6951648872 0.6951648872 #intra "S2 < 0.6"
#assign ( residue 69 and name HN ) and assign ( residue 69 and name HA ) 1.9661430433 0.4915357608 0.4915357608 #intra "S2 < 0.6"
#assign ( residue 69 and name HN ) and assign ( residue 69 and name HB1 ) 3.0106479512 0.7526619878 0.7526619878 #intra "S2 < 0.6"
#assign ( residue 69 and name HN ) and assign ( (residue 69 and name HG#) or (residue 69 and name HG*) ) 3.4480602129 0.8620150532 0.8620150532 #intra "S2 < 0.6"
#assign ( residue 70 and name HN ) and assign ( (residue 70 and name HD#) or (residue 70 and name HD*) ) 3.9408775709 0.9852193927 0.9852193927 #intra "S2 < 0.6"
#assign ( residue 70 and name HN ) and assign ( (residue 70 and name HG#) or (residue 70 and name HG*) ) 4.1962538081 1.049063452 1.049063452 #intra "S2 < 0.6"
#assign ( residue 70 and name HN ) and assign ( residue 70 and name HB2 ) 2.8609607649 0.7152401912 0.7152401912 #intra "S2 < 0.6"
#assign ( residue 70 and name HN ) and assign ( residue 70 and name HA ) 1.9645093482 0.491127337 0.491127337 #intra "S2 < 0.6"
#assign ( residue 70 and name HN ) and assign ( residue 70 and name HB1 ) 3.2183109665 0.8045777416 0.8045777416 #intra "S2 < 0.6"
#assign ( residue 71 and name HN ) and assign ( residue 71 and name HB2 ) 3.8457650616 0.9614412654 0.9614412654 #intra "S2 < 0.6"
#assign ( residue 71 and name HN ) and assign ( residue 71 and name HA ) 2.3851827771 0.5962956943 0.5962956943 #intra "S2 < 0.6"
#assign ( residue 71 and name HN ) and assign ( residue 71 and name HB1 ) 3.9345685569 0.9836421392 0.9836421392 #intra "S2 < 0.6"
#assign ( residue 72 and name HN ) and assign ( (residue 72 and name HB#) or (residue 72 and name HB*) ) 4.7177459199 1.17943648 1.17943648 #intra "S2 < 0.6"
#assign ( residue 72 and name HN ) and assign ( residue 72 and name HA ) 2.9105826117 0.7276456529 0.7276456529 #intra "S2 < 0.6"

#sequential
#assign (residue 4 and name HN ) and assign (residue 3 and name HA ) 2.904878637 0.7262196592 0.7262196592 #seq "S2 < 0.6"
#assign (residue 5 and name HN ) and assign (residue 4 and name HB2 ) 4.8421539389 1.2105384847 1.2105384847 #seq "S2 < 0.6"
#assign (residue 5 and name HN ) and assign (residue 6 and name HA ) 4.4317287278 1.1079321819 1.1079321819 #seq "S2 < 0.6"
#assign (residue 5 and name HN ) and assign (residue 4 and name HA ) 2.6135432654 0.6533858164 0.6533858164 #seq "S2 < 0.6"
#assign (residue 6 and name HN ) and assign (residue 5 and name HA ) 3.1738708076 0.7934677019 0.7934677019 #seq "S2 < 0.6"
#assign (residue 7 and name HN ) and assign ((residue 8 and name HB) or (residue 9 and name HB1) ) 4.1106250136 1.0276562534 1.0276562534 #seq "S2 < 0.6"
#assign (residue 7 and name HN ) and assign (residue 6 and name HB2 ) 4.8991968946 1.2247992236 1.2247992236 #seq "S2 < 0.6"
#assign (residue 7 and name HN ) and assign (residue 6 and name HB1 ) 5.0999608981 1.2749902245 1.2749902245 #seq "S2 < 0.6"
#assign (residue 7 and name HN ) and assign (residue 6 and name HA ) 4.1989226371 1.0497306593 1.0497306593 #seq water peak overlap "S2 < 0.6"
#assign (residue 8 and name HN ) and assign (residue 7 and name HA ) 2.1442033687 0.5360508422 0.5360508422 #seq "S2 < 0.6"
#assign (residue 8 and name HN ) and assign (residue 9 and name HB2 ) 4.5334911154 1.1333727788 1.1333727788 #seq "S2 < 0.6"
#assign (residue 8 and name HN ) and assign (residue 9 and name HN ) 4.1211857264 1.0302964316 1.0302964316 #seq "S2 < 0.6"
#assign (residue 8 and name HN ) and assign ((residue 7 and name HB#) or (residue 7 and name HB*) ) 4.6448571265 1.1612142816 1.1612142816 #seq "S2 < 0.6"
#assign (residue 9 and name HN ) and assign (residue 8 and name HN ) 3.1731387303 0.7932846826 0.7932846826 #seq "S2 < 0.6"
#assign (residue 9 and name HN ) and assign (residue 8 and name HA ) 2.0359528258 0.5089882065 0.5089882065 #seq "S2 < 0.6"
#assign (residue 9 and name HN ) and assign ((residue 8 and name HG#) or (residue 8 and name HG*) ) 3.5982394903 0.8995598726 0.8995598726 #seq "S2 < 0.6"
#assign (residue 12 and name HN ) and assign (residue 13 and name HN ) 3.6458561971 0.9114640493 0.9114640493 #seq "S2 < 0.6"
#assign (residue 12 and name HN ) and assign ((residue 11 and name HA) or (residue 12 and name HA) ) 2.0810743202 0.5202685801 0.5202685801 #seq "S2 < 0.6"
assign (residue 13 and name HN ) and assign (residue 12 and name HA ) 2.2632445541 0.5658111385 0.5658111385 #seq
assign (residue 13 and name HN ) and assign ((residue 12 and name HB#) or (residue 12 and name HB*) ) 3.7594486344 0.9398621586 0.9398621586 #seq
assign (residue 13 and name HN ) and assign (residue 12 and name HN ) 4.1028240782 1.0257060196 1.0257060196 #seq
assign (residue 14 and name HN ) and assign (residue 13 and name HA ) 2.5234039692 0.6308509923 0.6308509923 #seq
assign (residue 14 and name HN ) and assign ((residue 15 and name HG2#) or (residue 15 and name HG2*) ) 5.0713288756 1.5678322189 1.5678322189 #seq terminal methyl
assign (residue 14 and name HN ) and assign ((residue 13 and name HB#) or (residue 13 and name HB*) ) 4.0116715655 1.0029178914 1.0029178914 #seq
assign (residue 14 and name HN ) and assign (residue 15 and name HN ) 3.2396000273 0.8099000068 0.8099000068 #seq
#assign (residue 14 and name HN ) and assign (residue 15 and name HB ) 2.576546621 0.6441366553 0.6441366553 #seq overlap with water
assign (residue 15 and name HN ) and assign (residue 14 and name HA ) 3.2100759603 0.8025189901 0.8025189901 #seq
assign (residue 15 and name HN ) and assign (residue 14 and name HN ) 3.1861737814 0.7965434454 0.7965434454 #seq
assign (residue 15 and name HN ) and assign (residue 16 and name HN ) 4.855465328 1.213866332 1.213866332 #seq
assign (residue 15 and name HN ) and assign ((residue 14 and name HB1) or (residue 14 and name HB2) ) 4.5970741559 1.149268539 1.149268539 #seq
assign (residue 15 and name HN ) and assign ((residue 14 and name HB1) or (residue 14 and name HB2) ) 5.0812268794 1.2703067199 1.2703067199 #seq
assign (residue 16 and name HN ) and assign ((residue 15 and name HG2#) or (residue 15 and name HG2*) ) 3.7686255761 1.242156394 1.242156394 #seq terminal methyl
assign (residue 16 and name HN ) and assign (residue 15 and name HN ) 4.6713928031 1.1678482008 1.1678482008 #seq
assign (residue 16 and name HN ) and assign (residue 17 and name HN ) 3.4621806181 0.8655451545 0.8655451545 #seq
#assign (residue 16 and name HN ) and assign (residue 15 and name HB ) 2.9034142801 0.72585357 0.72585357 #seq overlap with water
assign (residue 16 and name HN ) and assign (residue 15 and name HA ) 2.6296831171 0.6574207793 0.6574207793 #seq
assign (residue 17 and name HN ) and assign ((residue 18 and name HB#) or (residue 18 and name HB*) ) 4.922727939 1.2306819848 1.2306819848 #seq
assign (residue 17 and name HN ) and assign (residue 18 and name HA ) 4.5183613636 1.1295903409 1.1295903409 #seq
assign (residue 17 and name HN ) and assign (residue 18 and name HN ) 3.2857032099 0.8214258025 0.8214258025 #seq
assign (residue 17 and name HN ) and assign (residue 16 and name HN ) 3.1475338277 0.7868834569 0.7868834569 #seq
assign (residue 17 and name HN ) and assign ((residue 16 and name HB#) or (residue 16 and name HB*) ) 2.8508163097 1.0127040774 1.0127040774 #seq terminal methyl
assign (residue 18 and name HN ) and assign (residue 19 and name HA ) 4.4440687814 1.1110171954 1.1110171954 #seq
assign (residue 18 and name HN ) and assign (residue 17 and name HB ) 3.7053607737 0.9263401934 0.9263401934 #seq
assign (residue 18 and name HN ) and assign ((residue 19 and name HB#) or (residue 19 and name HB*) ) 4.5479409338 1.4369852334 1.4369852334 #seq terminal methyl
assign (residue 18 and name HN ) and assign (residue 19 and name HN ) 3.0878114505 0.7719528626 0.7719528626 #seq
assign (residue 18 and name HN ) and assign (residue 17 and name HN ) 3.211256553 0.8028141383 0.8028141383 #seq
assign (residue 19 and name HN ) and assign ((residue 20 and name HG2#) or (residue 20 and name HG2*) ) 4.9083074092 1.5270768523 1.5270768523 #seq terminal methyl
assign (residue 19 and name HN ) and assign ((residue 18 and name HB#) or (residue 18 and name HB*) ) 2.9770827411 0.7442706853 0.7442706853 #seq
assign (residue 19 and name HN ) and assign (residue 18 and name HA ) 3.4445365494 0.8611341373 0.8611341373 #seq
assign (residue 19 and name HN ) and assign (residue 20 and name HA ) 7.058443716 1.764610929 1.764610929 #seq
assign (residue 19 and name HN ) and assign (residue 18 and name HN ) 3.376099879 0.8440249697 0.8440249697 #seq
assign (residue 20 and name HN ) and assign ((residue 19 and name HB#) or (residue 19 and name HB*) ) 2.9806008321 1.045150208 1.045150208 #seq terminal methyl
assign (residue 20 and name HN ) and assign ((residue 21 and name HA) or (residue 19 and name HA) ) 3.2170972165 0.8042743041 0.8042743041 #seq
assign (residue 20 and name HN ) and assign (residue 21 and name HN ) 3.026077359 0.7565193397 0.7565193397 #seq
assign (residue 21 and name HN ) and assign ((residue 20 and name HG2#) or (residue 20 and name HG2*) ) 3.8650587459 1.2662646865 1.2662646865 #seq terminal methyl
assign (residue 21 and name HN ) and assign (residue 20 and name HB ) 3.3676453128 0.8419113282 0.8419113282 #seq
assign (residue 21 and name HN ) and assign (residue 20 and name HA ) 3.8263611128 0.9565902782 0.9565902782 #seq
assign (residue 21 and name HN ) and assign ((residue 22 and name HD#) or (residue 22 and name HD*) or (residue 18 and name HB*)) 4.8255739354 1.2063934839 1.2063934839 #seq
assign (residue 21 and name HN ) and assign ((residue 22 and name HG#) or (residue 22 and name HG*) ) 5.0081857587 1.2520464397 1.2520464397 #seq
assign (residue 21 and name HN ) and assign (residue 20 and name HN ) 2.9750531792 0.7437632948 0.7437632948 #seq
assign (residue 21 and name HN ) and assign (residue 22 and name HN ) 2.9650040781 0.7412510195 0.7412510195 #seq
assign (residue 22 and name HN ) and assign ((residue 23 and name HA) or ( residue 22 and name HA) ) 2.9987992932 0.7496998233 0.7496998233 #seq
assign (residue 22 and name HN ) and assign (residue 23 and name HN ) 3.0679635141 0.7669908785 0.7669908785 #seq
assign (residue 22 and name HN ) and assign ((residue 21 and name HB1) or (residue 21 and name HB2) ) 3.6862755062 0.9215688765 0.9215688765 #seq
assign (residue 22 and name HN ) and assign ((residue 21 and name HB1) or (residue 21 and name HB2) ) 3.7251427406 0.9312856852 0.9312856852 #seq
assign (residue 22 and name HN ) and assign (residue 21 and name HA ) 3.3705880889 0.8426470222 0.8426470222 #seq
assign (residue 22 and name HN ) and assign ((residue 23 and name HG) or (residue 23 and name HB*) ) 3.7688118283 0.9422029571 0.9422029571 #seq
assign (residue 23 and name HN ) and assign ((residue 24 and name HB#) or (residue 24 and name HB*) ) 4.2488374473 1.3622093618 1.3622093618 #seq terminal methyl
assign (residue 23 and name HN ) and assign ((residue 22 and name HB1) or (residue 22 and name HB2) ) 3.6591527298 0.9147881825 0.9147881825 #seq
assign (residue 23 and name HN ) and assign (residue 22 and name HA ) 2.7709412858 0.6927353214 0.6927353214 #seq
assign (residue 23 and name HN ) and assign ((residue 22 and name HB1) or (residue 22 and name HB2) ) 2.7273410746 0.6818352687 0.6818352687 #seq
assign (residue 23 and name HN ) and assign (residue 24 and name HN ) 3.0481240019 0.7620310005 0.7620310005 #seq
assign (residue 23 and name HN ) and assign (residue 22 and name HN ) 3.1804585693 0.7951146423 0.7951146423 #seq
assign (residue 24 and name HN ) and assign (residue 23 and name HA ) 3.6274098041 0.906852451 0.906852451 #seq
assign (residue 24 and name HN ) and assign (residue 23 and name HN ) 3.0191576781 0.7547894195 0.7547894195 #seq
assign (residue 24 and name HN ) and assign (residue 25 and name HN ) 2.6694092155 0.6673523039 0.6673523039 #seq
assign (residue 24 and name HN ) and assign ((residue 23 and name HG ) or (residue 23 and name HB# ) or (residue 23 and name HB*)) 3.0845656907 0.7711414227 0.7711414227 #seq
assign (residue 25 and name HN ) and assign (residue 26 and name HN ) 2.9079780016 0.7269945004 0.7269945004 #seq
assign (residue 25 and name HN ) and assign ((residue 24 and name HB#) or (residue 24 and name HB*) ) 2.6877117539 0.9719279385 0.9719279385 #seq terminal methyl
assign (residue 25 and name HN ) and assign (residue 24 and name HA ) 3.5165569142 0.8791392286 0.8791392286 #seq
assign (residue 25 and name HN ) and assign (residue 24 and name HN ) 2.866154182 0.7165385455 0.7165385455 #seq
assign (residue 26 and name HN ) and assign (residue 25 and name HN ) 2.8850485382 0.7212621345 0.7212621345 #seq
assign (residue 26 and name HN ) and assign (residue 27 and name HN ) 2.9798217327 0.7449554332 0.7449554332 #seq
assign (residue 26 and name HN ) and assign ((residue 25 and name HB1) or (residue 25 and name HB2) ) 3.3835152418 0.8458788105 0.8458788105 #seq
assign (residue 26 and name HN ) and assign ((residue 27 and name HD#) or (residue 27 and name HD*) ) 4.4760279566 1.4190069892 1.4190069892 #seq terminal methyl
assign (residue 26 and name HN ) and assign ((residue 27 and name HB1) or (residue 27 and name HB2) ) 4.4046629626 1.1011657407 1.1011657407 #seq
assign (residue 26 and name HN ) and assign ((residue 25 and name HB1) or (residue 25 and name HB2) ) 3.370820143 0.8427050357 0.8427050357 #seq
assign (residue 26 and name HN ) and assign (residue 25 and name HA ) 2.8682892033 0.7170723008 0.7170723008 #seq
assign (residue 26 and name HN ) and assign ((residue 27 and name HB1) or (residue 27 and name HB2) ) 4.3666364917 1.0916591229 1.0916591229 #seq
assign (residue 27 and name HN ) and assign (residue 28 and name HN ) 3.3976954158 0.849423854 0.849423854 #seq
assign (residue 27 and name HN ) and assign (residue 26 and name HN ) 3.3010805844 0.8252701461 0.8252701461 #seq
assign (residue 27 and name HN ) and assign (residue 26 and name HA ) 3.8015058793 0.9503764698 0.9503764698 #seq
assign (residue 27 and name HN ) and assign ((residue 28 and name HG1#) or (residue 28 and name HG1*) or (residue 27 and name HD*) ) 4.0022229918 1.4005557479 1.4005557479 #seq terminal methyl & linear combination
assign (residue 27 and name HN ) and assign ((residue 26 and name HB1) or (residue 26 and name HB2) ) 3.6168142273 0.9042035568 0.9042035568 #seq
assign (residue 27 and name HN ) and assign (residue 28 and name HA ) 4.5226860811 1.1306715203 1.1306715203 #seq
assign (residue 27 and name HN ) and assign ((residue 26 and name HB1) or (residue 26 and name HB2) ) 3.9811063026 0.9952765757 0.9952765757 #seq
assign (residue 27 and name HN ) and assign ((residue 26 and name HD#) or (residue 26 and name HD*) ) 4.2106206729 1.0526551682 1.0526551682 #seq
assign (residue 28 and name HN ) and assign (residue 29 and name HN ) 2.9944458225 0.7486114556 0.7486114556 #seq
assign (residue 28 and name HN ) and assign (residue 27 and name HN ) 3.3301499417 0.8325374854 0.8325374854 #seq
assign (residue 28 and name HN ) and assign (residue 27 and name HA ) 3.8961083769 0.9740270942 0.9740270942 #seq
assign (residue 28 and name HN ) and assign (residue 27 and name HG ) 3.7102070746 0.9275517687 0.9275517687 #seq
assign (residue 28 and name HN ) and assign ((residue 27 and name HD#) or (residue 27 and name HD*) ) 3.9006667895 1.2751666974 1.2751666974 #seq terminal methyl
assign (residue 28 and name HN ) and assign ((residue 27 and name HB1) or (residue 27 and name HB2) ) 3.5419553396 0.8854888349 0.8854888349 #seq
#assign (residue 28 and name HN ) and assign (residue 29 and name HA ) 4.7627008447 1.1906752112 1.1906752112 #seq same chemical shift as water
assign (residue 29 and name HN ) and assign (residue 28 and name HN ) 2.9570724356 0.7392681089 0.7392681089 #seq
assign (residue 29 and name HN ) and assign ((residue 28 and name HG1#) or (residue 28 and name HG2#) ) 3.8911214688 1.2727803672 1.2727803672 #seq terminal methyl
assign (residue 29 and name HN ) and assign ((residue 28 and name HG1#) or (residue 28 and name HG2#) ) 3.8075982533 1.2518995633 1.2518995633 #seq terminal methyl
assign (residue 29 and name HN ) and assign (residue 28 and name HB ) 3.318725549 0.8296813873 0.8296813873 #seq
assign (residue 29 and name HN ) and assign (residue 28 and name HA ) 3.2937097101 0.8234274275 0.8234274275 #seq
assign (residue 30 and name HN ) and assign ((residue 29 and name HB1) or (residue 29 and name HB2) ) 3.6733982362 0.918349559 0.918349559 #seq
assign (residue 30 and name HN ) and assign (residue 31 and name HN ) 2.9229952385 0.7307488096 0.7307488096 #seq
assign (residue 30 and name HN ) and assign (residue 29 and name HA ) 2.5699646168 0.6424911542 0.6424911542 #seq 
assign (residue 30 and name HN ) and assign ((residue 29 and name HB1) or (residue 29 and name HB2) ) 3.5285388695 0.8821347174 0.8821347174 #seq
assign (residue 31 and name HN ) and assign (residue 32 and name HN ) 2.8026282551 0.7006570638 0.7006570638 #seq
assign (residue 31 and name HN ) and assign ((residue 30 and name HB#) or (residue 30 and name HB*) ) 3.1272350569 0.7818087642 0.7818087642 #seq
assign (residue 31 and name HN ) and assign (residue 30 and name HA ) 2.4943650869 0.9235912717 0.9235912717 #seq HN overlap with S40 HN, increased error window 0.3A
assign (residue 31 and name HN ) and assign ((residue 32 and name HB#) or (residue 32 and name HB*) ) 5.0882303855 1.2720575964 1.2720575964 #seq
assign (residue 31 and name HN ) and assign (residue 30 and name HN ) 2.527215514 0.6318038785 0.6318038785 #seq
assign (residue 32 and name HN ) and assign ((residue 31 and name HB#) or (residue 31 and name HB*) ) 3.4561273854 0.8640318463 0.8640318463 #seq
assign (residue 32 and name HN ) and assign (residue 31 and name HN ) 3.0172673404 0.7543168351 0.7543168351 #seq
assign (residue 32 and name HN ) and assign ((residue 33 and name HB#) or (residue 33 and name HB*) ) 5.7063760998 1.4265940249 1.4265940249 #seq
assign (residue 32 and name HN ) and assign (residue 31 and name HA ) 2.5892169852 0.6473042463 0.6473042463 #seq
assign (residue 33 and name HN ) and assign ((residue 34 and name HB#) or (residue 34 and name HB*) ) 4.3221828678 1.0805457169 1.0805457169 #seq
assign (residue 33 and name HN ) and assign ((residue 32 and name HB#) or (residue 32 and name HB*) ) 2.3166565697 0.5791641424 0.5791641424 #seq
assign (residue 33 and name HN ) and assign (residue 32 and name HA ) 2.4519276596 0.6129819149 0.6129819149 #seq
assign (residue 34 and name HN ) and assign (residue 33 and name HA ) 2.4272151842 0.6068037961 0.6068037961 #seq
assign (residue 34 and name HN ) and assign ((residue 35 and name HA1) or (residue 35 and name HA2) ) 4.4620894621 1.1155223655 1.1155223655 #seq
assign (residue 34 and name HN ) and assign ((residue 33 and name HB#) or (residue 33 and name HB*) ) 3.7829756087 0.9457439022 0.9457439022 #seq
assign (residue 34 and name HN ) and assign (residue 35 and name HN ) 2.649124478 0.6622811195 0.6622811195 #seq
assign (residue 35 and name HN ) and assign ((residue 34 and name HB#) or (residue 34 and name HB*) ) 2.9312656288 0.7328164072 0.7328164072 #seq
assign (residue 35 and name HN ) and assign ((residue 36 and name HB#) or (residue 36 and name HB*) ) 4.9071752486 1.5267938121 1.5267938121 #seq terminal methyl
assign (residue 35 and name HN ) and assign (residue 36 and name HN ) 2.8401551045 0.7100387761 0.7100387761 #seq
assign (residue 35 and name HN ) and assign (residue 34 and name HN ) 2.943899863 0.7359749658 0.7359749658 #seq
assign (residue 35 and name HN ) and assign (residue 34 and name HA ) 3.1852294607 0.7963073652 0.7963073652 #seq
assign (residue 35 and name HN ) and assign ((residue 34 and name HD#) or (residue 34 and name HD*) ) 4.8231857554 1.2057964388 1.2057964388 #seq
assign (residue 36 and name HN ) and assign ((residue 37 and name HG2#) or (residue 37 and name HG2*) ) 4.6011307713 1.4502826928 1.4502826928 #seq terminal methyl
assign (residue 36 and name HN ) and assign (residue 37 and name HG1* ) 4.4750239644 1.1187559911 1.1187559911 #seq
assign (residue 36 and name HN ) and assign (residue 37 and name HB ) 4.7499564218 1.1874891054 1.1874891054 #seq
assign (residue 36 and name HN ) and assign ((residue 35 and name HA1) or (residue 35 and name HA2) ) 2.903877595 0.7259693987 0.7259693987 #seq
assign (residue 36 and name HN ) and assign (residue 37 and name HN ) 2.3026159259 0.5756539815 0.5756539815 #seq
assign (residue 36 and name HN ) and assign ((residue 37 and name HD1#) or (residue 37 and name HD1*) ) 4.3739044083 1.3934761021 1.3934761021 #seq terminal methyl
assign (residue 36 and name HN ) and assign (residue 37 and name HG1* ) 4.7782400279 1.194560007 1.194560007 #seq
assign (residue 36 and name HN ) and assign (residue 35 and name HN ) 2.6672366492 0.6668091623 0.6668091623 #seq
assign (residue 36 and name HN ) and assign ((residue 35 and name HA1) or (residue 35 and name HA2) ) 3.1127852364 0.7781963091 0.7781963091 #seq
assign (residue 37 and name HN ) and assign ( (residue 38 and name HG) or (residue 38 and name HB*) or (residue 37 and name HG1*) ) 3.6537894164 0.9134473541 0.9134473541 #seq
assign (residue 37 and name HN ) and assign ((residue 36 and name HB#) or (residue 36 and name HB*) ) 2.7000159489 0.6750039872 0.6750039872 #seq
assign (residue 37 and name HN ) and assign (residue 36 and name HN ) 2.150160429 0.5375401073 0.5375401073 #seq
assign (residue 37 and name HN ) and assign ((residue 38 and name HB#) or (residue 38 and name HB*) ) 3.6563167186 0.9140791796 0.9140791796 #seq
assign (residue 37 and name HN ) and assign (residue 36 and name HA ) 2.8808687432 0.7202171858 0.7202171858 #seq
assign (residue 37 and name HN ) and assign (residue 38 and name HN ) 2.3015428619 0.5753857155 0.5753857155 #seq
assign (residue 38 and name HN ) and assign ((residue 37 and name HG1*) or ( residue 38 and name HG) or (reside 38 and name HB*) ) 2.5330702449 0.8332675612 0.8332675612 #seq linear combination
assign (residue 38 and name HN ) and assign (residue 37 and name HB ) 2.8122551918 0.703063798 0.703063798 #seq
assign (residue 38 and name HN ) and assign (residue 37 and name HN ) 2.5748433746 0.6437108437 0.6437108437 #seq
assign (residue 38 and name HN ) and assign ((residue 37 and name HD1#) or (residue 37 and name HD1*) or (residue 37 and name HG2#) or (residue 37 and name HG2*) or (residue 38 and name HD#) or (residue 38 and name HD*) ) 2.964331214 1.1410828035 1.1410828035 #seq terminal methyl & linear combination
assign (residue 38 and name HN ) and assign (residue 37 and name HG1* ) 4.6296668434 1.1574167109 1.1574167109 #seq
assign (residue 38 and name HN ) and assign (residue 37 and name HA ) 3.148165538 0.7870413845 0.7870413845 #seq
assign (residue 38 and name HN ) and assign (residue 39 and name HA ) 4.1194299722 1.0298574931 1.0298574931 #seq
assign (residue 39 and name HN ) and assign ((residue 38 and name HG) or (residue 38 and name HB*) or (residue 37 and name HG1*) ) 3.2822879927 1.0205719982 1.0205719982 #seq linear combination
assign (residue 39 and name HN ) and assign ((residue 38 and name HB#) or (residue 38 and name HB*) ) 3.2797860195 0.8199465049 0.8199465049 #seq
assign (residue 39 and name HN ) and assign (residue 38 and name HA ) 2.6874109833 0.6718527458 0.6718527458 #seq
assign (residue 39 and name HN ) and assign ((residue 40 and name HB#) or (residue 40 and name HB*) or (residue 39 and name HB*) ) 2.641361723 0.6603404307 0.6603404307 #seq
#assign (residue 39 and name HN ) and assign (residue 40 and name HN ) 2.4955954634 0.6238988658 0.6238988658 #seq
assign (residue 39 and name HN ) and assign (residue 40 and name HA ) 5.0000343897 1.2500085974 1.2500085974 #seq
#assign (residue 40 and name HN ) and assign (residue 41 and name HA ) 3.9031693357 0.9757923339 0.9757923339 #seq "S2 < 0.6"
#assign (residue 40 and name HN ) and assign ((residue 41 and name HG2#) or (residue 41 and name HG2*) ) 4.533974234 1.1334935585 1.1334935585 #seq "S2 < 0.6"
#assign (residue 40 and name HN ) and assign (residue 41 and name HN ) 2.402591741 0.6006479353 0.6006479353 #seq "S2 < 0.6"
#assign (residue 40 and name HN ) and assign (residue 39 and name HA ) 2.4307678294 0.6076919574 0.6076919574 #seq "S2 < 0.6"
#assign (residue 41 and name HN ) and assign ((residue 40 and name HB#) or (residue 40 and name HB*) or (residue 39 and name HB*) ) 3.4775203638 0.8693800909 0.8693800909 #seq "S2 < 0.6"
#assign (residue 41 and name HN ) and assign (residue 40 and name HN ) 2.514006705 0.6285016763 0.6285016763 #seq "S2 < 0.6"
#assign (residue 41 and name HN ) and assign (residue 42 and name HA ) 4.1440879916 1.0360219979 1.0360219979 #seq "S2 < 0.6"
#assign (residue 41 and name HN ) and assign (residue 40 and name HA ) 2.5305817263 0.6326454316 0.6326454316 #seq "S2 < 0.6"
#assign (residue 42 and name HN ) and assign (residue 41 and name HA ) 2.7096922422 0.6774230606 0.6774230606 #seq "S2 < 0.6"
#assign (residue 42 and name HN ) and assign ((residue 43 and name HG#) or (residue 43 and name HG*) ) 4.1989504349 1.0497376087 1.0497376087 #seq "S2 < 0.6"
#assign (residue 42 and name HN ) and assign (residue 43 and name HA ) 4.6290626913 1.1572656728 1.1572656728 #seq "S2 < 0.6"
#assign (residue 42 and name HN ) and assign ((residue 41 and name HG2#) or (residue 41 and name HG2*) ) 3.2835801252 0.8208950313 0.8208950313 #seq "S2 < 0.6"
#assign (residue 42 and name HN ) and assign (residue 41 and name HN ) 2.9225708419 0.7306427105 0.7306427105 #seq "S2 < 0.6"
#assign (residue 42 and name HN ) and assign ((residue 41 and name HB) or (residue 39 and name HA) or (residue 45 and name HA) ) 2.1528211261 0.5382052815 0.5382052815 #seq "S2 < 0.6"
#assign (residue 43 and name HN ) and assign (residue 42 and name HD22 ) 4.5227676907 1.1306919227 1.1306919227 #seq "S2 < 0.6"
#assign (residue 43 and name HN ) and assign ((residue 44 and name HN ) or (residue 42 and name HN )) 2.3775436494 0.5943859124 0.5943859124 #seq "S2 < 0.6"
#assign (residue 43 and name HN ) and assign ((residue 44 and name HA1) or (residue 40 and name HB*) or (residue 45 and name HB1) ) 4.4101679376 1.1025419844 1.1025419844 #seq "S2 < 0.6"
#assign (residue 43 and name HN ) and assign (residue 42 and name HB2 ) 3.5954144402 0.8988536101 0.8988536101 #seq "S2 < 0.6"
#assign (residue 43 and name HN ) and assign (residue 42 and name HB1 ) 3.7780436233 0.9445109058 0.9445109058 #seq "S2 < 0.6"
#assign (residue 43 and name HN ) and assign ((residue 42 and name HA) or (residue 46 and name HA) ) 2.1664043094 0.5416010773 0.5416010773 #seq "S2 < 0.6"
#assign (residue 44 and name HN ) and assign ((residue 45 and name HB1) or ( residue 44 and name HA1 ) ) 1.9962277811 0.4990569453 0.4990569453 #seq "S2 < 0.6"
#assign (residue 44 and name HN ) and assign ((residue 43 and name HG#) or (residue 43 and name HG*) ) 2.8299041275 0.7074760319 0.7074760319 #seq "S2 < 0.6"
#assign (residue 44 and name HN ) and assign (residue 43 and name HB ) 3.2137384041 0.803434601 0.803434601 #seq "S2 < 0.6"
#assign (residue 44 and name HN ) and assign (residue 45 and name HA ) 5.0386708748 1.2596677187 1.2596677187 #seq "S2 < 0.6"
#assign (residue 44 and name HN ) and assign ((residue 43 and name HA) or (residue 47 and name HA) ) 2.0689690417 0.5172422604 0.5172422604 #seq "S2 < 0.6"
#assign (residue 44 and name HN ) and assign ((residue 45 and name HB2) or ( residue 44 and name HA3 ) ) 4.4926465916 1.1231616479 1.1231616479 #seq "S2 < 0.6"
#assign (residue 44 and name HN ) and assign (residue 43 and name HN ) 2.829265637 0.7073164092 0.7073164092 #seq "S2 < 0.6"
#assign (residue 44 and name HN ) and assign (residue 45 and name HN ) 2.9313943846 0.7328485962 0.7328485962 #seq "S2 < 0.6"
#assign (residue 45 and name HN ) and assign ((residue 44 and name HA1) or (residue 45 and name HB1) ) 2.0565888326 0.5141472081 0.5141472081 #seq "S2 < 0.6"
#assign (residue 45 and name HN ) and assign ((residue 46 and name HB#) or (residue 46 and name HB*) ) 4.7571579033 1.1892894758 1.1892894758 #seq "S2 < 0.6"
#assign (residue 45 and name HN ) and assign ((residue 44 and name HA2) or (residue 45 and name HB2) ) 2.4126325526 0.6031581381 0.6031581381 #seq "S2 < 0.6"
#assign (residue 45 and name HN ) and assign ((residue 46 and name HN) or (residue 44 and name HN) ) 2.2492149008 0.5623037252 0.5623037252 #seq "S2 < 0.6"
#assign (residue 46 and name HN ) and assign (residue 45 and name HB1 ) 3.9206136604 0.9801534151 0.9801534151 #seq "S2 < 0.6"
#assign (residue 46 and name HN ) and assign ((residue 47 and name HG2#) or (residue 47 and name HG2*) ) 4.9898329152 1.2474582288 1.2474582288 #seq "S2 < 0.6"
#assign (residue 46 and name HN ) and assign (residue 45 and name HA ) 2.2386069284 0.5596517321 0.5596517321 #seq "S2 < 0.6"
#assign (residue 46 and name HN ) and assign (residue 45 and name HB2 ) 3.3637478884 0.8409369721 0.8409369721 #seq "S2 < 0.6"
#assign (residue 46 and name HN ) and assign ((residue 45 and name HN) or (residue 48 and name HN) ) 2.7157394392 0.6789348598 0.6789348598 #seq "S2 < 0.6"
#assign (residue 46 and name HN ) and assign (residue 47 and name HA ) 4.7003719685 1.1750929921 1.1750929921 #seq "S2 < 0.6"
#assign (residue 46 and name HN ) and assign (residue 47 and name HN ) 2.6286577428 0.6571644357 0.6571644357 #seq "S2 < 0.6"
#assign (residue 47 and name HN ) and assign ((residue 46 and name HA) or (residue 42 and name HA) ) 2.1878235813 0.5469558953 0.5469558953 #seq "S2 < 0.6"
#assign (residue 47 and name HN ) and assign ((residue 48 and name HD#) or (residue 48 and name HD*) ) 4.5572569427 1.1393142357 1.1393142357 #seq "S2 < 0.6"
#assign (residue 47 and name HN ) and assign ((residue 46 and name HB#) or (residue 46 and name HB*) ) 3.0441340975 0.7610335244 0.7610335244 #seq "S2 < 0.6"
#assign (residue 47 and name HN ) and assign (residue 48 and name HN ) 2.4894825432 0.6223706358 0.6223706358 #seq "S2 < 0.6"
#assign (residue 47 and name HN ) and assign (residue 48 and name HB2 ) 5.3302117281 1.332552932 1.332552932 #seq "S2 < 0.6"
#assign (residue 47 and name HN ) and assign (residue 46 and name HN ) 2.6335412253 0.6583853063 0.6583853063 #seq "S2 < 0.6"
#assign (residue 47 and name HN ) and assign (residue 48 and name HA ) 4.9534379578 1.2383594894 1.2383594894 #seq "S2 < 0.6"
#assign (residue 48 and name HN ) and assign ((residue 47 and name HG2#) or (residue 47 and name HG2*) ) 3.5127571426 0.8781892856 0.8781892856 #seq "S2 < 0.6"
#assign (residue 48 and name HN ) and assign ((residue 49 and name HA#) or (residue 49 and name HA*) ) 4.2263332779 1.0565833195 1.0565833195 #seq "S2 < 0.6"
#assign (residue 48 and name HN ) and assign ((residue 47 and name HB) or (residue 50 and name HA) ) 2.2940720349 0.5735180087 0.5735180087 #seq "S2 < 0.6"
#assign (residue 48 and name HN ) and assign (residue 47 and name HA ) 2.7133540113 0.6783385028 0.6783385028 #seq "S2 < 0.6"
#assign (residue 48 and name HN ) and assign (residue 47 and name HN ) 2.5494295827 0.6373573957 0.6373573957 #seq "S2 < 0.6"
#assign (residue 49 and name HN ) and assign ((residue 48 and name HD#) or (residue 48 and name HD*) ) 4.183488437 1.0458721093 1.0458721093 #seq "S2 < 0.6"
#assign (residue 49 and name HN ) and assign (residue 48 and name HB1 ) 3.2678609214 0.8169652304 0.8169652304 #seq "S2 < 0.6"
#assign (residue 49 and name HN ) and assign (residue 48 and name HN ) 2.8705027471 0.7176256868 0.7176256868 #seq "S2 < 0.6"
#assign (residue 49 and name HN ) and assign (residue 48 and name HB2 ) 3.5494805665 0.8873701416 0.8873701416 #seq "S2 < 0.6"
#assign (residue 49 and name HN ) and assign (residue 48 and name HA ) 2.255803577 0.5639508942 0.5639508942 #seq "S2 < 0.6"
#assign (residue 49 and name HN ) and assign (residue 50 and name HA ) 4.2907159519 1.072678988 1.072678988 #seq "S2 < 0.6"
#assign (residue 50 and name HN ) and assign ((residue 49 and name HA#) or (residue 49 and name HA*) ) 2.5626214426 0.6406553607 0.6406553607 #seq "S2 < 0.6"
#assign (residue 50 and name HN ) and assign (residue 49 and name HN ) 3.0311647674 0.7577911918 0.7577911918 #seq "S2 < 0.6"
#assign (residue 50 and name HN ) and assign ((residue 51 and name HB#) or (residue 51 and name HB*) or ( residue 50 and name HB# ) or (residue 50 and name HB*) ) 2.5570668224 0.6392667056 0.6392667056 #seq
assign (residue 51 and name HN ) and assign (residue 50 and name HG1 ) 3.7005760311 0.9251440078 0.9251440078 #seq
assign (residue 51 and name HN ) and assign (residue 52 and name HN ) 2.7298738771 0.6824684693 0.6824684693 #seq
assign (residue 51 and name HN ) and assign ((residue 50 and name HG2) or (residue 53 and name HB#) or (residue 53 and name HB*) ) 3.2715655489 1.1178913872 1.1178913872 #seq terminal methyl
assign (residue 51 and name HN ) and assign ((residue 50 and name HB#) or (residue 50 and name HB*) ) 2.1785761736 0.5446440434 0.5446440434 #seq
assign (residue 51 and name HN ) and assign (residue 52 and name HA ) 5.2543335146 1.3135833786 1.3135833786 #seq
assign (residue 52 and name HN ) and assign ((residue 53 and name HB#) or (residue 53 and name HB*) ) 4.2500853203 1.3625213301 1.3625213301 #seq terminal methyl
assign (residue 52 and name HN ) and assign (residue 53 and name HA ) 4.7226819093 1.1806704773 1.1806704773 #seq
assign (residue 52 and name HN ) and assign (residue 51 and name HA ) 2.6539127901 0.6634781975 0.6634781975 #seq
assign (residue 52 and name HN ) and assign ((residue 51 and name HD#) or (residue 51 and name HD*) ) 5.03254471 1.2581361775 1.2581361775 #seq
assign (residue 52 and name HN ) and assign ((residue 51 and name HG#) or (residue 51 and name HG*) ) 3.5963394113 0.8990848528 0.8990848528 #seq
assign (residue 52 and name HN ) and assign ((residue 51 and name HB#) or (residue 51 and name HB*) ) 2.8648325624 0.7162081406 0.7162081406 #seq
assign (residue 53 and name HN ) and assign (residue 52 and name HD2* ) 4.9050680967 1.2262670242 1.2262670242 #seq
assign (residue 53 and name HN ) and assign (residue 52 and name HD2* ) 4.9952518657 1.2488129664 1.2488129664 #seq
assign (residue 53 and name HN ) and assign ((residue 54 and name HG1#) or (residue 54 and name HG1*) ) 4.3387702722 1.384692568 1.384692568 #seq terminal methyl
assign (residue 53 and name HN ) and assign (residue 54 and name HN ) 3.0078399884 0.7519599971 0.7519599971 #seq
assign (residue 53 and name HN ) and assign (residue 52 and name HA ) 2.6392454217 0.6598113554 0.6598113554 #seq
assign (residue 53 and name HN ) and assign ((residue 52 and name HB#) or (residue 52 and name HB*) ) 3.1153532354 0.7788383088 0.7788383088 #seq
assign (residue 54 and name HN ) and assign ((residue 53 and name HB#) or (residue 53 and name HB*) ) 2.7014566682 0.975364167 0.975364167 #seq terminal methyl
assign (residue 54 and name HN ) and assign (residue 55 and name HN ) 2.7158125719 0.678953143 0.678953143 #seq
assign (residue 54 and name HN ) and assign (residue 53 and name HA ) 3.1710105755 0.7927526439 0.7927526439 #seq
assign (residue 55 and name HN ) and assign ((residue 56 and name HG1# ) or (residue 56 and name HG1*) or (residue 54 and name HG1# ) or (residue 54 and name HG1*)) 3.6103046708 1.2025761677 1.2025761677 #seq terminal methyl
assign (residue 55 and name HN ) and assign ((residue 54 and name HB) or (residue 56 and name HB )) 2.9122061037 0.7280515259 0.7280515259 #seq
assign (residue 55 and name HN ) and assign (residue 56 and name HN ) 2.68262619 0.6706565475 0.6706565475 #seq
assign (residue 55 and name HN ) and assign (residue 54 and name HA ) 3.2058789622 0.8014697406 0.8014697406 #seq
assign (residue 55 and name HN ) and assign (residue 54 and name HN ) 2.6065015491 0.6516253873 0.6516253873 #seq
assign (residue 55 and name HN ) and assign (residue 56 and name HA ) 6.307871148 1.576967787 1.576967787 #seq
assign (residue 55 and name HN ) and assign ((residue 54 and name HG2#) or (residue 54 and name HG2*) ) 3.489797781 1.1724494453 1.1724494453 #seq terminal methyl
assign (residue 56 and name HN ) and assign ((residue 55 and name HB#) or (residue 55 and name HB*) ) 2.879253289 0.7198133222 0.7198133222 #seq
assign (residue 56 and name HN ) and assign (residue 55 and name HN ) 2.5582561507 0.6395640377 0.6395640377 #seq
assign (residue 56 and name HN ) and assign ((residue 55 and name HA) or (residue 57 and name HA) ) 2.9068500689 0.7267125172 0.7267125172 #seq
assign (residue 56 and name HN ) and assign ((residue 57 and name HD#) or (residue 57 and name HD*) ) 4.4960502559 1.424012564 1.424012564 #seq terminal methyl
assign (residue 56 and name HN ) and assign (residue 57 and name HN ) 2.6279843242 0.6569960811 0.6569960811 #seq
assign (residue 56 and name HN ) and assign ((residue 57 and name HG) or (residue 58 and name HB*) ) 4.3930168034 1.0982542009 1.0982542009 #seq
assign (residue 56 and name HN ) and assign ((residue 57 and name HB#) or (residue 57 and name HB*) ) 5.0182581596 1.2545645399 1.2545645399 #seq
assign (residue 56 and name HN ) and assign ((residue 55 and name HG#) or (residue 55 and name HG*) ) 5.2070769387 1.3017692347 1.3017692347 #seq
assign (residue 57 and name HN ) and assign ((residue 56 and name HG1#) or (residue 56 and name HG1*) ) 3.5673592333 1.2918398083 1.2918398083 #seq terminal methyl
assign (residue 57 and name HN ) and assign ((residue 56 and name HG2#) or (residue 56 and name HG2*) or (residue 57 and name HD1#) or (residue 57 and name HD1*) or (residue 62 and name HD1#) or (residue 62 and name HD1*) ) 3.6628631265 1.2157157816 1.2157157816 #seq terminal methyl
assign (residue 57 and name HN ) and assign ((residue 58 and name HG#) or (residue 58 and name HG*) ) 4.8262081988 1.2065520497 1.2065520497 #seq
assign (residue 57 and name HN ) and assign (residue 56 and name HN ) 2.8873818092 0.7218454523 0.7218454523 #seq
assign (residue 57 and name HN ) and assign ((residue 58 and name HB#) or (residue 58 and name HB*) or (residue 57 and name HG) ) 2.9073014103 0.7268253526 0.7268253526 #seq
assign (residue 57 and name HN ) and assign (residue 56 and name HA ) 3.7255343946 0.9313835986 0.9313835986 #seq
assign (residue 58 and name HN ) and assign (residue 59 and name HN ) 3.1947333893 0.7986833473 0.7986833473 #seq
assign (residue 58 and name HN ) and assign ((residue 57 and name HD#) or (residue 57 and name HD*) ) 4.9476032533 1.5369008133 1.5369008133 #seq terminal methyl
assign (residue 58 and name HN ) and assign ((residue 57 and name HG) or (residue 58 and name HB*) ) 3.1437763586 0.7859440897 0.7859440897 #seq
assign (residue 59 and name HN ) and assign (residue 60 and name HN ) 2.9825256319 0.745631408 0.745631408 #seq
assign (residue 59 and name HN ) and assign (residue 58 and name HN ) 3.0627082331 0.7656770583 0.7656770583 #seq
assign (residue 59 and name HN ) and assign (residue 58 and name HA ) 3.1902137413 0.7975534353 0.7975534353 #seq
assign (residue 59 and name HN ) and assign (residue 58 and name HD* ) 4.9349116671 1.2337279168 1.2337279168 #seq
assign (residue 59 and name HN ) and assign ((residue 60 and name HB#) or (residue 60 and name HB*) ) 4.8946311634 1.2236577908 1.2236577908 #seq
assign (residue 60 and name HN ) and assign (residue 61 and name HD* ) 3.7009463917 0.9252365979 0.9252365979 #seq
assign (residue 60 and name HN ) and assign (residue 59 and name HN ) 2.7556423676 0.6889105919 0.6889105919 #seq
assign (residue 60 and name HN ) and assign (residue 61 and name HD* ) 3.2937101961 0.823427549 0.823427549 #seq
assign (residue 60 and name HN ) and assign (residue 59 and name HA ) 3.0411458289 0.7602864572 0.7602864572 #seq
assign (residue 60 and name HN ) and assign ((residue 61 and name HB*) or ( residue 59 and name HB*) ) 3.2346317109 0.8086579277 0.8086579277 #seq
assign (residue 60 and name HN ) and assign ((residue 59 and name HB#) or (residue 59 and name HB*) ) 3.6044874062 0.9011218516 0.9011218516 #seq
assign (residue 62 and name HN ) and assign (residue 61 and name HD* ) 4.0467887833 1.0116971958 1.0116971958 #seq
assign (residue 62 and name HN ) and assign ((residue 63 and name HB#) or (residue 63 and name HB*) ) 5.3281402109 1.3320350527 1.3320350527 #seq
assign (residue 62 and name HN ) and assign (residue 61 and name HA ) 2.6773346956 0.6693336739 0.6693336739 #seq
assign (residue 62 and name HN ) and assign ((residue 61 and name HG#) or (residue 61 and name HG*) ) 3.8858087564 0.9714521891 0.9714521891 #seq
assign (residue 62 and name HN ) and assign (residue 61 and name HB* ) 3.7719633392 0.9429908348 0.9429908348 #seq
assign (residue 62 and name HN ) and assign (residue 63 and name HA ) 4.3684536284 1.0921134071 1.0921134071 #seq
assign (residue 62 and name HN ) and assign (residue 61 and name HB* ) 4.5261665377 1.1315416344 1.1315416344 #seq
assign (residue 63 and name HN ) and assign ((residue 62 and name HB#) or (residue 62 and name HB*) ) 3.5527267279 0.888181682 0.888181682 #seq
assign (residue 63 and name HN ) and assign (residue 62 and name HA ) 2.7627415456 0.6906853864 0.6906853864 #seq
assign (residue 63 and name HN ) and assign ((residue 62 and name HD2#) or (residue 62 and name HD2*) ) 4.5514028371 1.1378507093 1.1378507093 #seq
assign (residue 63 and name HN ) and assign ((residue 64 and name HE#) or (residue 64 and name HE*) or (residue 64 and name HD#) or (residue 64 and name HD*) ) 5.2210176965 1.3052544241 1.3052544241 #seq
assign (residue 63 and name HN ) and assign (residue 64 and name HN ) 2.7715373992 0.6928843498 0.6928843498 #seq
assign (residue 63 and name HN ) and assign (residue 62 and name HG ) 3.9270163311 0.9817540828 0.9817540828 #seq
#assign (residue 64 and name HN ) and assign ((residue 65 and name HB#) or (residue 65 and name HB*) ) 4.377290324 1.094322581 1.094322581 #seq "S2 < 0.6"
#assign (residue 64 and name HN ) and assign (residue 65 and name HN ) 2.4290051425 0.6072512856 0.6072512856 #seq "S2 < 0.6"
#assign (residue 64 and name HN ) and assign ((residue 65 and name HD#) or (residue 65 and name HD*) ) 4.3620779586 1.0905194896 1.0905194896 #seq "S2 < 0.6"
assign (residue 64 and name HN ) and assign ((residue 63 and name HB#) or (residue 63 and name HB*) ) 3.3922839848 0.8480709962 0.8480709962 #seq
#assign (residue 64 and name HN ) and assign ((residue 65 and name HG) or (residue 62 and name HB*) or (residue 68 and name HB2) ) 3.7770067601 0.94425169 0.94425169 #seq "S2 < 0.6"
assign (residue 64 and name HN ) and assign (residue 63 and name HN ) 2.6177874811 0.6544468703 0.6544468703 #seq
#assign (residue 65 and name HN ) and assign (residue 64 and name HB1 ) 3.849456864 0.962364216 0.962364216 #seq "S2 < 0.6"
#assign (residue 65 and name HN ) and assign ((residue 66 and name HA) or (residue 61 and name HA) or (residue 65 and name HA) ) 2.8499919665 0.7124979916 0.7124979916 #seq "S2 < 0.6"
#assign (residue 65 and name HN ) and assign (residue 64 and name HB2 ) 3.8513371479 0.962834287 0.962834287 #seq "S2 < 0.6"
#assign (residue 65 and name HN ) and assign (residue 66 and name HD* ) 4.1242240746 1.0310560187 1.0310560187 #seq "S2 < 0.6"
#assign (residue 65 and name HN ) and assign (residue 66 and name HD* ) 4.5714205358 1.142855134 1.142855134 #seq "S2 < 0.6"
#assign (residue 65 and name HN ) and assign (residue 64 and name HN ) 2.4879956357 0.6219989089 0.6219989089 #seq "S2 < 0.6"
#assign (residue 65 and name HN ) and assign ((residue 64 and name HD#) or (residue 64 and name HD*) or (residue 64 and name HE#) or (residue 64 and name HE*) ) 4.7925085527 1.1981271382 1.1981271382 #seq "S2 < 0.6"
#assign (residue 67 and name HN ) and assign (residue 66 and name HB* ) 3.9650335631 0.9912583908 0.9912583908 #seq "S2 < 0.6"
#assign (residue 67 and name HN ) and assign (residue 66 and name HB* ) 3.5386594869 0.8846648717 0.8846648717 #seq "S2 < 0.6"
#assign (residue 67 and name HN ) and assign ((residue 68 and name HB2) or ( residue 69 and name HB*) or (residue 70 and name HB*) ) 4.2260905532 1.0565226383 1.0565226383 #seq "S2 < 0.6"
#assign (residue 67 and name HN ) and assign (residue 66 and name HD* ) 4.1897020148 1.0474255037 1.0474255037 #seq "S2 < 0.6"
#assign (residue 67 and name HN ) and assign (residue 68 and name HB1 ) 4.8155318675 1.2038829669 1.2038829669 #seq "S2 < 0.6"
#assign (residue 67 and name HN ) and assign (residue 68 and name HN ) 2.9290379264 0.7322594816 0.7322594816 #seq "S2 < 0.6"
#assign (residue 68 and name HN ) and assign (residue 67 and name HN ) 3.1404577392 0.7851144348 0.7851144348 #seq "S2 < 0.6"
#assign (residue 71 and name HN ) and assign (residue 72 and name HN ) 4.0188904425 1.0047226106 1.0047226106 #seq "S2 < 0.6"
#assign (residue 72 and name HN ) and assign (residue 71 and name HN ) 4.6351515803 1.1587878951 1.1587878951 #seq "S2 < 0.6"

#medium
#assign (residue 13 and name HN ) and assign (residue 15 and name HB ) 2.688321535 0.6720803837 0.6720803837 #med water peak overlap
assign (residue 14 and name HN ) and assign ((residue 18 and name HB#) or (residue 18 and name HB*) ) 4.7006542477 1.1751635619 1.1751635619 #med
assign (residue 14 and name HN ) and assign (residue 12 and name HA ) 4.1723170188 1.0430792547 1.0430792547 #med
assign (residue 14 and name HN ) and assign ((residue 12 and name HB#) or (residue 12 and name HB*) ) 4.8194626152 1.2048656538 1.2048656538 #med
assign (residue 14 and name HN ) and assign (residue 12 and name HN ) 5.0737220385 1.2684305096 1.2684305096 #med
assign (residue 15 and name HN ) and assign ((residue 18 and name HB#) or (residue 18 and name HB*) ) 3.5670547285 0.8917636821 0.8917636821 #med
assign (residue 15 and name HN ) and assign (residue 18 and name HN ) 5.0929887873 1.2732471968 1.2732471968 #med
assign (residue 15 and name HN ) and assign (residue 13 and name HA ) 4.1964513648 1.0491128412 1.0491128412 #med
assign (residue 15 and name HN ) and assign ((residue 13 and name HB#) or (residue 13 and name HB*) ) 4.3157412247 1.0789353062 1.0789353062 #med
assign (residue 17 and name HN ) and assign ((residue 15 and name HG2#) or (residue 15 and name HG2*) ) 3.317982736 0.904495684 0.904495684 #med terminal methyl
#assign (residue 17 and name HN ) and assign (residue 15 and name HB ) 2.5847386245 0.6461846561 0.6461846561 #med water peak overlap
assign (residue 17 and name HN ) and assign (residue 15 and name HA ) 4.1927117824 1.0481779456 1.0481779456 #med
assign (residue 18 and name HN ) and assign (residue 15 and name HN ) 4.8891884883 1.2222971221 1.2222971221 #med
#assign (residue 18 and name HN ) and assign (residue 15 and name HB ) 3.2610298492 0.8152574623 0.8152574623 #med overlap with water
assign (residue 18 and name HN ) and assign ((residue 16 and name HB#) or (residue 16 and name HB*) ) 4.8243565555 1.5060891389 1.5060891389 #med terminal methyl
assign (residue 19 and name HN ) and assign ((residue 21 and name HA) or (residue 19 and name HA) ) 2.7512372812 0.6878093203 0.6878093203 #med
assign (residue 20 and name HN ) and assign ((residue 23 and name HB#) or (residue 23 and name HB*) ) 5.0397417678 1.2599354419 1.2599354419 #med
assign (residue 20 and name HN ) and assign (residue 18 and name HA ) 4.8977072313 1.2244268078 1.2244268078 #med
assign (residue 20 and name HN ) and assign (residue 22 and name HN ) 4.2698307026 1.0674576756 1.0674576756 #med
assign (residue 21 and name HN ) and assign (residue 18 and name HA ) 4.2108494901 1.0527123725 1.0527123725 #med
assign (residue 21 and name HN ) and assign ((residue 19 and name HB#) or (residue 19 and name HB*) ) 4.8372841775 1.5093210444 1.5093210444 #med terminal methyl
assign (residue 22 and name HN ) and assign ((residue 19 and name HB#) or (residue 19 and name HB*) ) 4.8763094525 1.5190773631 1.5190773631 #med terminal methyl
assign (residue 22 and name HN ) and assign (residue 20 and name HA ) 4.8103023337 1.2025755834 1.2025755834 #med
assign (residue 22 and name HN ) and assign (residue 24 and name HN ) 4.9984776954 1.2496194238 1.2496194238 #med
assign (residue 22 and name HN ) and assign (residue 20 and name HN ) 3.9471616525 0.9867904131 0.9867904131 #med
assign (residue 23 and name HN ) and assign (residue 20 and name HA ) 3.699383546 0.9248458865 0.9248458865 #med
assign (residue 24 and name HN ) and assign (residue 26 and name HN ) 4.5500633382 1.1375158346 1.1375158346 #med
assign (residue 24 and name HN ) and assign (residue 22 and name HA ) 3.6274098041 0.906852451 0.906852451 #med
assign (residue 24 and name HN ) and assign (residue 20 and name HA ) 4.3747950598 1.0936987649 1.0936987649 #med
assign (residue 24 and name HN ) and assign (residue 21 and name HA ) 3.6647880714 0.9161970179 0.9161970179 #med
assign (residue 24 and name HN ) and assign ((residue 23 and name HD#) or (residue 23 and name HD*) ) 4.4105293235 1.1026323309 1.1026323309 #med
assign (residue 24 and name HN ) and assign ((residue 22 and name HB2) or (reside 23 and name HB*) ) 3.2073396211 0.8018349053 0.8018349053 #med
assign (residue 24 and name HN ) and assign (residue 22 and name HN ) 4.3606445709 1.0901611427 1.0901611427 #med
assign (residue 25 and name HN ) and assign (residue 21 and name HA ) 4.4927855376 1.1231963844 1.1231963844 #med
assign (residue 25 and name HN ) and assign ((residue 28 and name HG1#) or (residue 28 and name HG1*) or (residue 28 and name HG2#) or (residue 28 and name HG2*) ) 4.8496829102 1.5124207275 1.5124207275 #med terminal methyl
assign (residue 25 and name HN ) and assign (residue 22 and name HA ) 3.4068889078 0.851722227 0.851722227 #med
assign (residue 25 and name HN ) and assign (residue 23 and name HA ) 3.4068889078 0.851722227 0.851722227 #med
assign (residue 26 and name HN ) and assign (residue 23 and name HA ) 3.4118328393 0.8529582098 0.8529582098 #med
assign (residue 26 and name HN ) and assign ((residue 24 and name HB#) or (residue 24 and name HB*) ) 4.581665446 1.4454163615 1.4454163615 #med terminal methyl
assign (residue 26 and name HN ) and assign ((residue 28 and name HG1#) or (residue 28 and name HG1*) or (residue 28 and name HG2#) or (residue 28 and name HG2*) ) 4.6093460025 1.4523365006 1.4523365006 #med terminal methyl
assign (residue 26 and name HN ) and assign (residue 24 and name HN ) 4.153163602 1.0382909005 1.0382909005 #med
assign (residue 27 and name HN ) and assign (residue 24 and name HA ) 3.5202870844 0.8800717711 0.8800717711 #med
assign (residue 28 and name HN ) and assign (residue 24 and name HA ) 3.8895260393 0.9723815098 0.9723815098 #med
assign (residue 28 and name HN ) and assign ((residue 25 and name HA ) or (residue 26 and name HA )) 3.5167022073 0.8791755518 0.8791755518 #med
assign (residue 28 and name HN ) and assign (residue 29 and name HN ) 3.4999520378 0.8899880095 0.8899880095 #med
assign (residue 29 and name HN ) and assign (residue 26 and name HA ) 3.788836083 0.9472090208 0.9472090208 #med
assign (residue 29 and name HN ) and assign (residue 27 and name HA ) 4.084448693 1.0211121733 1.0211121733 #med
assign (residue 29 and name HN ) and assign ((residue 31 and name HN) or (residue 26 and name HN) ) 3.7791594554 0.9447898639 0.9447898639 #med
assign (residue 30 and name HN ) and assign (residue 26 and name HA ) 4.6785665301 1.1696416325 1.1696416325 #med
assign (residue 30 and name HN ) and assign (residue 27 and name HA ) 3.8634417478 0.965860437 0.965860437 #med
assign (residue 30 and name HN ) and assign ((residue 27 and name HD*) or (residue 27 and name HD1#) or (residue 27 and name HD2#) ) 4.9730123724 1.5432530931 1.5432530931 #med terminal methyl
assign (residue 30 and name HN ) and assign (residue 28 and name HN ) 4.0671366823 1.0167841706 1.0167841706 #med
assign (residue 30 and name HN ) and assign ((residue 28 and name HG2#) or (residue 28 and name HG2*) or (residue 28 and name HG1#) or (residue 28 and name HG1*) ) 4.7145089897 1.4786272474 1.4786272474 #med terminal methyl
assign (residue 30 and name HN ) and assign ((residue 28 and name HG1#) or (residue 28 and name HG1*) or (residue 28 and name HG2#) or (residue 28 and name HG2*) ) 4.5083127377 1.4270781844 1.4270781844 #med terminal methyl
assign (residue 30 and name HN ) and assign (residue 28 and name HB ) 4.8416976807 1.2104244202 1.2104244202 #med
assign (residue 30 and name HN ) and assign (residue 28 and name HA ) 4.1543637306 1.0385909326 1.0385909326 #med
assign (residue 30 and name HN ) and assign (residue 32 and name HN ) 4.4516973957 1.1129472942 1.1129472942 #med
assign (residue 31 and name HN ) and assign ((residue 29 and name HN) or (residue 30 and name HN) ) 2.731813431 0.6829533578 0.6829533578 #med
#assign (residue 31 and name HN ) and assign (residue 29 and name HA ) 2.6291500543 0.6572875136 0.6572875136 #med same chemical shift as water
#assign (residue 32 and name HN ) and assign (residue 29 and name HA ) 3.0754679501 0.7688669875 0.7688669875 #med same chemical shift as water
assign (residue 32 and name HN ) and assign ((residue 30 and name HB#) or (residue 30 and name HB*) ) 4.4172076819 1.1043019205 1.1043019205 #med
assign (residue 32 and name HN ) and assign ((residue 34 and name HB#) or (residue 34 and name HB*) ) 4.9420171887 1.2355042972 1.2355042972 #med
assign (residue 32 and name HN ) and assign (residue 30 and name HA ) 4.7714569659 1.1928642415 1.1928642415 #med
assign (residue 32 and name HN ) and assign (residue 34 and name HN ) 3.0575841232 0.7643960308 0.7643960308 #med
assign (residue 33 and name HN ) and assign ((residue 36 and name HB#) or (residue 36 and name HB*) ) 4.818641569 1.5046603923 1.5046603923 #med terminal methyl
assign (residue 33 and name HN ) and assign ((residue 31 and name HB#) or (residue 31 and name HB*) ) 4.5316183733 1.1329045933 1.1329045933 #med
assign (residue 33 and name HN ) and assign (residue 31 and name HA ) 4.5961880588 1.1490470147 1.1490470147 #med
assign (residue 34 and name HN ) and assign ((residue 37 and name HD1#) or (residue 37 and name HD1*) or (residue 37 and name HG2#) or (residue 37 and name HG2*) ) 4.9183458949 1.5295864737 1.5295864737 #med terminal methyl
assign (residue 34 and name HN ) and assign (residue 36 and name HN ) 5.00462146 1.251155365 1.251155365 #med
assign (residue 34 and name HN ) and assign ((residue 32 and name HB#) or (residue 32 and name HB*) or (residue 33 and name HB*) ) 3.3487072407 0.8371768102 0.8371768102 #med
assign (residue 34 and name HN ) and assign (residue 32 and name HA ) 4.7190751687 1.1797687922 1.1797687922 #med
assign (residue 35 and name HN ) and assign (residue 33 and name HA ) 4.3090915185 1.0772728796 1.0772728796 #med
assign (residue 35 and name HN ) and assign (residue 33 and name HN ) 4.9940587514 1.2485146879 1.2485146879 #med
assign (residue 36 and name HN ) and assign (residue 33 and name HA ) 4.1242240746 1.0310560187 1.0310560187 #med
assign (residue 36 and name HN ) and assign ((residue 32 and name HB#) or (residue 32 and name HB*) ) 4.7274122562 1.1818530641 1.1818530641 #med
assign (residue 36 and name HN ) and assign ((residue 38 and name HB#) or (residue 38 and name HB*) ) 4.7361316948 1.1840329237 1.1840329237 #med
assign (residue 36 and name HN ) and assign (residue 34 and name HN ) 3.8071987581 0.9517996895 0.9517996895 #med
assign (residue 36 and name HN ) and assign (residue 34 and name HA ) 3.8316726821 0.9579181705 0.9579181705 #med
assign (residue 37 and name HN ) and assign (residue 34 and name HA ) 3.4136803642 0.853420091 0.853420091 #med
assign (residue 38 and name HN ) and assign (residue 35 and name HA2 ) 4.5562987802 1.1390746951 1.1390746951 #med
assign (residue 38 and name HN ) and assign ((residue 36 and name HB#) or (residue 36 and name HB*) ) 4.47939658 1.419849145 1.419849145 #med terminal methyl
assign (residue 39 and name HN ) and assign (residue 35 and name HA2 ) 4.7853305461 1.1963326365 1.1963326365 #med
assign (residue 39 and name HN ) and assign (residue 36 and name HB# ) 4.8159993455 1.5039998364 1.5039998364 #med terminal methyl
assign (residue 39 and name HN ) and assign (residue 37 and name HB ) 4.8049952509 1.2012488127 1.2012488127 #med
assign (residue 39 and name HN ) and assign ((residue 37 and name HD1# ) or (residue 37 and name HD1*) or (residue 37 and name HG2#) or (residue 37 and name HG2*) or (residue 38 and name HD*) or (residue 38 and name HD#)) 4.156158935 1.3390397337 1.3390397337 #med terminal methyl
assign (residue 39 and name HN ) and assign ((residue 37 and name HA) or ( residue 39 and name HB#) or (residue 39 and name HB*)) 2.5320977078 0.633024427 0.633024427 #med
#assign (residue 40 and name HN ) and assign ((residue 37 and name HD1# ) or (residue 37 and name HD1*) or (residue 37 and name HG2*) or (residue 37 and name HG2# ) or ( residue 38 and name HD#) or (residue 38 and name HD*)) 4.0946747634 1.3236686908 1.3236686908 #med terminal methyl
#assign (residue 40 and name HN ) and assign ((residue 37 and name HA) or ( residue 39 and name HB#) or (residue 39 and name HB*) ) 2.4957519662 0.6239379915 0.6239379915 #med
#assign (residue 40 and name HN ) and assign ((residue 38 and name HG) or (residue 38 and name HB*) ) 4.8462239548 1.2115559887 1.2115559887 #med
#assign (residue 40 and name HN ) and assign ((residue 42 and name HN) or (residue 44 and name HN) ) 4.4687525376 1.1171881344 1.1171881344 #med "S2 < 0.6"
#assign (residue 40 and name HN ) and assign (residue 38 and name HA ) 3.7342911009 0.9335727752 0.9335727752 #med
#assign (residue 40 and name HN ) and assign ((residue 38 and name HN) or (residue 39 and name HN) ) 2.4488708262 0.6122177065 0.6122177065 #med
#assign (residue 41 and name HN ) and assign ((residue 37 and name HD1#) or (residue 37 and name HD1*) or (residue 37 and name HG2#) or (residue 37 and name HG2*) ) 4.8925351264 1.5231337816 1.5231337816 #med terminal methyl
#assign (residue 41 and name HN ) and assign ((residue 38 and name HD*) or (residue 38 and name HD#) ) 4.9149213182 1.5287303295 1.5287303295 #med terminal methyl
#assign (residue 41 and name HN ) and assign ((residue 39 and name HB#) or (residue 39 and name HB*) ) 3.5404634265 0.8851158566 0.8851158566 #med
#assign (residue 42 and name HN ) and assign ((residue 44 and name HA1 ) or (residue 40 and name HB# ) or (residue 40 and name HB*)) 4.778532134 1.1946330335 1.1946330335 #med "S2 < 0.6"
#assign (residue 42 and name HN ) and assign ((residue 40 and name HN) or ( residue 43 and name HN) ) 2.8595558051 0.7148889513 0.7148889513 #med "S2 < 0.6"
#assign (residue 42 and name HN ) and assign (residue 40 and name HA ) 4.6592898918 1.164822473 1.164822473 #med "S2 < 0.6"
#assign (residue 43 and name HN ) and assign (residue 41 and name HA ) 3.6041314811 0.9010328703 0.9010328703 #med "S2 < 0.6"
#assign (residue 43 and name HN ) and assign ((residue 41 and name HG2#) or (residue 41 and name HG2*) ) 4.076972081 1.0192430203 1.0192430203 #med "S2 < 0.6"
#assign (residue 43 and name HN ) and assign (residue 41 and name HB ) 3.7881772961 0.947044324 0.947044324 #med "S2 < 0.6"
#assign (residue 44 and name HN ) and assign ((residue 47 and name HG2#) or (residue 47 and name HG2*) ) 4.9876986759 1.246924669 1.246924669 #med "S2 < 0.6"
#assign (residue 44 and name HN ) and assign (residue 42 and name HA ) 4.4752069802 1.1188017451 1.1188017451 #med "S2 < 0.6"
#assign (residue 45 and name HN ) and assign ((residue 42 and name HA) or ( residue 46 and name HA) ) 4.1383523008 1.0345880752 1.0345880752 #med "S2 < 0.6"
#assign (residue 45 and name HN ) and assign ((residue 43 and name HG#) or (residue 43 and name HG*)) 3.8646680046 0.9661670012 0.9661670012 #med "S2 < 0.6"
#assign (residue 45 and name HN ) and assign (residue 43 and name HA ) 3.7451721211 0.9362930303 0.9362930303 #med "S2 < 0.6"
#assign (residue 45 and name HN ) and assign (residue 47 and name HN ) 3.3439960515 0.8359990129 0.8359990129 #med "S2 < 0.6"
#assign (residue 46 and name HN ) and assign ((residue 48 and name HN) or (residue 45 and name HN) ) 4.2102431444 1.0525607861 1.0525607861 #med "S2 < 0.6"
#assign (residue 46 and name HN ) and assign (residue 44 and name HA2 ) 3.2539768836 0.8134942209 0.8134942209 #med "S2 < 0.6"
#assign (residue 47 and name HN ) and assign ((residue 44 and name HA2) or (residue 45 and name HB2) ) 4.6556732817 1.1639183204 1.1639183204 #med "S2 < 0.6"
#assign (residue 47 and name HN ) and assign (residue 45 and name HA ) 4.423658484 1.105914621 1.105914621 #med "S2 < 0.6"
#assign (residue 47 and name HN ) and assign ((residue 49 and name HA#) or (residue 49 and name HA*) or (residue 45 and name HB1) ) 3.995217615 0.9988044038 0.9988044038 #med "S2 < 0.6"
#assign (residue 47 and name HN ) and assign (residue 49 and name HN ) 4.1238185434 1.0309546358 1.0309546358 #med "S2 < 0.6"
#assign (residue 47 and name HN ) and assign (residue 45 and name HN ) 4.0636793456 1.0159198364 1.0159198364 #med "S2 < 0.6"
#assign (residue 48 and name HN ) and assign ((residue 44 and name HA2) or (residue 45 and name HB2) ) 4.6959627345 1.1739906836 1.1739906836 #med "S2 < 0.6"
#assign (residue 48 and name HN ) and assign (residue 45 and name HA ) 5.1122785598 1.27806964 1.27806964 #med "S2 < 0.6"
#assign (residue 48 and name HN ) and assign (residue 46 and name HA ) 4.6761820938 1.1690455235 1.1690455235 #med "S2 < 0.6"
#assign (residue 48 and name HN ) and assign ((residue 46 and name HB#) or (residue 46 and name HB*) ) 4.4502276512 1.1125569128 1.1125569128 #med "S2 < 0.6"
#assign (residue 48 and name HN ) and assign (residue 46 and name HN ) 4.8078695476 1.2019673869 1.2019673869 #med "S2 < 0.6"
#assign (residue 49 and name HN ) and assign ((residue 46 and name HB#) or (residue 52 and name HB#) or (residue 46 and name HB*) or (residue 52 and name HB*) ) 3.8533354742 0.9633338686 0.9633338686 #med "S2 < 0.6"
#assign (residue 49 and name HN ) and assign ((residue 47 and name HG2#) or (residue 47 and name HG2*) ) 4.7933651729 1.1983412932 1.1983412932 #med "S2 < 0.6"
#assign (residue 49 and name HN ) and assign (residue 47 and name HN ) 4.6108148483 1.1527037121 1.1527037121 #med "S2 < 0.6"
#assign (residue 50 and name HN ) and assign (residue 48 and name HA ) 4.8582380457 1.2145595114 1.2145595114 #med "S2 < 0.6"
assign (residue 51 and name HN ) and assign ((residue 53 and name HN) or (residue 52 and name HN) ) 2.7298738771 0.6824684693 0.6824684693 #med
assign (residue 52 and name HN ) and assign ((residue 55 and name HG#) or (residue 55 and name HG*) ) 6.497039784 1.624259946 1.624259946 #med
assign (residue 52 and name HN ) and assign ((residue 54 and name HG1#) or (residue 54 and name HG1*) or (residue 54 and name HG2#) or (residue 54 and name HG2*) ) 4.8233426406 1.5058356602 1.5058356602 #med terminal methyl
assign (residue 52 and name HN ) and assign (residue 54 and name HN ) 4.8431648888 1.2107912222 1.2107912222 #med
assign (residue 53 and name HN ) and assign (residue 55 and name HN ) 4.6274641642 1.156866041 1.156866041 #med
assign (residue 53 and name HN ) and assign (residue 51 and name HA ) 3.9410165303 0.9852541326 0.9852541326 #med
assign (residue 53 and name HN ) and assign ((residue 51 and name HB#) or (residue 51 and name HB*)) 4.8097938403 1.2024484601 1.2024484601 #med
assign (residue 54 and name HN ) and assign (residue 51 and name HA ) 4.1631879745 1.0407969936 1.0407969936 #med
assign (residue 54 and name HN ) and assign ((residue 57 and name HD#) or (residue 57 and name HD*)) 4.8753871705 1.5188467926 1.5188467926 #med terminal methyl
assign (residue 54 and name HN ) and assign ((residue 52 and name HN) or (residue 53 and name HN) ) 2.6813744173 0.6703436043 0.6703436043 #med
assign (residue 54 and name HN ) and assign (residue 52 and name HD2* ) 4.3508307361 1.087707684 1.087707684 #med
assign (residue 54 and name HN ) and assign (residue 52 and name HA ) 4.3407319468 1.0851829867 1.0851829867 #med
assign (residue 55 and name HN ) and assign ((residue 53 and name HB#) or (residue 53 and name HB*) ) 4.7485012027 1.4871253007 1.4871253007 #med terminal methyl
assign (residue 55 and name HN ) and assign (residue 51 and name HA ) 4.9485691555 1.2371422889 1.2371422889 #med
assign (residue 55 and name HN ) and assign (residue 52 and name HA ) 3.8662456504 0.9665614126 0.9665614126 #med
assign (residue 55 and name HN ) and assign (residue 53 and name HN ) 4.4269435748 1.1067358937 1.1067358937 #med
assign (residue 56 and name HN ) and assign (residue 52 and name HA ) 4.9391751584 1.2347937896 1.2347937896 #med
assign (residue 56 and name HN ) and assign ((residue 52 and name HB#) or (residue 52 and name HB*) ) 5.0241754536 1.2560438634 1.2560438634 #med
assign (residue 56 and name HN ) and assign ((residue 53 and name HB#) or (residue 53 and name HB*) ) 4.6731916728 1.4682979182 1.4682979182 #med terminal methyl
assign (residue 56 and name HN ) and assign (residue 54 and name HA ) 4.8754966303 1.2188741576 1.2188741576 #med
assign (residue 57 and name HN ) and assign ((residue 54 and name HB) or (residue 56 and name HB) ) 3.2048074683 0.8012018671 0.8012018671 #med
assign (residue 57 and name HN ) and assign (residue 54 and name HA ) 3.9494640735 0.9873660184 0.9873660184 #med
assign (residue 58 and name HN ) and assign ((residue 56 and name HG1#) or (residue 56 and name HG1*) or (residue 56 and name HG2#) or (residue 56 and name HG2*) ) 4.6784440177 1.4696110044 1.4696110044 #med terminal methyl
assign (residue 58 and name HN ) and assign ((residue 56 and name HG2#) or (residue 56 and name HG2*) or (residue 56 and name HG1#) or (residue 56 and name HG1*) ) 4.3617554497 1.3904388624 1.3904388624 #med terminal methyl
assign (residue 58 and name HN ) and assign (residue 56 and name HA ) 5.2983286681 1.324582167 1.324582167 #med
assign (residue 59 and name HN ) and assign ((residue 61 and name HB*) or ( residue 59 and name HB*) or (residue 59 and name HB#) or (residue 58 and name HB*) or (residue 58 and name HB#) or (residue 57 and name HG)) 3.4294910645 3.429 0.8573727661 #med
assign (residue 60 and name HN ) and assign ((residue 63 and name HB#) or (residue 63 and name HB*) ) 4.7961558331 1.1990389583 1.1990389583 #med
assign (residue 60 and name HN ) and assign (residue 58 and name HA ) 3.4967510707 0.8741877677 0.8741877677 #med
assign (residue 60 and name HN ) and assign ((residue 62 and name HD1#) or (residue 62 and name HD1*) or (residue 62 and name HD2*) or (residue 62 and name HD2#) or (residue 56 and name HG2#) or (residue 56 and name HG2*) ) 3.9456332359 1.286408309 1.286408309 #med terminal methyl
assign (residue 60 and name HN ) and assign ((residue 62 and name HB#) or (residue 62 and name HB*) ) 4.8805623922 1.2201405981 1.2201405981 #med
assign (residue 62 and name HN ) and assign ((residue 65 and name HB#) or (residue 65 and name HB*) ) 4.8410548837 1.2102637209 1.2102637209 #med
assign (residue 62 and name HN ) and assign (residue 64 and name HB1 ) 4.7121297361 1.178032434 1.178032434 #med
assign (residue 62 and name HN ) and assign (residue 60 and name HA ) 4.1874570283 1.0468642571 1.0468642571 #med
assign (residue 62 and name HN ) and assign (residue 64 and name HN ) 4.8154067292 1.2038516823 1.2038516823 #med
assign (residue 63 and name HN ) and assign (residue 65 and name HN ) 4.574742701 1.1436856753 1.1436856753 #med
assign (residue 63 and name HN ) and assign ((residue 65 and name HD#) or (residue 65 and name HD*) ) 5.136378126 1.2840945315 1.2840945315 #med
assign (residue 63 and name HN ) and assign (residue 61 and name HA ) 3.9672111989 0.9918027997 0.9918027997 #med
assign (residue 63 and name HN ) and assign (residue 61 and name HB* ) 5.3234549094 1.3308637273 1.3308637273 #med
assign (residue 64 and name HN ) and assign (residue 61 and name HA ) 2.9604137188 0.7401034297 0.7401034297 #med
assign (residue 64 and name HN ) and assign (residue 62 and name HA ) 3.7854908404 0.9463727101 0.9463727101 #med
#assign (residue 64 and name HN ) and assign ((residue 66 and name HA) or (residue 61 and name HA) ) 2.7758979482 0.693974487 0.693974487 #med "S2 < 0.6"
assign (residue 64 and name HN ) and assign ((residue 62 and name HD2#) or (residue 62 and name HD2*) or (residue 62 and name HD1#) or (residue 62 and name HD1*) ) 4.2660967842 1.3665241961 1.3665241961 #med terminal methyl
assign (residue 64 and name HN ) and assign (residue 62 and name HN ) 2.9960474392 0.7490118598 0.7490118598 #med
assign (residue 65 and name HN ) and assign (residue 62 and name HA ) 4.627267936 1.156816984 1.156816984 #med
assign (residue 65 and name HN ) and assign ((residue 63 and name HB#) or (residue 63 and name HB*) ) 5.1304290629 1.2826072657 1.2826072657 #med
assign (residue 65 and name HN ) and assign (residue 63 and name HN ) 4.9188461258 1.2297115315 1.2297115315 #med
#assign (residue 67 and name HN ) and assign ((residue 65 and name HB#) or (residue 65 and name HB*) or (residue 68 and name HG#) or (residue 68 and name HG*) or (residue 69 and name HG#) or (residue 69 and name HG*) ) 4.4881869155 1.1220467289 1.1220467289 #med  "S2 < 0.6"
#assign (residue 67 and name HN ) and assign ((residue 65 and name HA) or (residue 66 and name HA) ) 2.291540739 0.5728851847 0.5728851847 #med  "S2 < 0.6"
#assign (residue 68 and name HN ) and assign ((residue 65 and name HA) or (residue 66 and name HA) ) 2.9754727733 0.7438681933 0.7438681933 #med  "S2 < 0.6"

#long
assign	(residue 13 and name HN	) and assign ((residue 18 and name HB#)	or (residue 18 and name HB*))	5.0946787899	1.2736696975	1.2736696975	#long
assign	(residue 18 and	name HN	) and assign ((residue 13 and name HB#)	or (residue 13 and name HB*))	5.0406500595	1.2601625149	1.2601625149	#long
assign	(residue 19 and	name HN	) and assign ((residue 13 and name HB#)	or (residue 13 and name	HB*))	4.8121691996	1.2030422999	1.2030422999	#long
assign	(residue 31 and	name HN	) and assign ((residue 26 and name HD*)	or (residue 26 and name	HE*) or (residue 26 and name HD#) or (residue 26 and name HE#) or (residue 26 and name HZ))	4.7588284356	1.1897071089	1.1897071089	#long

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