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
	642760	6rva	34408	cing	1-original	3	XPLOR/CNS	distance	NOE	ambi

# Restraints file 3: noe.tbl
assign (( resid 53 and name HN
	 ))
       (( resid 53 and name HA
	 )) 4.0 2.0 0.8 volume=124811.500 peak=1 ppm1=8.834 ppm2=4.823

assign (( resid 53 and name HN
	 ))
       (( resid 53 and name HB2
	 )) 4.1 2.0 0.8 volume=110865.250 peak=2 ppm1=8.831 ppm2=3.169

assign (( resid 53 and name HN
	 ))
       (( resid 53 and name HB1
	 )) 3.9 2.0 0.8 volume=134661.250 peak=3 ppm1=8.831 ppm2=3.265

assign (( resid 21 and name HN
	 ))
       (( resid 21 and name HA
	 )) 3.5 1.7 0.7 volume=289759.500 peak=4 ppm1=8.683 ppm2=4.549

assign (( resid 21 and name HN
	 ))
       (( resid 21 and name HB2
	 ) or ( resid 21 and name HB1
	 )) 3.1 1.4 0.6 volume=516176.250 peak=5 ppm1=8.684 ppm2=2.855

assign (( resid 8 and name HN
	 ))
       (( resid 8 and name HA2
	 )) 3.4 1.7 0.7 volume=314257.250 peak=6 ppm1=8.645 ppm2=3.797

assign (( resid 8 and name HN
	 ))
       (( resid 8 and name HA1
	 )) 3.5 1.7 0.7 volume=292601.750 peak=7 ppm1=8.646 ppm2=3.931

assign (( resid 4 and name HN
	 ))
       (( resid 4 and name HA
	 )) 3.3 1.6 0.7 volume=396014.750 peak=8 ppm1=8.573 ppm2=4.473

assign (( resid 4 and name HN
	 ))
       (( resid 4 and name HB2
	 )) 3.3 1.6 0.7 volume=384045.250 peak=9 ppm1=8.571 ppm2=1.995

assign (( resid 4 and name HN
	 ))
       (( resid 4 and name HB1
	 )) 3.7 1.8 0.7 volume=199798.250 peak=10 ppm1=8.573 ppm2=2.140

assign (( resid 4 and name HN
	 ))
       (( resid 4 and name HG2
	 ) or ( resid 4 and name HG1
	 )) 3.6 1.8 0.7 volume=221466.000 peak=11 ppm1=8.573 ppm2=2.435

assign (( resid 9 and name HN
	 ))
       (( resid 9 and name HB%
	 )) 3.0 1.3 0.6 volume=692590.750 peak=12 ppm1=8.567 ppm2=1.440

assign (( resid 9 and name HN
	 ))
       (( resid 9 and name HA
	 )) 3.6 1.8 0.7 volume=221585.000 peak=13 ppm1=8.566 ppm2=4.092

assign (( resid 19 and name HN
	 ))
       (( resid 19 and name HA
	 )) 3.3 1.6 0.7 volume=358494.000 peak=14 ppm1=8.544 ppm2=4.784

assign (( resid 19 and name HN
	 ))
       (( resid 19 and name HB1
	 )) 3.6 1.8 0.7 volume=235185.000 peak=15 ppm1=8.543 ppm2=3.262

assign (( resid 19 and name HN
	 ))
       (( resid 19 and name HB2
	 )) 3.2 1.5 0.6 volume=431207.250 peak=16 ppm1=8.542 ppm2=2.892

assign (( resid 41 and name HN
	 ))
       (( resid 41 and name HA
	 )) 3.3 1.6 0.7 volume=372466.500 peak=17 ppm1=8.422 ppm2=4.376

assign (( resid 41 and name HN
	 ))
       (( resid 41 and name HG2
	 ) or ( resid 41 and name HG1
	 )) 3.3 1.6 0.7 volume=359403.250 peak=18 ppm1=8.421 ppm2=2.372

assign (( resid 41 and name HN
	 ))
       (( resid 41 and name HB1
	 )) 3.5 1.8 0.7 volume=268356.750 peak=19 ppm1=8.421 ppm2=2.133

assign (( resid 41 and name HE21
	 ))
       (( resid 41 and name HG2
	 ) or ( resid 41 and name HG1
	 )) 3.7 1.8 0.7 volume=205237.500 peak=20 ppm1=7.441 ppm2=2.372

assign (( resid 41 and name HE22
	 ))
       (( resid 41 and name HG2
	 ) or ( resid 41 and name HG1
	 )) 3.8 1.9 0.8 volume=178045.250 peak=21 ppm1=6.789 ppm2=2.375

assign (( resid 41 and name HE21
	 ))
       (( resid 41 and name HE22
	 )) 2.0 0.3 0.4 volume=8143792.750 peak=22 ppm1=7.441 ppm2=6.793

assign (( resid 33 and name HN
	 ))
       (( resid 33 and name HA2
	 )) 2.9 1.1 0.6 volume=912739.250 peak=23 ppm1=8.340 ppm2=3.882

assign (( resid 33 and name HN
	 ))
       (( resid 33 and name HA1
	 )) 3.0 1.3 0.6 volume=706994.250 peak=24 ppm1=8.340 ppm2=3.967

assign (( resid 35 and name HN
	 ))
       (( resid 35 and name HA
	 )) 3.5 1.7 0.7 volume=278256.500 peak=25 ppm1=8.344 ppm2=4.493

assign (( resid 35 and name HN
	 ))
       (( resid 35 and name HB2
	 )) 2.9 1.2 0.6 volume=773807.000 peak=26 ppm1=8.344 ppm2=3.889

assign (( resid 35 and name HN
	 ))
       (( resid 35 and name HB1
	 )) 3.1 1.4 0.6 volume=542770.500 peak=27 ppm1=8.345 ppm2=3.974

assign (( resid 68 and name HN
	 ))
       (( resid 68 and name HA
	 )) 3.6 1.8 0.7 volume=229871.000 peak=28 ppm1=8.309 ppm2=4.296

assign (( resid 68 and name HN
	 ))
       (( resid 68 and name HB%
	 )) 3.0 1.2 0.6 volume=759130.500 peak=29 ppm1=8.308 ppm2=1.392

assign (( resid 54 and name HN
	 ))
       (( resid 54 and name HA
	 )) 3.5 1.7 0.7 volume=284370.750 peak=30 ppm1=8.279 ppm2=4.688

assign (( resid 54 and name HN
	 ))
       (( resid 54 and name HB2
	 )) 3.2 1.4 0.6 volume=503705.000 peak=31 ppm1=8.280 ppm2=2.750

assign (( resid 54 and name HN
	 ))
       (( resid 54 and name HB1
	 )) 3.2 1.4 0.6 volume=499247.000 peak=32 ppm1=8.281 ppm2=2.817

assign (( resid 70 and name HN
	 ))
       (( resid 70 and name HA
	 )) 3.6 1.8 0.7 volume=212890.000 peak=33 ppm1=8.257 ppm2=4.439

assign (( resid 31 and name HN
	 ))
       (( resid 31 and name HA1
	 )) 3.0 1.2 0.6 volume=742186.250 peak=34 ppm1=8.233 ppm2=3.885

assign (( resid 31 and name HN
	 ))
       (( resid 31 and name HA2
	 )) 3.1 1.4 0.6 volume=555031.750 peak=35 ppm1=8.233 ppm2=3.943

assign (( resid 48 and name HN
	 ))
       (( resid 48 and name HA
	 )) 3.3 1.6 0.7 volume=403923.000 peak=36 ppm1=8.222 ppm2=4.807

assign (( resid 48 and name HN
	 ))
       (( resid 48 and name HB2
	 )) 3.3 1.5 0.7 volume=414245.250 peak=37 ppm1=8.226 ppm2=3.250

assign (( resid 48 and name HN
	 ))
       (( resid 48 and name HB1
	 )) 3.2 1.4 0.6 volume=512261.000 peak=38 ppm1=8.224 ppm2=2.992

assign (( resid 7 and name HN
	 ))
       (( resid 7 and name HA
	 )) 3.1 1.4 0.6 volume=548430.500 peak=39 ppm1=8.189 ppm2=4.674

assign (( resid 7 and name HN
	 ))
       (( resid 7 and name HB1
	 )) 3.2 1.5 0.6 volume=454527.750 peak=40 ppm1=8.184 ppm2=3.093

assign (( resid 7 and name HN
	 ))
       (( resid 7 and name HB2
	 )) 3.0 1.2 0.6 volume=736131.000 peak=41 ppm1=8.186 ppm2=2.954

assign (( resid 34 and name HN
	 ))
       (( resid 34 and name HA
	 )) 2.9 1.2 0.6 volume=772574.000 peak=42 ppm1=8.185 ppm2=4.466

assign (( resid 34 and name HN
	 ))
       (( resid 34 and name HB2
	 )) 3.6 1.8 0.7 volume=222115.500 peak=43 ppm1=8.181 ppm2=3.933

assign (( resid 34 and name HN
	 ))
       (( resid 34 and name HB1
	 )) 3.1 1.4 0.6 volume=538501.250 peak=44 ppm1=8.179 ppm2=3.861

assign (( resid 36 and name HN
	 ))
       (( resid 36 and name HA
	 )) 3.0 1.2 0.6 volume=731849.500 peak=45 ppm1=8.161 ppm2=4.437

assign (( resid 36 and name HN
	 ))
       (( resid 36 and name HB1
	 )) 3.3 1.6 0.7 volume=401738.750 peak=46 ppm1=8.164 ppm2=3.851

assign (( resid 36 and name HN
	 ))
       (( resid 36 and name HB2
	 )) 3.3 1.6 0.7 volume=361844.500 peak=47 ppm1=8.161 ppm2=3.894

assign (( resid 39 and name HN
	 ))
       (( resid 39 and name HA
	 )) 3.3 1.6 0.7 volume=376623.750 peak=48 ppm1=8.128 ppm2=4.572

assign (( resid 39 and name HN
	 ))
       (( resid 39 and name HB%
	 )) 2.7 1.0 0.5 volume=1241335.250 peak=49 ppm1=8.129 ppm2=1.344

assign (( resid 27 and name HN
	 ))
       (( resid 27 and name HA
	 )) 2.7 1.0 0.5 volume=1379103.500 peak=50 ppm1=8.112 ppm2=4.734

assign (( resid 27 and name HN
	 ))
       (( resid 27 and name HB2
	 )) 3.1 1.4 0.6 volume=556335.000 peak=51 ppm1=8.116 ppm2=2.649

assign (( resid 27 and name HN
	 ))
       (( resid 27 and name HB1
	 )) 3.2 1.5 0.6 volume=435792.000 peak=52 ppm1=8.116 ppm2=2.746

assign (( resid 27 and name HD22
	 ))
       (( resid 27 and name HB2
	 )) 3.9 1.9 0.8 volume=147753.750 peak=53 ppm1=7.464 ppm2=2.650

assign (( resid 27 and name HD21
	 ))
       (( resid 27 and name HB2
	 )) 4.0 2.0 0.8 volume=125632.750 peak=54 ppm1=6.851 ppm2=2.646

assign (( resid 27 and name HD21
	 ))
       (( resid 27 and name HB1
	 )) 4.3 2.1 0.9 volume=83252.750 peak=55 ppm1=6.851 ppm2=2.745

assign (( resid 27 and name HD22
	 ))
       (( resid 27 and name HB1
	 )) 3.9 2.0 0.8 volume=134195.250 peak=56 ppm1=7.468 ppm2=2.745

assign (( resid 15 and name HN
	 ))
       (( resid 15 and name HA
	 )) 3.5 1.7 0.7 volume=293356.750 peak=57 ppm1=8.105 ppm2=3.876

assign (( resid 15 and name HN
	 ))
       (( resid 15 and name HD1%
	 )) 3.7 1.9 0.7 volume=183803.750 peak=58 ppm1=8.108 ppm2=0.455

assign (( resid 15 and name HN
	 ))
       (( resid 15 and name HD2%
	 )) 3.6 1.8 0.7 volume=231521.250 peak=59 ppm1=8.108 ppm2=0.667

assign (( resid 15 and name HN
	 ))
       (( resid 15 and name HG
	 )) 3.4 1.6 0.7 volume=349176.750 peak=60 ppm1=8.103 ppm2=1.272

assign (( resid 15 and name HN
	 ))
       (( resid 15 and name HB1
	 ) or ( resid 15 and name HB2
	 )) 2.9 1.2 0.6 volume=880933.250 peak=61 ppm1=8.105 ppm2=1.459

assign (( resid 13 and name HN
	 ))
       (( resid 13 and name HA
	 )) 3.1 1.4 0.6 volume=559650.250 peak=62 ppm1=8.090 ppm2=4.407

assign (( resid 13 and name HN
	 ))
       (( resid 13 and name HB1
	 ) or ( resid 13 and name HB2
	 )) 2.8 1.0 0.6 volume=1155077.000 peak=63 ppm1=8.090 ppm2=2.834

assign (( resid 10 and name HN
	 ))
       (( resid 10 and name HA
	 )) 3.0 1.3 0.6 volume=677462.000 peak=64 ppm1=8.088 ppm2=4.145

assign (( resid 10 and name HN
	 ))
       (( resid 10 and name HG2
	 ) or ( resid 10 and name HG1
	 )) 3.3 1.6 0.7 volume=394959.000 peak=65 ppm1=8.087 ppm2=2.543

assign (( resid 10 and name HN
	 ))
       (( resid 10 and name HB2
	 )) 3.1 1.4 0.6 volume=546673.750 peak=66 ppm1=8.086 ppm2=2.187

assign (( resid 10 and name HN
	 ))
       (( resid 10 and name HB1
	 )) 3.3 1.6 0.7 volume=376151.750 peak=67 ppm1=8.087 ppm2=2.127

assign (( resid 22 and name HN
	 ))
       (( resid 22 and name HB2
	 )) 3.4 1.7 0.7 volume=316891.500 peak=68 ppm1=8.071 ppm2=2.023

assign (( resid 22 and name HN
	 ))
       (( resid 22 and name HB1
	 )) 3.2 1.4 0.6 volume=500842.000 peak=69 ppm1=8.070 ppm2=1.935

assign (( resid 22 and name HN
	 ))
       (( resid 22 and name HG2
	 )) 3.3 1.5 0.7 volume=412447.500 peak=70 ppm1=8.071 ppm2=1.811

assign (( resid 22 and name HN
	 ))
       (( resid 22 and name HG1
	 )) 3.4 1.7 0.7 volume=309505.250 peak=71 ppm1=8.073 ppm2=1.714

assign (( resid 22 and name HN
	 ))
       (( resid 22 and name HA
	 )) 3.0 1.3 0.6 volume=667042.000 peak=72 ppm1=8.068 ppm2=4.186

assign (( resid 22 and name HN
	 ))
       (( resid 22 and name HD1
	 ) or ( resid 22 and name HD2
	 )) 3.8 1.9 0.8 volume=175196.000 peak=73 ppm1=8.068 ppm2=3.261

assign (( resid 22 and name HE
	 ))
       (( resid 22 and name HD1
	 )) 3.1 1.4 0.6 volume=596120.750 peak=74 ppm1=7.092 ppm2=3.267

assign (( resid 22 and name HE
	 ))
       (( resid 22 and name HB2
	 )) 3.5 1.8 0.7 volume=260473.500 peak=75 ppm1=7.094 ppm2=2.024

assign (( resid 22 and name HE
	 ))
       (( resid 22 and name HB1
	 )) 3.7 1.9 0.7 volume=187171.000 peak=76 ppm1=7.097 ppm2=1.938

assign (( resid 22 and name HE
	 ))
       (( resid 22 and name HG2
	 )) 3.7 1.9 0.7 volume=192715.250 peak=77 ppm1=7.095 ppm2=1.813

assign (( resid 22 and name HE
	 ))
       (( resid 22 and name HG1
	 )) 3.8 1.9 0.8 volume=175146.250 peak=78 ppm1=7.095 ppm2=1.716

assign (( resid 22 and name HE
	 ))
       (( resid 22 and name HA
	 )) 4.5 2.3 0.9 volume=57022.000 peak=79 ppm1=7.097 ppm2=4.188

assign (( resid 32 and name HN
	 ))
       (( resid 32 and name HA
	 )) 2.8 1.1 0.6 volume=995579.250 peak=80 ppm1=8.063 ppm2=4.553

assign (( resid 32 and name HN
	 ))
       (( resid 32 and name HB2
	 )) 3.3 1.6 0.7 volume=369629.000 peak=81 ppm1=8.066 ppm2=3.055

assign (( resid 32 and name HN
	 ))
       (( resid 32 and name HB1
	 )) 3.1 1.4 0.6 volume=597762.750 peak=82 ppm1=8.066 ppm2=2.943

assign (( resid 32 and name HD%
	 ))
       (( resid 32 and name HA
	 )) 3.5 1.7 0.7 volume=281393.750 peak=83 ppm1=7.097 ppm2=4.554

assign (( resid 32 and name HD%
	 ))
       (( resid 32 and name HB2
	 )) 3.2 1.5 0.6 volume=438438.250 peak=84 ppm1=7.099 ppm2=3.055

assign (( resid 32 and name HD%
	 ))
       (( resid 32 and name HB1
	 )) 3.3 1.6 0.7 volume=393844.750 peak=85 ppm1=7.096 ppm2=2.944

assign (( resid 32 and name HE%
	 ))
       (( resid 32 and name HB1
	 )) 4.1 2.1 0.8 volume=101594.250 peak=86 ppm1=6.837 ppm2=2.945

assign (( resid 32 and name HE%
	 ))
       (( resid 32 and name HB2
	 )) 4.3 2.1 0.9 volume=82538.250 peak=87 ppm1=6.837 ppm2=3.053

assign (( resid 32 and name HD%
	 ))
       (( resid 32 and name HE%
	 )) 2.2 0.4 0.4 volume=4823545.250 peak=88 ppm1=7.091 ppm2=6.831

assign (( resid 42 and name HN
	 ))
       (( resid 42 and name HA
	 )) 3.0 1.2 0.6 volume=755233.750 peak=89 ppm1=8.030 ppm2=4.346

assign (( resid 42 and name HN
	 ))
       (( resid 42 and name HB
	 )) 3.4 1.6 0.7 volume=352837.250 peak=90 ppm1=8.030 ppm2=4.241

assign (( resid 42 and name HA
	 ))
       (( resid 42 and name HB
	 )) 4.2 2.1 0.8 volume=90565.000 peak=91 ppm1=4.347 ppm2=4.246

assign (( resid 42 and name HN
	 ))
       (( resid 42 and name HG2%
	 )) 3.2 1.4 0.6 volume=495208.500 peak=92 ppm1=8.028 ppm2=1.210

assign (( resid 42 and name HA
	 ))
       (( resid 42 and name HG2%
	 )) 3.7 1.8 0.7 volume=200527.750 peak=93 ppm1=4.343 ppm2=1.211

assign (( resid 5 and name HN
	 ))
       (( resid 5 and name HA
	 )) 3.0 1.3 0.6 volume=712739.500 peak=94 ppm1=7.997 ppm2=4.505

assign (( resid 5 and name HN
	 ))
       (( resid 5 and name HB
	 )) 3.3 1.5 0.7 volume=418720.250 peak=95 ppm1=7.996 ppm2=4.235

assign (( resid 5 and name HN
	 ))
       (( resid 5 and name HG2%
	 )) 3.1 1.4 0.6 volume=536321.750 peak=96 ppm1=7.995 ppm2=1.110

assign (( resid 47 and name HN
	 ))
       (( resid 47 and name HA
	 )) 3.3 1.5 0.7 volume=416746.250 peak=97 ppm1=7.983 ppm2=4.161

assign (( resid 47 and name HN
	 ))
       (( resid 47 and name HG1
	 ) or ( resid 47 and name HG2
	 )) 3.4 1.7 0.7 volume=306395.000 peak=98 ppm1=7.989 ppm2=2.441

assign (( resid 47 and name HN
	 ))
       (( resid 47 and name HB2
	 ) or ( resid 47 and name HB1
	 )) 3.0 1.3 0.6 volume=685525.000 peak=99 ppm1=7.984 ppm2=2.081

assign (( resid 47 and name HA
	 ))
       (( resid 47 and name HB2
	 )) 3.1 1.4 0.6 volume=590008.750 peak=100 ppm1=4.163 ppm2=2.086

assign (( resid 47 and name HA
	 ))
       (( resid 47 and name HG1
	 )) 3.6 1.8 0.7 volume=230067.250 peak=101 ppm1=4.162 ppm2=2.443

assign (( resid 46 and name HN
	 ))
       (( resid 46 and name HB1
	 ) or ( resid 46 and name HB2
	 )) 2.8 1.0 0.6 volume=1119037.000 peak=102 ppm1=7.979 ppm2=2.785

assign (( resid 46 and name HB1
	 ))
       (( resid 46 and name HA
	 )) 2.8 1.1 0.6 volume=1065459.000 peak=103 ppm1=2.786 ppm2=4.513

assign (( resid 46 and name HN
	 ))
       (( resid 46 and name HA
	 )) 3.0 1.2 0.6 volume=756962.000 peak=104 ppm1=7.982 ppm2=4.509

assign (( resid 61 and name HN
	 ))
       (( resid 61 and name HA
	 )) 3.1 1.4 0.6 volume=515431.500 peak=105 ppm1=7.933 ppm2=4.560

assign (( resid 61 and name HN
	 ))
       (( resid 61 and name HB1
	 )) 3.5 1.7 0.7 volume=280335.750 peak=106 ppm1=7.933 ppm2=3.425

assign (( resid 61 and name HN
	 ))
       (( resid 61 and name HB2
	 )) 3.1 1.4 0.6 volume=573172.250 peak=107 ppm1=7.932 ppm2=2.867

assign (( resid 61 and name HD%
	 ))
       (( resid 61 and name HB2
	 )) 3.0 1.2 0.6 volume=750437.750 peak=108 ppm1=7.264 ppm2=2.866

assign (( resid 61 and name HD%
	 ))
       (( resid 61 and name HB1
	 )) 3.1 1.4 0.6 volume=553087.000 peak=109 ppm1=7.263 ppm2=3.427

assign (( resid 61 and name HE%
	 ))
       (( resid 61 and name HB2
	 )) 4.0 2.0 0.8 volume=130793.500 peak=110 ppm1=6.781 ppm2=2.876

assign (( resid 61 and name HE%
	 ))
       (( resid 61 and name HB1
	 )) 4.3 2.1 0.9 volume=85016.750 peak=111 ppm1=6.774 ppm2=3.422

assign (( resid 61 and name HD%
	 ))
       (( resid 61 and name HA
	 )) 3.0 1.2 0.6 volume=757140.250 peak=112 ppm1=7.263 ppm2=4.558

assign (( resid 61 and name HE%
	 ))
       (( resid 61 and name HA
	 )) 3.8 1.9 0.8 volume=163462.250 peak=113 ppm1=6.777 ppm2=4.558

assign (( resid 61 and name HD%
	 ))
       (( resid 61 and name HE%
	 )) 2.3 0.6 0.5 volume=2992808.000 peak=114 ppm1=7.266 ppm2=6.779

assign (( resid 45 and name HN
	 ))
       (( resid 45 and name HA
	 )) 3.6 1.8 0.7 volume=223509.000 peak=115 ppm1=7.894 ppm2=3.734

assign (( resid 45 and name HN
	 ))
       (( resid 45 and name HB
	 )) 3.1 1.4 0.6 volume=578256.500 peak=116 ppm1=7.894 ppm2=1.976

assign (( resid 45 and name HN
	 ))
       (( resid 45 and name HG2%
	 )) 2.9 1.2 0.6 volume=790480.000 peak=117 ppm1=7.894 ppm2=0.861

assign (( resid 45 and name HN
	 ))
       (( resid 45 and name HG1%
	 )) 3.3 1.6 0.7 volume=371574.250 peak=118 ppm1=7.895 ppm2=0.790

assign (( resid 45 and name HA
	 ))
       (( resid 45 and name HG1%
	 )) 3.5 1.7 0.7 volume=290421.500 peak=119 ppm1=3.730 ppm2=0.787

assign (( resid 45 and name HA
	 ))
       (( resid 45 and name HG2%
	 )) 3.3 1.6 0.7 volume=377728.000 peak=120 ppm1=3.732 ppm2=0.860

assign (( resid 45 and name HA
	 ))
       (( resid 45 and name HB
	 )) 2.9 1.2 0.6 volume=819338.000 peak=121 ppm1=3.736 ppm2=1.981

assign (( resid 45 and name HB
	 ))
       (( resid 45 and name HG2%
	 )) 3.0 1.3 0.6 volume=653388.750 peak=122 ppm1=1.976 ppm2=0.862

assign (( resid 45 and name HB
	 ))
       (( resid 45 and name HG1%
	 )) 3.1 1.4 0.6 volume=549892.500 peak=123 ppm1=1.981 ppm2=0.788

assign (( resid 52 and name HN
	 ))
       (( resid 52 and name HA
	 )) 3.2 1.5 0.6 volume=485953.750 peak=124 ppm1=7.886 ppm2=4.474

assign (( resid 52 and name HN
	 ))
       (( resid 52 and name HB2
	 ) or ( resid 52 and name HB1
	 )) 3.3 1.6 0.7 volume=401498.500 peak=125 ppm1=7.884 ppm2=3.800

assign (( resid 52 and name HB2
	 ) or (resid 52 and name HB1
	 ))
       (( resid 52 and name HA
	 )) 3.0 1.3 0.6 volume=681052.250 peak=126 ppm1=3.807 ppm2=4.472

assign (( resid 44 and name HN
	 ))
       (( resid 44 and name HG2%
	 )) 3.0 1.3 0.6 volume=722589.000 peak=127 ppm1=7.855 ppm2=0.767

assign (( resid 44 and name HN
	 ))
       (( resid 44 and name HA
	 )) 3.2 1.5 0.6 volume=432379.000 peak=128 ppm1=7.854 ppm2=3.999

assign (( resid 44 and name HN
	 ))
       (( resid 44 and name HD1%
	 )) 4.0 2.0 0.8 volume=130087.250 peak=129 ppm1=7.856 ppm2=0.700

assign (( resid 44 and name HA
	 ))
       (( resid 44 and name HD1%
	 )) 3.4 1.7 0.7 volume=298395.500 peak=130 ppm1=4.000 ppm2=0.699

assign (( resid 44 and name HA
	 ))
       (( resid 44 and name HG2%
	 )) 3.1 1.4 0.6 volume=534813.500 peak=131 ppm1=3.999 ppm2=0.767

assign (( resid 44 and name HG2%
	 ))
       (( resid 44 and name HG11
	 )) 3.3 1.6 0.7 volume=403715.000 peak=132 ppm1=0.766 ppm2=1.004

assign (( resid 44 and name HD1%
	 ))
       (( resid 44 and name HG11
	 )) 3.0 1.2 0.6 volume=737382.500 peak=133 ppm1=0.701 ppm2=0.995

assign (( resid 44 and name HG11
	 ))
       (( resid 44 and name HD1%
	 )) 3.1 1.4 0.6 volume=541538.000 peak=134 ppm1=0.991 ppm2=0.700

assign (( resid 44 and name HG12
	 ))
       (( resid 44 and name HG11
	 )) 2.9 1.2 0.6 volume=859823.250 peak=135 ppm1=1.273 ppm2=1.002

assign (( resid 44 and name HG12
	 ))
       (( resid 44 and name HG2%
	 )) 3.4 1.6 0.7 volume=342962.000 peak=136 ppm1=1.282 ppm2=0.768

assign (( resid 44 and name HG12
	 ))
       (( resid 44 and name HD1%
	 )) 3.2 1.4 0.6 volume=495704.250 peak=137 ppm1=1.281 ppm2=0.698

assign (( resid 44 and name HB
	 ))
       (( resid 44 and name HG11
	 )) 4.0 2.0 0.8 volume=114455.250 peak=138 ppm1=1.529 ppm2=0.997

assign (( resid 44 and name HB
	 ))
       (( resid 44 and name HG2%
	 )) 3.6 1.8 0.7 volume=249949.750 peak=139 ppm1=1.519 ppm2=0.767

assign (( resid 44 and name HB
	 ))
       (( resid 44 and name HD1%
	 )) 3.9 2.0 0.8 volume=134358.250 peak=140 ppm1=1.519 ppm2=0.700

assign (( resid 44 and name HG12
	 ))
       (( resid 44 and name HB
	 )) 3.7 1.9 0.7 volume=183837.250 peak=141 ppm1=1.281 ppm2=1.521

assign (( resid 44 and name HA
	 ))
       (( resid 44 and name HG11
	 )) 3.7 1.8 0.7 volume=205108.000 peak=142 ppm1=4.000 ppm2=1.003

assign (( resid 44 and name HA
	 ))
       (( resid 44 and name HG12
	 )) 3.3 1.6 0.7 volume=372036.500 peak=143 ppm1=4.005 ppm2=1.284

assign (( resid 44 and name HA
	 ))
       (( resid 44 and name HB
	 )) 3.3 1.6 0.7 volume=370610.000 peak=144 ppm1=3.999 ppm2=1.527

assign (( resid 44 and name HN
	 ))
       (( resid 44 and name HG11
	 )) 3.7 1.9 0.7 volume=187734.250 peak=145 ppm1=7.855 ppm2=1.003

assign (( resid 44 and name HN
	 ))
       (( resid 44 and name HG12
	 )) 3.7 1.9 0.7 volume=185499.750 peak=146 ppm1=7.854 ppm2=1.276

assign (( resid 44 and name HN
	 ))
       (( resid 44 and name HB
	 )) 3.1 1.4 0.6 volume=531078.750 peak=147 ppm1=7.856 ppm2=1.525

assign (( resid 50 and name HN
	 ))
       (( resid 50 and name HA
	 )) 3.8 1.9 0.8 volume=161917.000 peak=148 ppm1=7.842 ppm2=4.673

assign (( resid 50 and name HN
	 ))
       (( resid 50 and name HB1
	 )) 3.6 1.8 0.7 volume=237331.000 peak=149 ppm1=7.841 ppm2=3.353

assign (( resid 50 and name HN
	 ))
       (( resid 50 and name HB2
	 )) 3.3 1.6 0.7 volume=364042.000 peak=150 ppm1=7.840 ppm2=3.062

assign (( resid 50 and name HD%
	 ))
       (( resid 50 and name HB2
	 )) 3.2 1.4 0.6 volume=508426.500 peak=151 ppm1=7.265 ppm2=3.059

assign (( resid 50 and name HD%
	 ))
       (( resid 50 and name HB1
	 )) 3.2 1.5 0.6 volume=481496.750 peak=152 ppm1=7.265 ppm2=3.358

assign (( resid 50 and name HE%
	 ))
       (( resid 50 and name HB1
	 )) 4.0 2.0 0.8 volume=116368.000 peak=153 ppm1=7.315 ppm2=3.365

assign (( resid 50 and name HE%
	 ))
       (( resid 50 and name HB2
	 )) 3.8 1.9 0.8 volume=176591.750 peak=154 ppm1=7.314 ppm2=3.059

assign (( resid 50 and name HD%
	 ))
       (( resid 50 and name HA
	 )) 3.3 1.6 0.7 volume=370800.250 peak=155 ppm1=7.265 ppm2=4.670

assign (( resid 50 and name HE%
	 ))
       (( resid 50 and name HD%
	 )) 1.9 0.1 0.4 volume=11794486.750 peak=156 ppm1=7.318 ppm2=7.266

assign (( resid 20 and name HN
	 ))
       (( resid 20 and name HA2
	 )) 3.0 1.3 0.6 volume=671569.750 peak=157 ppm1=7.814 ppm2=3.949

assign (( resid 20 and name HN
	 ))
       (( resid 20 and name HA1
	 )) 3.0 1.2 0.6 volume=738451.250 peak=158 ppm1=7.814 ppm2=3.978

assign (( resid 51 and name HN
	 ))
       (( resid 51 and name HA
	 )) 3.5 1.8 0.7 volume=263123.000 peak=159 ppm1=7.782 ppm2=4.443

assign (( resid 51 and name HE
	 ))
       (( resid 51 and name HA
	 )) 5.6 2.8 1.1 volume=16957.000 peak=160 ppm1=7.206 ppm2=4.442

assign (( resid 51 and name HN
	 ))
       (( resid 51 and name HD1
	 ) or ( resid 51 and name HD2
	 )) 5.2 2.6 1.0 volume=25818.000 peak=161 ppm1=7.785 ppm2=3.219

assign (( resid 51 and name HE
	 ))
       (( resid 51 and name HD1
	 ) or ( resid 51 and name HD2
	 )) 3.4 1.7 0.7 volume=317570.750 peak=162 ppm1=7.203 ppm2=3.217

assign (( resid 51 and name HN
	 ))
       (( resid 51 and name HB2
	 )) 4.0 2.0 0.8 volume=127653.250 peak=163 ppm1=7.782 ppm2=1.934

assign (( resid 51 and name HN
	 ))
       (( resid 51 and name HB1
	 )) 3.5 1.7 0.7 volume=287995.000 peak=164 ppm1=7.781 ppm2=1.838

assign (( resid 51 and name HN
	 ))
       (( resid 51 and name HG2
	 ) or ( resid 51 and name HG1
	 )) 4.0 2.0 0.8 volume=125932.500 peak=165 ppm1=7.783 ppm2=1.621

assign (( resid 57 and name HN
	 ))
       (( resid 57 and name HA
	 )) 3.0 1.3 0.6 volume=685824.000 peak=166 ppm1=7.808 ppm2=4.335

assign (( resid 57 and name HE
	 ))
       (( resid 57 and name HA
	 )) 4.2 2.1 0.8 volume=91596.000 peak=167 ppm1=7.482 ppm2=4.337

assign (( resid 57 and name HN
	 ))
       (( resid 57 and name HB2
	 )) 3.1 1.4 0.6 volume=528572.000 peak=168 ppm1=7.810 ppm2=2.057

assign (( resid 57 and name HE
	 ))
       (( resid 57 and name HB1
	 )) 3.3 1.6 0.7 volume=368740.750 peak=169 ppm1=7.485 ppm2=1.887

assign (( resid 57 and name HN
	 ))
       (( resid 57 and name HB1
	 )) 2.7 1.0 0.5 volume=1277851.000 peak=170 ppm1=7.808 ppm2=1.878

assign (( resid 57 and name HN
	 ))
       (( resid 57 and name HG2
	 ) or ( resid 57 and name HG1
	 )) 3.2 1.5 0.6 volume=489247.250 peak=171 ppm1=7.810 ppm2=1.711

assign (( resid 57 and name HE
	 ))
       (( resid 57 and name HG2
	 ) or ( resid 57 and name HG1
	 )) 3.4 1.6 0.7 volume=345772.000 peak=172 ppm1=7.489 ppm2=1.715

assign (( resid 57 and name HN
	 ))
       (( resid 57 and name HD2
	 ) or ( resid 57 and name HD1
	 )) 3.7 1.9 0.7 volume=189173.750 peak=173 ppm1=7.811 ppm2=3.259

assign (( resid 57 and name HE
	 ))
       (( resid 57 and name HD2
	 ) or ( resid 57 and name HD1
	 )) 3.5 1.8 0.7 volume=254398.750 peak=174 ppm1=7.487 ppm2=3.255

assign (( resid 14 and name HN
	 ))
       (( resid 14 and name HB%
	 )) 2.6 0.9 0.5 volume=1473995.500 peak=175 ppm1=7.756 ppm2=1.439

assign (( resid 14 and name HN
	 ))
       (( resid 14 and name HA
	 )) 3.2 1.5 0.6 volume=474532.250 peak=176 ppm1=7.756 ppm2=4.224

assign (( resid 17 and name HN
	 ))
       (( resid 17 and name HA
	 )) 3.2 1.5 0.6 volume=450824.000 peak=177 ppm1=7.693 ppm2=4.440

assign (( resid 17 and name HN
	 ))
       (( resid 17 and name HB2
	 ) or ( resid 17 and name HB1
	 )) 2.7 1.0 0.5 volume=1240257.750 peak=178 ppm1=7.693 ppm2=3.230

assign (( resid 17 and name HE%
	 ))
       (( resid 17 and name HB2
	 ) or ( resid 17 and name HB1
	 )) 3.7 1.8 0.7 volume=211782.750 peak=179 ppm1=7.334 ppm2=3.232

assign (( resid 17 and name HD%
	 ))
       (( resid 17 and name HB2
	 ) or ( resid 17 and name HB1
	 )) 2.8 1.1 0.6 volume=1053999.500 peak=180 ppm1=7.257 ppm2=3.230

assign (( resid 17 and name HE%
	 ))
       (( resid 17 and name HA
	 )) 4.0 2.0 0.8 volume=126059.000 peak=181 ppm1=7.333 ppm2=4.439

assign (( resid 17 and name HD%
	 ))
       (( resid 17 and name HA
	 )) 3.1 1.4 0.6 volume=568620.250 peak=182 ppm1=7.257 ppm2=4.440

assign (( resid 17 and name HN
	 ))
       (( resid 17 and name HD%
	 )) 4.0 2.0 0.8 volume=123820.500 peak=183 ppm1=7.694 ppm2=7.251

assign (( resid 60 and name HN
	 ))
       (( resid 60 and name HA
	 )) 3.0 1.3 0.6 volume=652908.500 peak=184 ppm1=7.666 ppm2=4.242

assign (( resid 60 and name HN
	 ))
       (( resid 60 and name HG1
	 )) 3.4 1.7 0.7 volume=315027.500 peak=185 ppm1=7.667 ppm2=2.399

assign (( resid 60 and name HN
	 ))
       (( resid 60 and name HG2
	 )) 3.4 1.7 0.7 volume=299569.250 peak=186 ppm1=7.666 ppm2=2.242

assign (( resid 60 and name HN
	 ))
       (( resid 60 and name HB1
	 )) 3.2 1.5 0.6 volume=436973.500 peak=187 ppm1=7.666 ppm2=1.890

assign (( resid 60 and name HN
	 ))
       (( resid 60 and name HB2
	 )) 3.2 1.4 0.6 volume=506992.500 peak=188 ppm1=7.667 ppm2=1.940

assign (( resid 24 and name HN
	 ))
       (( resid 24 and name HA
	 )) 3.6 1.8 0.7 volume=214048.500 peak=189 ppm1=7.584 ppm2=5.005

assign (( resid 24 and name HN
	 ))
       (( resid 24 and name HB1
	 )) 3.7 1.8 0.7 volume=206381.000 peak=190 ppm1=7.584 ppm2=2.857

assign (( resid 24 and name HN
	 ))
       (( resid 24 and name HB2
	 )) 3.9 2.0 0.8 volume=140373.750 peak=191 ppm1=7.584 ppm2=3.129

assign (( resid 24 and name HD%
	 ))
       (( resid 24 and name HB1
	 )) 2.9 1.2 0.6 volume=800520.000 peak=192 ppm1=6.857 ppm2=2.863

assign (( resid 24 and name HD%
	 ))
       (( resid 24 and name HB2
	 )) 3.0 1.3 0.6 volume=656062.500 peak=193 ppm1=6.856 ppm2=3.137

assign (( resid 24 and name HE%
	 ))
       (( resid 24 and name HB1
	 )) 3.8 1.9 0.8 volume=175556.750 peak=194 ppm1=7.157 ppm2=2.866

assign (( resid 24 and name HE%
	 ))
       (( resid 24 and name HB2
	 )) 3.7 1.8 0.7 volume=200135.250 peak=195 ppm1=7.160 ppm2=3.137

assign (( resid 24 and name HE%
	 ))
       (( resid 24 and name HD%
	 )) 2.4 0.7 0.5 volume=2443038.750 peak=196 ppm1=7.156 ppm2=6.858

assign (( resid 24 and name HZ
	 ))
       (( resid 24 and name HD%
	 )) 3.2 1.5 0.6 volume=435853.500 peak=197 ppm1=7.229 ppm2=6.860

assign (( resid 24 and name HZ
	 ))
       (( resid 24 and name HE%
	 )) 2.3 0.5 0.5 volume=3709057.000 peak=198 ppm1=7.231 ppm2=7.162

assign (( resid 24 and name HN
	 ))
       (( resid 24 and name HD%
	 )) 3.6 1.8 0.7 volume=234107.750 peak=199 ppm1=7.586 ppm2=6.858

assign (( resid 23 and name HN
	 ))
       (( resid 23 and name HA2
	 )) 3.7 1.9 0.7 volume=192996.000 peak=200 ppm1=7.549 ppm2=3.764

assign (( resid 23 and name HN
	 ))
       (( resid 23 and name HA1
	 )) 3.9 2.0 0.8 volume=135927.750 peak=201 ppm1=7.546 ppm2=3.986

assign (( resid 12 and name HN
	 ))
       (( resid 12 and name HA
	 )) 3.7 1.8 0.7 volume=197622.000 peak=202 ppm1=7.507 ppm2=3.399

assign (( resid 12 and name HN
	 ))
       (( resid 12 and name HB
	 )) 3.2 1.5 0.6 volume=478312.750 peak=203 ppm1=7.502 ppm2=2.071

assign (( resid 12 and name HN
	 ))
       (( resid 12 and name HG2%
	 ) or ( resid 12 and name HG1%
	 )) 2.9 1.2 0.6 volume=868572.750 peak=204 ppm1=7.505 ppm2=0.960

assign (( resid 12 and name HA
	 ))
       (( resid 12 and name HG2%
	 ) or ( resid 12 and name HG1%
	 )) 2.9 1.2 0.6 volume=783775.250 peak=205 ppm1=3.397 ppm2=0.963

assign (( resid 12 and name HA
	 ))
       (( resid 12 and name HB
	 )) 3.9 2.0 0.8 volume=133187.750 peak=206 ppm1=3.388 ppm2=2.070

assign (( resid 62 and name HN
	 ))
       (( resid 62 and name HA
	 )) 3.9 2.0 0.8 volume=141536.500 peak=207 ppm1=7.458 ppm2=5.019

assign (( resid 62 and name HN
	 ))
       (( resid 62 and name HB1
	 )) 3.8 1.9 0.8 volume=165445.000 peak=208 ppm1=7.457 ppm2=3.171

assign (( resid 62 and name HN
	 ))
       (( resid 62 and name HB2
	 )) 3.5 1.8 0.7 volume=253342.000 peak=209 ppm1=7.461 ppm2=2.784

assign (( resid 43 and name HN
	 ))
       (( resid 43 and name HA2
	 )) 3.0 1.3 0.6 volume=630815.000 peak=210 ppm1=8.446 ppm2=4.058

assign (( resid 43 and name HN
	 ))
       (( resid 43 and name HA1
	 )) 3.1 1.4 0.6 volume=535745.250 peak=211 ppm1=8.448 ppm2=4.082

assign (( resid 2 and name HN
	 ))
       (( resid 2 and name HA2
	 )) 3.6 1.8 0.7 volume=243923.750 peak=212 ppm1=8.419 ppm2=4.168

assign (( resid 2 and name HN
	 ))
       (( resid 2 and name HA1
	 )) 3.6 1.8 0.7 volume=220188.500 peak=213 ppm1=8.420 ppm2=4.195

assign (( resid 18 and name HN
	 ))
       (( resid 18 and name HA
	 )) 3.4 1.7 0.7 volume=337010.750 peak=214 ppm1=8.291 ppm2=3.739

assign (( resid 18 and name HN
	 ))
       (( resid 18 and name HB
	 )) 3.1 1.4 0.6 volume=582683.000 peak=215 ppm1=8.287 ppm2=2.055

assign (( resid 18 and name HN
	 ))
       (( resid 18 and name HG2%
	 )) 2.9 1.2 0.6 volume=776741.750 peak=216 ppm1=8.288 ppm2=1.104

assign (( resid 18 and name HN
	 ))
       (( resid 18 and name HG1%
	 )) 3.4 1.7 0.7 volume=321491.750 peak=217 ppm1=8.292 ppm2=0.918

assign (( resid 18 and name HA
	 ))
       (( resid 18 and name HG1%
	 )) 3.0 1.3 0.6 volume=659766.750 peak=218 ppm1=3.740 ppm2=0.919

assign (( resid 18 and name HA
	 ))
       (( resid 18 and name HG2%
	 )) 3.0 1.2 0.6 volume=749305.250 peak=219 ppm1=3.739 ppm2=1.105

assign (( resid 18 and name HA
	 ))
       (( resid 18 and name HB
	 )) 3.6 1.8 0.7 volume=242614.750 peak=220 ppm1=3.743 ppm2=2.061

assign (( resid 18 and name HG2%
	 ))
       (( resid 18 and name HG1%
	 )) 2.7 0.9 0.5 volume=1440908.750 peak=221 ppm1=1.105 ppm2=0.919

assign (( resid 18 and name HG2%
	 ))
       (( resid 18 and name HB
	 )) 3.0 1.2 0.6 volume=761056.500 peak=222 ppm1=1.104 ppm2=2.054

assign (( resid 18 and name HG1%
	 ))
       (( resid 18 and name HB
	 )) 2.8 1.0 0.6 volume=1129646.500 peak=223 ppm1=0.919 ppm2=2.055

assign (( resid 55 and name HN
	 ))
       (( resid 55 and name HA
	 )) 3.0 1.3 0.6 volume=642319.750 peak=224 ppm1=8.418 ppm2=4.017

assign (( resid 55 and name HN
	 ))
       (( resid 55 and name HD2%
	 )) 3.5 1.8 0.7 volume=271908.250 peak=225 ppm1=8.418 ppm2=0.852

assign (( resid 55 and name HN
	 ))
       (( resid 55 and name HD1%
	 )) 3.7 1.8 0.7 volume=205096.500 peak=226 ppm1=8.415 ppm2=0.936

assign (( resid 55 and name HN
	 ))
       (( resid 55 and name HB1
	 ) or ( resid 55 and name HG
	 )) 3.2 1.5 0.6 volume=443614.500 peak=227 ppm1=8.416 ppm2=1.614

assign (( resid 55 and name HN
	 ))
       (( resid 55 and name HB2
	 )) 2.8 1.1 0.6 volume=1060530.500 peak=228 ppm1=8.416 ppm2=1.738

assign (( resid 55 and name HA
	 ))
       (( resid 55 and name HD2%
	 )) 2.7 1.0 0.5 volume=1262680.750 peak=229 ppm1=4.017 ppm2=0.850

assign (( resid 55 and name HA
	 ))
       (( resid 55 and name HD1%
	 )) 3.5 1.8 0.7 volume=253484.000 peak=230 ppm1=4.016 ppm2=0.935

assign (( resid 55 and name HA
	 ))
       (( resid 55 and name HB1
	 ) or ( resid 55 and name HG
	 )) 3.1 1.4 0.6 volume=527995.500 peak=231 ppm1=4.013 ppm2=1.610

assign (( resid 55 and name HA
	 ))
       (( resid 55 and name HB2
	 )) 3.0 1.3 0.6 volume=724906.750 peak=232 ppm1=4.015 ppm2=1.736

assign (( resid 55 and name HB2
	 ))
       (( resid 55 and name HD2%
	 )) 3.1 1.4 0.6 volume=567362.750 peak=233 ppm1=1.724 ppm2=0.853

assign (( resid 55 and name HB2
	 ))
       (( resid 55 and name HD1%
	 )) 3.0 1.3 0.6 volume=672379.750 peak=234 ppm1=1.724 ppm2=0.937

assign (( resid 55 and name HB1
	 ) or (resid 55 and name HG
	 ))
       (( resid 55 and name HD1%
	 )) 3.1 1.4 0.6 volume=587111.750 peak=235 ppm1=1.612 ppm2=0.932

assign (( resid 55 and name HB1
	 ) or (resid 55 and name HG
	 ))
       (( resid 55 and name HD2%
	 )) 3.1 1.3 0.6 volume=619159.750 peak=236 ppm1=1.615 ppm2=0.855

assign (( resid 65 and name HN
	 ))
       (( resid 65 and name HA
	 )) 3.3 1.6 0.7 volume=408206.750 peak=237 ppm1=8.181 ppm2=4.232

assign (( resid 65 and name HN
	 ))
       (( resid 65 and name HB2
	 ) or ( resid 65 and name HB1
	 )) 2.7 1.0 0.5 volume=1313422.750 peak=238 ppm1=8.183 ppm2=1.553

assign (( resid 65 and name HN
	 ))
       (( resid 65 and name HG
	 )) 3.2 1.5 0.6 volume=446150.000 peak=239 ppm1=8.182 ppm2=1.594

assign (( resid 65 and name HN
	 ))
       (( resid 65 and name HD1%
	 )) 4.2 2.1 0.8 volume=98194.000 peak=240 ppm1=8.185 ppm2=0.875

assign (( resid 65 and name HN
	 ))
       (( resid 65 and name HD2%
	 )) 4.1 2.0 0.8 volume=109338.750 peak=241 ppm1=8.185 ppm2=0.914

assign (( resid 65 and name HA
	 ))
       (( resid 65 and name HD1%
	 )) 3.5 1.7 0.7 volume=284770.000 peak=242 ppm1=4.231 ppm2=0.875

assign (( resid 65 and name HA
	 ))
       (( resid 65 and name HD2%
	 )) 4.0 2.0 0.8 volume=131547.250 peak=243 ppm1=4.233 ppm2=0.912

assign (( resid 65 and name HA
	 ))
       (( resid 65 and name HB2
	 ) or ( resid 65 and name HB1
	 )) 3.3 1.6 0.7 volume=380140.500 peak=244 ppm1=4.234 ppm2=1.555

assign (( resid 65 and name HB2
	 ))
       (( resid 65 and name HD1%
	 )) 3.1 1.4 0.6 volume=555294.250 peak=245 ppm1=1.553 ppm2=0.877

assign (( resid 65 and name HB2
	 ))
       (( resid 65 and name HD2%
	 )) 2.9 1.2 0.6 volume=861429.000 peak=246 ppm1=1.553 ppm2=0.913

assign (( resid 65 and name HG
	 ))
       (( resid 65 and name HD2%
	 )) 3.4 1.6 0.7 volume=348332.000 peak=247 ppm1=1.596 ppm2=0.912

assign (( resid 65 and name HG
	 ))
       (( resid 65 and name HD1%
	 )) 3.5 1.7 0.7 volume=274329.000 peak=248 ppm1=1.596 ppm2=0.877

assign (( resid 65 and name HD2%
	 ))
       (( resid 65 and name HD1%
	 )) 1.7 0.0 0.3 volume=23592244.250 peak=249 ppm1=0.914 ppm2=0.877

assign (( resid 55 and name HD1%
	 ))
       (( resid 55 and name HD2%
	 )) 2.4 0.7 0.5 volume=2712420.250 peak=250 ppm1=0.937 ppm2=0.854

assign (( resid 44 and name HG2%
	 ))
       (( resid 44 and name HD1%
	 )) 2.9 1.2 0.6 volume=849734.000 peak=251 ppm1=0.771 ppm2=0.694

assign (( resid 58 and name HN
	 ))
       (( resid 58 and name HA
	 )) 3.3 1.6 0.7 volume=410260.500 peak=252 ppm1=7.793 ppm2=4.201

assign (( resid 58 and name HN
	 ))
       (( resid 58 and name HD1%
	 )) 3.6 1.8 0.7 volume=212356.750 peak=253 ppm1=7.796 ppm2=0.799

assign (( resid 58 and name HN
	 ))
       (( resid 58 and name HD2%
	 )) 3.6 1.8 0.7 volume=214702.500 peak=254 ppm1=7.793 ppm2=0.844

assign (( resid 58 and name HN
	 ))
       (( resid 58 and name HB2
	 )) 3.1 1.4 0.6 volume=514299.000 peak=255 ppm1=7.794 ppm2=1.788

assign (( resid 58 and name HN
	 ))
       (( resid 58 and name HB1
	 )) 2.9 1.2 0.6 volume=806334.250 peak=256 ppm1=7.792 ppm2=1.859

assign (( resid 58 and name HA
	 ))
       (( resid 58 and name HD1%
	 )) 3.0 1.3 0.6 volume=679492.750 peak=257 ppm1=4.200 ppm2=0.801

assign (( resid 58 and name HA
	 ))
       (( resid 58 and name HD2%
	 )) 3.8 1.9 0.8 volume=163631.500 peak=258 ppm1=4.204 ppm2=0.842

assign (( resid 58 and name HA
	 ))
       (( resid 58 and name HB2
	 )) 3.9 2.0 0.8 volume=140671.250 peak=259 ppm1=4.200 ppm2=1.784

assign (( resid 58 and name HA
	 ))
       (( resid 58 and name HB1
	 )) 3.7 1.9 0.7 volume=186025.750 peak=260 ppm1=4.199 ppm2=1.860

assign (( resid 58 and name HB1
	 ))
       (( resid 58 and name HD1%
	 )) 3.7 1.8 0.7 volume=209813.000 peak=261 ppm1=1.862 ppm2=0.801

assign (( resid 58 and name HB1
	 ))
       (( resid 58 and name HD2%
	 )) 3.3 1.6 0.7 volume=404863.750 peak=262 ppm1=1.860 ppm2=0.840

assign (( resid 58 and name HB2
	 ))
       (( resid 58 and name HD1%
	 )) 3.6 1.8 0.7 volume=248732.000 peak=263 ppm1=1.786 ppm2=0.803

assign (( resid 58 and name HB2
	 ))
       (( resid 58 and name HD2%
	 )) 3.4 1.7 0.7 volume=326435.000 peak=264 ppm1=1.789 ppm2=0.846

assign (( resid 15 and name HD2%
	 ))
       (( resid 15 and name HD1%
	 )) 2.8 1.1 0.6 volume=1051306.000 peak=265 ppm1=0.666 ppm2=0.456

assign (( resid 15 and name HG
	 ))
       (( resid 15 and name HD1%
	 )) 3.8 1.9 0.8 volume=174979.750 peak=266 ppm1=1.271 ppm2=0.456

assign (( resid 15 and name HB1
	 ) or (resid 15 and name HB2
	 ))
       (( resid 15 and name HD1%
	 )) 3.6 1.8 0.7 volume=223613.000 peak=267 ppm1=1.463 ppm2=0.457

assign (( resid 15 and name HB1
	 ) or (resid 15 and name HB2
	 ))
       (( resid 15 and name HD2%
	 )) 3.4 1.7 0.7 volume=302558.750 peak=268 ppm1=1.460 ppm2=0.666

assign (( resid 15 and name HG
	 ))
       (( resid 15 and name HD2%
	 )) 3.6 1.8 0.7 volume=232357.500 peak=269 ppm1=1.273 ppm2=0.670

assign (( resid 15 and name HA
	 ))
       (( resid 15 and name HD1%
	 )) 3.8 1.9 0.8 volume=159384.250 peak=270 ppm1=3.879 ppm2=0.457

assign (( resid 15 and name HA
	 ))
       (( resid 15 and name HD2%
	 )) 2.9 1.2 0.6 volume=828229.000 peak=271 ppm1=3.874 ppm2=0.666

assign (( resid 15 and name HA
	 ))
       (( resid 15 and name HG
	 )) 3.9 2.0 0.8 volume=134663.250 peak=272 ppm1=3.869 ppm2=1.272

assign (( resid 15 and name HA
	 ))
       (( resid 15 and name HB1
	 ) or ( resid 15 and name HB2
	 )) 3.9 1.9 0.8 volume=146740.000 peak=273 ppm1=3.878 ppm2=1.460

assign (( resid 69 and name HN
	 ))
       (( resid 69 and name HB2
	 )) 3.4 1.7 0.7 volume=307590.250 peak=274 ppm1=8.183 ppm2=1.852

assign (( resid 69 and name HN
	 ))
       (( resid 69 and name HB1
	 )) 3.9 2.0 0.8 volume=136676.500 peak=275 ppm1=8.179 ppm2=1.775

assign (( resid 69 and name HA
	 ))
       (( resid 69 and name HE2
	 ) or ( resid 69 and name HE1
	 )) 5.0 2.5 1.0 volume=32051.750 peak=276 ppm1=4.349 ppm2=3.006

assign (( resid 69 and name HE2
	 ) or (resid 69 and name HE1
	 ))
       (( resid 69 and name HD1
	 ) or ( resid 69 and name HD2
	 )) 2.8 1.1 0.6 volume=975287.000 peak=277 ppm1=3.006 ppm2=1.695

assign (( resid 66 and name HN
	 ))
       (( resid 66 and name HA
	 )) 3.2 1.5 0.6 volume=451123.000 peak=278 ppm1=8.238 ppm2=4.606

assign (( resid 66 and name HN
	 ))
       (( resid 66 and name HB1
	 ) or ( resid 66 and name HB2
	 )) 3.6 1.8 0.7 volume=234032.750 peak=279 ppm1=8.238 ppm2=1.793

assign (( resid 66 and name HN
	 ))
       (( resid 66 and name HD1
	 ) or ( resid 66 and name HD2
	 )) 3.2 1.5 0.6 volume=482675.750 peak=280 ppm1=8.238 ppm2=1.697

assign (( resid 66 and name HN
	 ))
       (( resid 66 and name HG1
	 )) 4.2 2.1 0.8 volume=89933.500 peak=281 ppm1=8.238 ppm2=1.447

assign (( resid 28 and name HN
	 ))
       (( resid 28 and name HA
	 )) 2.5 0.8 0.5 volume=2151467.000 peak=282 ppm1=8.108 ppm2=4.471

assign (( resid 28 and name HN
	 ))
       (( resid 28 and name HE2
	 ) or ( resid 28 and name HE1
	 )) 3.8 1.9 0.8 volume=178916.000 peak=283 ppm1=8.113 ppm2=2.935

assign (( resid 28 and name HE2
	 ) or (resid 28 and name HE1
	 ))
       (( resid 28 and name HG1
	 ) or ( resid 28 and name HG2
	 )) 3.8 1.9 0.8 volume=172616.750 peak=284 ppm1=2.940 ppm2=1.376

assign (( resid 28 and name HN
	 ))
       (( resid 28 and name HG1
	 ) or ( resid 28 and name HG2
	 )) 3.7 1.8 0.7 volume=196395.750 peak=285 ppm1=8.109 ppm2=1.379

assign (( resid 28 and name HN
	 ))
       (( resid 28 and name HB2
	 ) or ( resid 28 and name HB1
	 )) 3.5 1.8 0.7 volume=263658.500 peak=286 ppm1=8.110 ppm2=1.762

assign (( resid 63 and name HN
	 ))
       (( resid 63 and name HB%
	 )) 2.6 0.9 0.5 volume=1550250.750 peak=287 ppm1=8.236 ppm2=1.247

assign (( resid 63 and name HN
	 ))
       (( resid 63 and name HA
	 )) 3.1 1.4 0.6 volume=586690.750 peak=288 ppm1=8.238 ppm2=4.433

assign (( resid 63 and name HA
	 ))
       (( resid 63 and name HB%
	 )) 3.8 1.9 0.8 volume=165110.250 peak=289 ppm1=4.425 ppm2=1.247

assign (( resid 61 and name HB1
	 ))
       (( resid 61 and name HB2
	 )) 3.0 1.3 0.6 volume=666033.750 peak=290 ppm1=3.432 ppm2=2.869

assign (( resid 59 and name HN
	 ))
       (( resid 59 and name HB2
	 )) 3.2 1.5 0.6 volume=439310.000 peak=291 ppm1=8.047 ppm2=2.715

assign (( resid 59 and name HN
	 ))
       (( resid 59 and name HB1
	 )) 3.2 1.5 0.6 volume=453046.750 peak=292 ppm1=8.049 ppm2=2.847

assign (( resid 59 and name HN
	 ))
       (( resid 59 and name HA
	 )) 2.9 1.2 0.6 volume=804034.500 peak=293 ppm1=8.047 ppm2=4.555

assign (( resid 30 and name HN
	 ))
       (( resid 30 and name HB
	 )) 3.5 1.8 0.7 volume=253853.000 peak=294 ppm1=8.107 ppm2=4.194

assign (( resid 30 and name HN
	 ))
       (( resid 30 and name HA
	 )) 2.9 1.2 0.6 volume=884055.750 peak=295 ppm1=8.110 ppm2=4.312

assign (( resid 30 and name HN
	 ))
       (( resid 30 and name HG2%
	 )) 3.2 1.5 0.6 volume=429637.750 peak=296 ppm1=8.108 ppm2=1.193

assign (( resid 30 and name HA
	 ))
       (( resid 30 and name HG2%
	 )) 3.6 1.8 0.7 volume=223075.500 peak=297 ppm1=4.307 ppm2=1.193

assign (( resid 49 and name HN
	 ))
       (( resid 49 and name HA
	 )) 3.7 1.9 0.7 volume=186244.000 peak=298 ppm1=7.986 ppm2=4.556

assign (( resid 49 and name HN
	 ))
       (( resid 49 and name HB2
	 )) 3.7 1.8 0.7 volume=204967.000 peak=299 ppm1=7.983 ppm2=3.194

assign (( resid 49 and name HN
	 ))
       (( resid 49 and name HB1
	 )) 3.0 1.3 0.6 volume=678042.750 peak=300 ppm1=7.985 ppm2=2.768

assign (( resid 16 and name HE21
	 ))
       (( resid 16 and name HE22
	 )) 2.1 0.4 0.4 volume=6072447.500 peak=301 ppm1=7.260 ppm2=6.730

assign (( resid 16 and name HN
	 ))
       (( resid 16 and name HB1
	 )) 3.1 1.4 0.6 volume=519076.750 peak=302 ppm1=8.132 ppm2=2.186

assign (( resid 16 and name HN
	 ))
       (( resid 16 and name HB2
	 )) 3.2 1.5 0.6 volume=456723.250 peak=303 ppm1=8.132 ppm2=2.056

assign (( resid 16 and name HN
	 ))
       (( resid 16 and name HA
	 )) 2.7 1.0 0.5 volume=1300029.750 peak=304 ppm1=8.133 ppm2=4.120

assign (( resid 16 and name HN
	 ))
       (( resid 16 and name HG2
	 )) 3.8 1.9 0.8 volume=163870.750 peak=305 ppm1=8.130 ppm2=2.396

assign (( resid 16 and name HN
	 ))
       (( resid 16 and name HG1
	 )) 3.7 1.9 0.7 volume=187924.250 peak=306 ppm1=8.132 ppm2=2.466

assign (( resid 16 and name HA
	 ))
       (( resid 16 and name HG2
	 )) 3.6 1.8 0.7 volume=219487.250 peak=307 ppm1=4.124 ppm2=2.391

assign (( resid 16 and name HA
	 ))
       (( resid 16 and name HG1
	 )) 4.4 2.2 0.9 volume=69836.250 peak=308 ppm1=4.125 ppm2=2.477

assign (( resid 16 and name HA
	 ))
       (( resid 16 and name HB1
	 )) 3.2 1.5 0.6 volume=436834.000 peak=309 ppm1=4.128 ppm2=2.188

assign (( resid 16 and name HA
	 ))
       (( resid 16 and name HB2
	 )) 3.4 1.7 0.7 volume=332803.000 peak=310 ppm1=4.125 ppm2=2.058

assign (( resid 11 and name HA
	 ))
       (( resid 11 and name HD1%
	 ) or ( resid 11 and name HD2%
	 )) 2.9 1.1 0.6 volume=929704.750 peak=311 ppm1=4.022 ppm2=0.746

assign (( resid 11 and name HB1
	 ))
       (( resid 11 and name HD1%
	 ) or ( resid 11 and name HD2%
	 )) 3.1 1.4 0.6 volume=576855.000 peak=312 ppm1=1.740 ppm2=0.749

assign (( resid 11 and name HG
	 ))
       (( resid 11 and name HD1%
	 ) or ( resid 11 and name HD2%
	 )) 2.8 1.0 0.6 volume=1130377.250 peak=313 ppm1=1.379 ppm2=0.747

assign (( resid 11 and name HB2
	 ))
       (( resid 11 and name HD1%
	 ) or ( resid 11 and name HD2%
	 )) 3.1 1.3 0.6 volume=619814.250 peak=314 ppm1=1.311 ppm2=0.748

assign (( resid 11 and name HN
	 ))
       (( resid 11 and name HB1
	 )) 3.9 2.0 0.8 volume=133532.500 peak=315 ppm1=7.396 ppm2=1.739

assign (( resid 11 and name HN
	 ))
       (( resid 11 and name HB2
	 )) 4.0 2.0 0.8 volume=125904.750 peak=316 ppm1=7.398 ppm2=1.311

assign (( resid 11 and name HN
	 ))
       (( resid 11 and name HD1%
	 ) or ( resid 11 and name HD2%
	 )) 4.1 2.0 0.8 volume=110575.500 peak=317 ppm1=7.395 ppm2=0.746

assign (( resid 11 and name HN
	 ))
       (( resid 11 and name HA
	 )) 3.9 2.0 0.8 volume=138769.750 peak=318 ppm1=7.384 ppm2=4.029

assign (( resid 11 and name HA
	 ))
       (( resid 11 and name HG
	 )) 3.9 1.9 0.8 volume=144719.500 peak=319 ppm1=4.026 ppm2=1.376

assign (( resid 11 and name HA
	 ))
       (( resid 11 and name HB2
	 )) 3.4 1.7 0.7 volume=317508.500 peak=320 ppm1=4.031 ppm2=1.317

assign (( resid 6 and name HN
	 ))
       (( resid 6 and name HA
	 )) 3.1 1.4 0.6 volume=547588.000 peak=321 ppm1=8.240 ppm2=4.439

assign (( resid 6 and name HN
	 ))
       (( resid 6 and name HB1
	 )) 3.3 1.6 0.7 volume=408316.500 peak=322 ppm1=8.241 ppm2=1.594

assign (( resid 6 and name HN
	 ))
       (( resid 6 and name HG
	 )) 3.6 1.8 0.7 volume=221183.500 peak=323 ppm1=8.244 ppm2=1.479

assign (( resid 6 and name HN
	 ))
       (( resid 6 and name HB2
	 )) 4.1 2.0 0.8 volume=107558.250 peak=324 ppm1=8.241 ppm2=1.285

assign (( resid 6 and name HA
	 ))
       (( resid 6 and name HB1
	 )) 4.3 2.1 0.9 volume=81873.500 peak=325 ppm1=4.441 ppm2=1.595

assign (( resid 6 and name HB2
	 ))
       (( resid 6 and name HD2%
	 )) 3.8 1.9 0.8 volume=180206.000 peak=326 ppm1=1.289 ppm2=0.809

assign (( resid 6 and name HB2
	 ))
       (( resid 6 and name HD1%
	 )) 4.0 2.0 0.8 volume=122673.500 peak=327 ppm1=1.287 ppm2=0.838

assign (( resid 6 and name HB1
	 ))
       (( resid 6 and name HD2%
	 )) 3.4 1.6 0.7 volume=348002.500 peak=328 ppm1=1.586 ppm2=0.806

assign (( resid 6 and name HB1
	 ))
       (( resid 6 and name HD1%
	 )) 3.0 1.3 0.6 volume=715707.000 peak=329 ppm1=1.587 ppm2=0.835

assign (( resid 6 and name HG
	 ))
       (( resid 6 and name HD2%
	 )) 3.1 1.4 0.6 volume=547147.250 peak=330 ppm1=1.491 ppm2=0.811

assign (( resid 6 and name HG
	 ))
       (( resid 6 and name HD1%
	 )) 3.1 1.4 0.6 volume=583013.750 peak=331 ppm1=1.492 ppm2=0.836

assign (( resid 6 and name HN
	 ))
       (( resid 6 and name HD2%
	 )) 4.1 2.0 0.8 volume=110591.250 peak=332 ppm1=8.244 ppm2=0.807

assign (( resid 6 and name HN
	 ))
       (( resid 6 and name HD1%
	 )) 4.2 2.1 0.8 volume=96914.000 peak=333 ppm1=8.241 ppm2=0.833

assign (( resid 14 and name HN
	 ))
       (( resid 13 and name HA
	 )) 3.6 1.8 0.7 volume=228157.500 peak=334 ppm1=7.755 ppm2=4.408

assign (( resid 53 and name HN
	 ))
       (( resid 52 and name HA
	 )) 3.0 1.3 0.6 volume=696674.250 peak=335 ppm1=8.827 ppm2=4.474

assign (( resid 21 and name HN
	 ))
       (( resid 20 and name HA1
	 )) 3.1 1.4 0.6 volume=569098.750 peak=336 ppm1=8.684 ppm2=3.977

assign (( resid 8 and name HN
	 ))
       (( resid 7 and name HA
	 )) 3.6 1.8 0.7 volume=220485.750 peak=337 ppm1=8.649 ppm2=4.681

assign (( resid 19 and name HN
	 ))
       (( resid 18 and name HA
	 )) 3.6 1.8 0.7 volume=227054.500 peak=338 ppm1=8.542 ppm2=3.740

assign (( resid 4 and name HN
	 ))
       (( resid 3 and name HA
	 )) 2.7 1.0 0.5 volume=1281923.500 peak=339 ppm1=8.572 ppm2=4.418

assign (( resid 43 and name HN
	 ))
       (( resid 42 and name HA
	 )) 2.9 1.2 0.6 volume=856462.250 peak=340 ppm1=8.446 ppm2=4.345

assign (( resid 41 and name HN
	 ))
       (( resid 40 and name HA
	 )) 2.5 0.8 0.5 volume=1870128.000 peak=341 ppm1=8.421 ppm2=4.411

assign (( resid 43 and name HN
	 ))
       (( resid 42 and name HB
	 )) 3.4 1.7 0.7 volume=305642.500 peak=342 ppm1=8.446 ppm2=4.245

assign (( resid 2 and name HN
	 ))
       (( resid 1 and name HA2
	 ) or ( resid 1 and name HA1
	 )) 3.4 1.7 0.7 volume=306110.750 peak=343 ppm1=8.420 ppm2=3.898

assign (( resid 9 and name HN
	 ))
       (( resid 8 and name HA1
	 )) 3.3 1.6 0.7 volume=361507.000 peak=344 ppm1=8.567 ppm2=3.933

assign (( resid 9 and name HN
	 ))
       (( resid 8 and name HA2
	 )) 3.6 1.8 0.7 volume=248404.250 peak=345 ppm1=8.568 ppm2=3.797

assign (( resid 19 and name HN
	 ))
       (( resid 15 and name HA
	 )) 3.9 2.0 0.8 volume=136197.750 peak=346 ppm1=8.542 ppm2=3.868

assign (( resid 54 and name HN
	 ))
       (( resid 53 and name HA
	 )) 2.8 1.1 0.6 volume=1022435.750 peak=347 ppm1=8.280 ppm2=4.842

assign (( resid 20 and name HN
	 ))
       (( resid 19 and name HA
	 )) 3.7 1.8 0.7 volume=202966.500 peak=348 ppm1=7.811 ppm2=4.788

assign (( resid 57 and name HN
	 ))
       (( resid 56 and name HA
	 )) 3.2 1.5 0.6 volume=481750.000 peak=349 ppm1=7.811 ppm2=4.120

assign (( resid 60 and name HN
	 ))
       (( resid 59 and name HA
	 )) 3.3 1.6 0.7 volume=357720.750 peak=350 ppm1=7.667 ppm2=4.558

assign (( resid 25 and name HN
	 ))
       (( resid 24 and name HA
	 )) 3.2 1.5 0.6 volume=428938.750 peak=351 ppm1=8.441 ppm2=5.004

assign (( resid 63 and name HN
	 ))
       (( resid 24 and name HA
	 ) or ( resid 62 and name HA
	 )) 2.7 1.0 0.5 volume=1358936.500 peak=352 ppm1=8.236 ppm2=5.019

assign (( resid 32 and name HN
	 ))
       (( resid 31 and name HA1
	 )) 3.2 1.5 0.6 volume=469491.750 peak=353 ppm1=8.066 ppm2=3.892

assign (( resid 32 and name HN
	 ))
       (( resid 31 and name HA2
	 )) 3.1 1.4 0.6 volume=554477.500 peak=354 ppm1=8.068 ppm2=3.949

assign (( resid 24 and name HN
	 ))
       (( resid 23 and name HA2
	 )) 3.2 1.5 0.6 volume=454187.500 peak=355 ppm1=7.583 ppm2=3.773

assign (( resid 24 and name HN
	 ))
       (( resid 23 and name HA1
	 )) 3.2 1.4 0.6 volume=506535.500 peak=356 ppm1=7.584 ppm2=3.979

assign (( resid 17 and name HN
	 ))
       (( resid 16 and name HA
	 )) 3.5 1.7 0.7 volume=278676.500 peak=357 ppm1=7.696 ppm2=4.118

assign (( resid 5 and name HN
	 ))
       (( resid 4 and name HA
	 )) 2.7 1.0 0.5 volume=1224935.750 peak=358 ppm1=7.996 ppm2=4.471

assign (( resid 36 and name HN
	 ))
       (( resid 35 and name HA
	 )) 3.0 1.3 0.6 volume=706550.750 peak=359 ppm1=8.162 ppm2=4.494

assign (( resid 35 and name HN
	 ))
       (( resid 34 and name HA
	 )) 2.9 1.1 0.6 volume=906184.750 peak=360 ppm1=8.344 ppm2=4.469

assign (( resid 37 and name HN
	 ))
       (( resid 36 and name HA
	 )) 2.8 1.1 0.6 volume=960404.750 peak=361 ppm1=8.133 ppm2=4.436

assign (( resid 31 and name HN
	 ))
       (( resid 30 and name HA
	 )) 2.8 1.1 0.6 volume=985741.000 peak=362 ppm1=8.233 ppm2=4.311

assign (( resid 33 and name HN
	 ))
       (( resid 32 and name HA
	 )) 2.9 1.2 0.6 volume=807488.750 peak=363 ppm1=8.338 ppm2=4.555

assign (( resid 33 and name HN
	 ))
       (( resid 32 and name HB2
	 )) 3.9 1.9 0.8 volume=146755.750 peak=364 ppm1=8.335 ppm2=3.055

assign (( resid 33 and name HN
	 ))
       (( resid 32 and name HB1
	 )) 4.1 2.1 0.8 volume=99607.000 peak=365 ppm1=8.340 ppm2=2.944

assign (( resid 8 and name HN
	 ))
       (( resid 7 and name HB2
	 )) 4.2 2.1 0.8 volume=86720.000 peak=366 ppm1=8.650 ppm2=2.943

assign (( resid 8 and name HN
	 ))
       (( resid 7 and name HB1
	 )) 4.0 2.0 0.8 volume=117861.250 peak=367 ppm1=8.641 ppm2=3.090

assign (( resid 21 and name HN
	 ))
       (( resid 22 and name HN
	 )) 3.5 1.8 0.7 volume=268877.000 peak=368 ppm1=8.682 ppm2=8.070

assign (( resid 21 and name HN
	 ))
       (( resid 20 and name HN
	 )) 4.2 2.1 0.8 volume=92708.250 peak=369 ppm1=8.681 ppm2=7.810

assign (( resid 19 and name HN
	 ))
       (( resid 18 and name HN
	 )) 3.2 1.4 0.6 volume=495496.500 peak=370 ppm1=8.544 ppm2=8.287

assign (( resid 9 and name HN
	 ))
       (( resid 10 and name HN
	 )) 3.6 1.8 0.7 volume=223247.250 peak=371 ppm1=8.564 ppm2=8.087

assign (( resid 19 and name HN
	 ))
       (( resid 18 and name HB
	 )) 3.3 1.6 0.7 volume=402741.000 peak=372 ppm1=8.543 ppm2=2.054

assign (( resid 19 and name HN
	 ))
       (( resid 18 and name HG2%
	 )) 3.5 1.7 0.7 volume=294679.250 peak=373 ppm1=8.543 ppm2=1.106

assign (( resid 19 and name HN
	 ))
       (( resid 18 and name HG1%
	 )) 3.5 1.7 0.7 volume=283593.250 peak=374 ppm1=8.542 ppm2=0.919

assign (( resid 19 and name HN
	 ))
       (( resid 16 and name HA
	 )) 4.0 2.0 0.8 volume=130640.750 peak=375 ppm1=8.545 ppm2=4.116

assign (( resid 19 and name HN
	 ))
       (( resid 20 and name HN
	 )) 3.2 1.4 0.6 volume=499108.750 peak=376 ppm1=8.542 ppm2=7.813

assign (( resid 4 and name HN
	 ))
       (( resid 5 and name HN
	 )) 3.4 1.7 0.7 volume=313875.750 peak=377 ppm1=8.572 ppm2=7.996

assign (( resid 43 and name HN
	 ))
       (( resid 44 and name HN
	 )) 3.6 1.8 0.7 volume=248972.750 peak=378 ppm1=8.442 ppm2=7.856

assign (( resid 55 and name HN
	 ))
       (( resid 56 and name HN
	 )) 3.1 1.4 0.6 volume=568024.500 peak=379 ppm1=8.416 ppm2=8.133

assign (( resid 35 and name HN
	 ))
       (( resid 36 and name HN
	 )) 3.4 1.6 0.7 volume=353868.750 peak=380 ppm1=8.345 ppm2=8.163

assign (( resid 33 and name HN
	 ))
       (( resid 32 and name HN
	 )) 3.8 1.9 0.8 volume=163459.500 peak=381 ppm1=8.340 ppm2=8.065

assign (( resid 31 and name HN
	 ))
       (( resid 32 and name HN
	 )) 3.9 2.0 0.8 volume=137049.250 peak=382 ppm1=8.232 ppm2=8.067

assign (( resid 41 and name HN
	 ))
       (( resid 42 and name HN
	 )) 3.2 1.5 0.6 volume=440646.750 peak=383 ppm1=8.427 ppm2=8.028

assign (( resid 16 and name HN
	 ))
       (( resid 17 and name HN
	 )) 3.1 1.4 0.6 volume=517304.500 peak=384 ppm1=8.133 ppm2=7.693

assign (( resid 18 and name HN
	 ))
       (( resid 17 and name HN
	 )) 3.2 1.5 0.6 volume=440994.750 peak=385 ppm1=8.290 ppm2=7.694

assign (( resid 48 and name HN
	 ))
       (( resid 50 and name HN
	 )) 4.0 2.0 0.8 volume=126266.750 peak=386 ppm1=8.227 ppm2=7.851

assign (( resid 56 and name HN
	 ))
       (( resid 57 and name HN
	 )) 2.8 1.1 0.6 volume=941100.250 peak=387 ppm1=8.134 ppm2=7.811

assign (( resid 55 and name HN
	 ))
       (( resid 54 and name HA
	 )) 2.6 0.9 0.5 volume=1508285.000 peak=388 ppm1=8.416 ppm2=4.683

assign (( resid 62 and name HN
	 ))
       (( resid 61 and name HA
	 )) 3.6 1.8 0.7 volume=250128.000 peak=389 ppm1=7.457 ppm2=4.561

assign (( resid 49 and name HN
	 ))
       (( resid 48 and name HA
	 )) 3.7 1.9 0.7 volume=195429.500 peak=390 ppm1=7.987 ppm2=4.804

assign (( resid 68 and name HN
	 ))
       (( resid 67 and name HA
	 )) 2.5 0.8 0.5 volume=1872379.750 peak=391 ppm1=8.308 ppm2=4.381

assign (( resid 31 and name HN
	 ))
       (( resid 32 and name HA
	 )) 3.7 1.8 0.7 volume=195851.000 peak=392 ppm1=8.237 ppm2=4.553

assign (( resid 25 and name HN
	 ))
       (( resid 25 and name HB1
	 )) 3.9 2.0 0.8 volume=141236.750 peak=393 ppm1=8.443 ppm2=3.056

assign (( resid 25 and name HN
	 ))
       (( resid 25 and name HB2
	 )) 3.8 1.9 0.8 volume=163017.000 peak=394 ppm1=8.440 ppm2=2.906

assign (( resid 25 and name HN
	 ))
       (( resid 24 and name HB1
	 )) 3.6 1.8 0.7 volume=250368.000 peak=395 ppm1=8.443 ppm2=2.865

assign (( resid 25 and name HN
	 ))
       (( resid 24 and name HB2
	 )) 4.0 2.0 0.8 volume=128580.750 peak=396 ppm1=8.438 ppm2=3.137

assign (( resid 43 and name HN
	 ))
       (( resid 42 and name HG2%
	 )) 3.8 1.9 0.8 volume=178062.500 peak=397 ppm1=8.444 ppm2=1.211

assign (( resid 41 and name HN
	 ))
       (( resid 40 and name HG1
	 ) or ( resid 40 and name HG2
	 ) or ( resid 40 and name HB2
	 )) 3.6 1.8 0.7 volume=223428.250 peak=398 ppm1=8.417 ppm2=1.888

assign (( resid 6 and name HN
	 ))
       (( resid 5 and name HG2%
	 )) 3.7 1.9 0.7 volume=190091.750 peak=399 ppm1=8.242 ppm2=1.111

assign (( resid 55 and name HN
	 ))
       (( resid 54 and name HB2
	 )) 3.5 1.7 0.7 volume=287275.500 peak=400 ppm1=8.415 ppm2=2.753

assign (( resid 55 and name HN
	 ))
       (( resid 54 and name HB1
	 )) 3.7 1.9 0.7 volume=185610.250 peak=401 ppm1=8.418 ppm2=2.812

assign (( resid 68 and name HN
	 ))
       (( resid 67 and name HB2
	 ) or ( resid 67 and name HG2
	 ) or ( resid 67 and name HG1
	 )) 3.9 2.0 0.8 volume=132661.000 peak=402 ppm1=8.305 ppm2=1.900

assign (( resid 68 and name HN
	 ))
       (( resid 67 and name HB1
	 )) 4.4 2.2 0.9 volume=71657.750 peak=403 ppm1=8.306 ppm2=2.275

assign (( resid 46 and name HN
	 ))
       (( resid 45 and name HG2%
	 )) 3.6 1.8 0.7 volume=218307.250 peak=404 ppm1=7.974 ppm2=0.862

assign (( resid 46 and name HN
	 ))
       (( resid 45 and name HG1%
	 )) 3.5 1.8 0.7 volume=270220.750 peak=405 ppm1=7.978 ppm2=0.785

assign (( resid 20 and name HN
	 ) or (resid 58 and name HN
	 ))
       (( resid 18 and name HG1%
	 )) 3.9 2.0 0.8 volume=133915.000 peak=406 ppm1=7.808 ppm2=0.920

assign (( resid 13 and name HN
	 ))
       (( resid 12 and name HG2%
	 ) or ( resid 12 and name HG1%
	 )) 3.1 1.3 0.6 volume=608358.250 peak=407 ppm1=8.092 ppm2=0.963

assign (( resid 48 and name HN
	 ))
       (( resid 47 and name HA
	 )) 3.3 1.6 0.7 volume=356014.250 peak=408 ppm1=8.221 ppm2=4.161

assign (( resid 66 and name HN
	 ))
       (( resid 65 and name HA
	 )) 2.5 0.8 0.5 volume=2194166.750 peak=409 ppm1=8.239 ppm2=4.233

assign (( resid 70 and name HN
	 ))
       (( resid 69 and name HA
	 )) 3.6 1.8 0.7 volume=219947.250 peak=410 ppm1=8.263 ppm2=4.348

assign (( resid 48 and name HN
	 ))
       (( resid 47 and name HB2
	 ) or ( resid 47 and name HB1
	 )) 3.2 1.5 0.6 volume=428974.000 peak=411 ppm1=8.223 ppm2=2.084

assign (( resid 48 and name HN
	 ))
       (( resid 47 and name HG1
	 ) or ( resid 47 and name HG2
	 )) 4.0 2.0 0.8 volume=123081.500 peak=412 ppm1=8.226 ppm2=2.445

assign (( resid 63 and name HN
	 ))
       (( resid 62 and name HB2
	 )) 3.5 1.8 0.7 volume=269935.500 peak=413 ppm1=8.234 ppm2=2.789

assign (( resid 41 and name HN
	 ))
       (( resid 39 and name HB%
	 )) 4.0 2.0 0.8 volume=120077.250 peak=414 ppm1=8.423 ppm2=1.343

assign (( resid 41 and name HN
	 ))
       (( resid 40 and name HB1
	 )) 4.0 2.0 0.8 volume=115136.250 peak=415 ppm1=8.422 ppm2=2.251

assign (( resid 18 and name HN
	 ))
       (( resid 17 and name HA
	 )) 3.7 1.8 0.7 volume=209926.000 peak=416 ppm1=8.286 ppm2=4.442

assign (( resid 6 and name HN
	 ))
       (( resid 5 and name HA
	 )) 2.8 1.1 0.6 volume=954784.250 peak=417 ppm1=8.243 ppm2=4.502

assign (( resid 18 and name HN
	 ))
       (( resid 17 and name HB2
	 ) or ( resid 17 and name HB1
	 )) 3.1 1.4 0.6 volume=531208.000 peak=418 ppm1=8.286 ppm2=3.236

assign (( resid 54 and name HN
	 ))
       (( resid 53 and name HB2
	 )) 3.5 1.7 0.7 volume=281186.250 peak=419 ppm1=8.280 ppm2=3.167

assign (( resid 63 and name HN
	 ))
       (( resid 62 and name HB1
	 )) 3.3 1.5 0.7 volume=425516.500 peak=420 ppm1=8.235 ppm2=3.175

assign (( resid 63 and name HN
	 ))
       (( resid 64 and name HD2
	 )) 4.0 2.0 0.8 volume=131446.000 peak=421 ppm1=8.239 ppm2=3.629

assign (( resid 63 and name HN
	 ))
       (( resid 64 and name HD1
	 )) 4.0 2.0 0.8 volume=124452.500 peak=422 ppm1=8.237 ppm2=3.759

assign (( resid 69 and name HN
	 ))
       (( resid 68 and name HA
	 )) 2.9 1.2 0.6 volume=810355.000 peak=423 ppm1=8.180 ppm2=4.294

assign (( resid 65 and name HN
	 ))
       (( resid 64 and name HA
	 )) 2.5 0.7 0.5 volume=2260760.000 peak=424 ppm1=8.184 ppm2=4.401

assign (( resid 27 and name HN
	 ))
       (( resid 26 and name HA
	 )) 3.0 1.3 0.6 volume=688916.250 peak=425 ppm1=8.120 ppm2=4.673

assign (( resid 10 and name HN
	 ))
       (( resid 9 and name HA
	 )) 3.3 1.6 0.7 volume=367502.000 peak=426 ppm1=8.088 ppm2=4.090

assign (( resid 42 and name HN
	 ))
       (( resid 41 and name HA
	 )) 2.6 0.9 0.5 volume=1494695.750 peak=427 ppm1=8.029 ppm2=4.371

assign (( resid 42 and name HN
	 ))
       (( resid 41 and name HG2
	 ) or ( resid 41 and name HG1
	 )) 4.0 2.0 0.8 volume=131792.250 peak=428 ppm1=8.030 ppm2=2.369

assign (( resid 42 and name HN
	 ))
       (( resid 41 and name HB1
	 )) 3.8 1.9 0.8 volume=176717.250 peak=429 ppm1=8.030 ppm2=2.133

assign (( resid 61 and name HN
	 ))
       (( resid 60 and name HA
	 )) 3.4 1.7 0.7 volume=319879.750 peak=430 ppm1=7.932 ppm2=4.240

assign (( resid 61 and name HN
	 ))
       (( resid 58 and name HA
	 )) 3.6 1.8 0.7 volume=224757.250 peak=431 ppm1=7.948 ppm2=4.204

assign (( resid 46 and name HN
	 ) or (resid 49 and name HN
	 ))
       (( resid 44 and name HA
	 )) 3.9 2.0 0.8 volume=132839.500 peak=432 ppm1=7.978 ppm2=3.995

assign (( resid 46 and name HN
	 ) or (resid 49 and name HN
	 ))
       (( resid 45 and name HA
	 )) 3.4 1.7 0.7 volume=322668.750 peak=433 ppm1=7.974 ppm2=3.730

assign (( resid 50 and name HN
	 ))
       (( resid 49 and name HA
	 )) 3.7 1.9 0.7 volume=189474.250 peak=434 ppm1=7.840 ppm2=4.546

assign (( resid 49 and name HN
	 ))
       (( resid 50 and name HN
	 )) 3.3 1.6 0.7 volume=365506.250 peak=435 ppm1=7.989 ppm2=7.842

assign (( resid 46 and name HN
	 ))
       (( resid 45 and name HN
	 )) 3.8 1.9 0.8 volume=155240.500 peak=436 ppm1=7.976 ppm2=7.890

assign (( resid 59 and name HN
	 ))
       (( resid 58 and name HN
	 )) 3.1 1.3 0.6 volume=603515.500 peak=437 ppm1=8.047 ppm2=7.794

assign (( resid 59 and name HN
	 ))
       (( resid 60 and name HN
	 )) 3.1 1.4 0.6 volume=552730.250 peak=438 ppm1=8.046 ppm2=7.666

assign (( resid 15 and name HN
	 ))
       (( resid 14 and name HN
	 )) 2.9 1.1 0.6 volume=900587.250 peak=439 ppm1=8.099 ppm2=7.755

assign (( resid 61 and name HN
	 ))
       (( resid 60 and name HN
	 )) 3.0 1.3 0.6 volume=630605.750 peak=440 ppm1=7.932 ppm2=7.666

assign (( resid 22 and name HN
	 ))
       (( resid 23 and name HN
	 )) 3.3 1.5 0.7 volume=421975.000 peak=441 ppm1=8.072 ppm2=7.545

assign (( resid 10 and name HN
	 ))
       (( resid 11 and name HN
	 )) 3.4 1.7 0.7 volume=327358.750 peak=442 ppm1=8.087 ppm2=7.394

assign (( resid 13 and name HN
	 ))
       (( resid 12 and name HN
	 )) 3.1 1.4 0.6 volume=518929.000 peak=443 ppm1=8.090 ppm2=7.504

assign (( resid 61 and name HN
	 ))
       (( resid 62 and name HN
	 )) 3.1 1.4 0.6 volume=535325.000 peak=444 ppm1=7.932 ppm2=7.458

assign (( resid 61 and name HN
	 ))
       (( resid 61 and name HD%
	 )) 3.1 1.4 0.6 volume=548743.250 peak=445 ppm1=7.932 ppm2=7.263

assign (( resid 32 and name HN
	 ))
       (( resid 32 and name HD%
	 )) 3.6 1.8 0.7 volume=240654.000 peak=446 ppm1=8.066 ppm2=7.097

assign (( resid 27 and name HN
	 ))
       (( resid 26 and name HD%
	 ) or ( resid 26 and name HZ
	 )) 3.7 1.8 0.7 volume=200245.000 peak=447 ppm1=8.119 ppm2=7.144

assign (( resid 26 and name HN
	 ))
       (( resid 26 and name HD%
	 ) or ( resid 26 and name HZ
	 )) 3.9 2.0 0.8 volume=142321.000 peak=448 ppm1=8.189 ppm2=7.145

assign (( resid 25 and name HN
	 ))
       (( resid 25 and name HD%
	 )) 4.1 2.1 0.8 volume=99891.000 peak=449 ppm1=8.439 ppm2=7.052

assign (( resid 25 and name HD%
	 ))
       (( resid 25 and name HB2
	 )) 3.1 1.4 0.6 volume=592931.500 peak=450 ppm1=7.054 ppm2=2.905

assign (( resid 25 and name HD%
	 ))
       (( resid 25 and name HB1
	 )) 3.2 1.4 0.6 volume=502489.250 peak=451 ppm1=7.053 ppm2=3.049

assign (( resid 25 and name HE%
	 ))
       (( resid 25 and name HB1
	 )) 4.1 2.0 0.8 volume=106477.250 peak=452 ppm1=6.795 ppm2=3.048

assign (( resid 25 and name HE%
	 ))
       (( resid 25 and name HB2
	 )) 4.0 2.0 0.8 volume=122215.250 peak=453 ppm1=6.793 ppm2=2.914

assign (( resid 25 and name HD%
	 ))
       (( resid 25 and name HE%
	 )) 2.2 0.5 0.4 volume=4540197.250 peak=454 ppm1=7.048 ppm2=6.791

assign (( resid 50 and name HN
	 ))
       (( resid 50 and name HD%
	 )) 3.9 2.0 0.8 volume=134635.250 peak=455 ppm1=7.837 ppm2=7.267

assign (( resid 60 and name HN
	 ))
       (( resid 61 and name HD%
	 )) 4.1 2.0 0.8 volume=107258.000 peak=456 ppm1=7.672 ppm2=7.268

assign (( resid 17 and name HN
	 ))
       (( resid 16 and name HB2
	 ) or ( resid 18 and name HB
	 )) 3.5 1.8 0.7 volume=252117.000 peak=457 ppm1=7.693 ppm2=2.054

assign (( resid 17 and name HN
	 ))
       (( resid 16 and name HB1
	 )) 3.6 1.8 0.7 volume=216835.000 peak=458 ppm1=7.694 ppm2=2.186

assign (( resid 13 and name HN
	 ))
       (( resid 12 and name HB
	 )) 3.1 1.4 0.6 volume=550369.000 peak=459 ppm1=8.092 ppm2=2.074

assign (( resid 13 and name HN
	 ) or (resid 15 and name HN
	 ))
       (( resid 12 and name HA
	 )) 3.5 1.8 0.7 volume=251352.500 peak=460 ppm1=8.099 ppm2=3.398

assign (( resid 15 and name HN
	 ))
       (( resid 11 and name HD1%
	 )) 3.5 1.7 0.7 volume=295349.500 peak=461 ppm1=8.107 ppm2=0.742

assign (( resid 12 and name HN
	 ))
       (( resid 11 and name HD1%
	 )) 4.1 2.0 0.8 volume=110197.750 peak=462 ppm1=7.501 ppm2=0.742

assign (( resid 14 and name HN
	 ))
       (( resid 11 and name HD1%
	 )) 4.2 2.1 0.8 volume=93593.000 peak=463 ppm1=7.760 ppm2=0.741

assign (( resid 61 and name HE%
	 ))
       (( resid 44 and name HD1%
	 )) 3.9 1.9 0.8 volume=143234.000 peak=464 ppm1=6.776 ppm2=0.702

assign (( resid 24 and name HD%
	 ))
       (( resid 15 and name HD2%
	 )) 3.7 1.9 0.7 volume=183793.750 peak=465 ppm1=6.855 ppm2=0.665

assign (( resid 25 and name HE%
	 ) or (resid 61 and name HE%
	 ))
       (( resid 15 and name HD2%
	 )) 4.1 2.1 0.8 volume=104197.750 peak=466 ppm1=6.780 ppm2=0.670

assign (( resid 51 and name HN
	 ))
       (( resid 50 and name HB2
	 )) 4.1 2.0 0.8 volume=112446.250 peak=467 ppm1=7.777 ppm2=3.065

assign (( resid 51 and name HN
	 ))
       (( resid 50 and name HB1
	 )) 4.1 2.1 0.8 volume=104662.250 peak=468 ppm1=7.777 ppm2=3.355

assign (( resid 14 and name HN
	 ))
       (( resid 13 and name HB1
	 ) or ( resid 13 and name HB2
	 )) 3.2 1.4 0.6 volume=498439.250 peak=469 ppm1=7.756 ppm2=2.834

assign (( resid 14 and name HN
	 ))
       (( resid 11 and name HA
	 )) 3.9 2.0 0.8 volume=141951.500 peak=470 ppm1=7.757 ppm2=4.027

assign (( resid 14 and name HN
	 ))
       (( resid 12 and name HG2%
	 ) or ( resid 12 and name HG1%
	 )) 4.2 2.1 0.8 volume=91699.500 peak=471 ppm1=7.754 ppm2=0.964

assign (( resid 17 and name HN
	 ))
       (( resid 14 and name HA
	 )) 3.7 1.9 0.7 volume=193889.000 peak=472 ppm1=7.695 ppm2=4.220

assign (( resid 17 and name HN
	 ))
       (( resid 15 and name HA
	 )) 4.2 2.1 0.8 volume=89633.500 peak=473 ppm1=7.692 ppm2=3.872

assign (( resid 17 and name HN
	 ))
       (( resid 14 and name HB%
	 )) 4.4 2.2 0.9 volume=72617.000 peak=474 ppm1=7.692 ppm2=1.439

assign (( resid 17 and name HN
	 ))
       (( resid 18 and name HG2%
	 )) 4.1 2.0 0.8 volume=107145.500 peak=475 ppm1=7.700 ppm2=1.107

assign (( resid 60 and name HN
	 ))
       (( resid 58 and name HA
	 )) 4.0 2.0 0.8 volume=130072.500 peak=476 ppm1=7.667 ppm2=4.200

assign (( resid 60 and name HN
	 ))
       (( resid 59 and name HB2
	 )) 3.9 2.0 0.8 volume=140965.000 peak=477 ppm1=7.667 ppm2=2.714

assign (( resid 60 and name HN
	 ))
       (( resid 59 and name HB1
	 )) 3.9 1.9 0.8 volume=143959.000 peak=478 ppm1=7.668 ppm2=2.848

assign (( resid 60 and name HN
	 ))
       (( resid 57 and name HA
	 )) 4.1 2.0 0.8 volume=113575.000 peak=479 ppm1=7.664 ppm2=4.341

assign (( resid 23 and name HN
	 ))
       (( resid 22 and name HA
	 )) 3.9 2.0 0.8 volume=133653.250 peak=480 ppm1=7.556 ppm2=4.187

assign (( resid 12 and name HN
	 ))
       (( resid 11 and name HA
	 )) 4.1 2.1 0.8 volume=101376.500 peak=481 ppm1=7.508 ppm2=4.027

assign (( resid 12 and name HN
	 ))
       (( resid 9 and name HA
	 )) 4.1 2.1 0.8 volume=103996.250 peak=482 ppm1=7.507 ppm2=4.089

assign (( resid 37 and name HN
	 ) or (resid 38 and name HN
	 ))
       (( resid 37 and name HA
	 ) or ( resid 38 and name HA
	 )) 2.3 0.6 0.5 volume=3120548.000 peak=483 ppm1=8.127 ppm2=4.326

assign (( resid 56 and name HN
	 ))
       (( resid 55 and name HA
	 )) 3.4 1.7 0.7 volume=321399.500 peak=484 ppm1=8.133 ppm2=4.018

assign (( resid 59 and name HN
	 ))
       (( resid 18 and name HG1%
	 )) 3.6 1.8 0.7 volume=212989.500 peak=485 ppm1=8.046 ppm2=0.917

assign (( resid 61 and name HN
	 ))
       (( resid 60 and name HG2
	 )) 4.3 2.1 0.9 volume=84812.500 peak=486 ppm1=7.932 ppm2=2.238

assign (( resid 65 and name HN
	 ))
       (( resid 64 and name HB1
	 )) 3.5 1.8 0.7 volume=268115.000 peak=487 ppm1=8.185 ppm2=2.267

assign (( resid 59 and name HN
	 ))
       (( resid 58 and name HB1
	 )) 3.6 1.8 0.7 volume=232799.000 peak=488 ppm1=8.046 ppm2=1.869

assign (( resid 45 and name HN
	 ))
       (( resid 44 and name HG2%
	 )) 3.2 1.4 0.6 volume=506639.250 peak=489 ppm1=7.894 ppm2=0.773

assign (( resid 18 and name HG2%
	 ))
       (( resid 15 and name HD2%
	 )) 3.7 1.9 0.7 volume=189879.000 peak=490 ppm1=1.108 ppm2=0.665

assign (( resid 6 and name HB1
	 ))
       (( resid 11 and name HD1%
	 ) or ( resid 11 and name HD2%
	 )) 3.7 1.9 0.7 volume=193330.000 peak=491 ppm1=1.593 ppm2=0.743

assign (( resid 58 and name HB1
	 ))
       (( resid 18 and name HG2%
	 )) 4.1 2.1 0.8 volume=101756.750 peak=492 ppm1=1.867 ppm2=1.105

assign (( resid 11 and name HA
	 ))
       (( resid 14 and name HB%
	 )) 3.3 1.6 0.7 volume=378750.750 peak=493 ppm1=4.022 ppm2=1.440

assign (( resid 52 and name HN
	 ))
       (( resid 51 and name HB1
	 )) 3.3 1.6 0.7 volume=409252.750 peak=494 ppm1=7.884 ppm2=1.837

assign (( resid 5 and name HN
	 ))
       (( resid 4 and name HB1
	 )) 3.9 1.9 0.8 volume=153774.750 peak=495 ppm1=7.997 ppm2=2.144

assign (( resid 55 and name HN
	 ))
       (( resid 57 and name HN
	 )) 4.1 2.1 0.8 volume=105071.750 peak=496 ppm1=8.412 ppm2=7.807

assign (( resid 48 and name HN
	 ))
       (( resid 49 and name HN
	 )) 2.9 1.2 0.6 volume=882236.500 peak=497 ppm1=8.224 ppm2=7.986

assign (( resid 34 and name HN
	 ))
       (( resid 35 and name HB1
	 )) 3.3 1.6 0.7 volume=394228.750 peak=498 ppm1=8.182 ppm2=3.977

assign (( resid 52 and name HN
	 ))
       (( resid 51 and name HA
	 )) 3.0 1.3 0.6 volume=728104.750 peak=499 ppm1=7.884 ppm2=4.445

assign (( resid 9 and name HA
	 ))
       (( resid 12 and name HG2%
	 ) or ( resid 12 and name HG1%
	 )) 3.2 1.5 0.6 volume=436558.000 peak=500 ppm1=4.091 ppm2=0.960

assign (( resid 9 and name HB%
	 ) or (resid 14 and name HB%
	 ))
       (( resid 12 and name HG2%
	 ) or ( resid 12 and name HG1%
	 )) 3.7 1.9 0.7 volume=188080.000 peak=501 ppm1=1.439 ppm2=0.961

assign (( resid 15 and name HA
	 ))
       (( resid 18 and name HG2%
	 )) 3.6 1.8 0.7 volume=249817.000 peak=502 ppm1=3.879 ppm2=1.105

assign (( resid 50 and name HN
	 ))
       (( resid 49 and name HB1
	 )) 3.6 1.8 0.7 volume=216036.750 peak=503 ppm1=7.841 ppm2=2.774

assign (( resid 47 and name HN
	 ) or (resid 49 and name HN
	 ))
       (( resid 48 and name HB2
	 )) 3.9 1.9 0.8 volume=145091.750 peak=504 ppm1=7.991 ppm2=3.250

assign (( resid 4 and name HN
	 ))
       (( resid 3 and name HG2
	 ) or ( resid 3 and name HB2
	 ) or ( resid 3 and name HG1
	 )) 3.9 2.0 0.8 volume=132851.500 peak=505 ppm1=8.574 ppm2=1.902

assign (( resid 4 and name HN
	 ))
       (( resid 3 and name HB1
	 )) 4.2 2.1 0.8 volume=97712.250 peak=506 ppm1=8.570 ppm2=2.223

assign (( resid 4 and name HN
	 ))
       (( resid 3 and name HD2
	 )) 4.3 2.1 0.9 volume=80277.000 peak=507 ppm1=8.571 ppm2=3.640

assign (( resid 41 and name HN
	 ))
       (( resid 40 and name HD2
	 )) 4.1 2.1 0.8 volume=104693.750 peak=508 ppm1=8.420 ppm2=3.629

assign (( resid 12 and name HN
	 ))
       (( resid 9 and name HB%
	 )) 4.3 2.1 0.9 volume=79434.000 peak=509 ppm1=7.508 ppm2=1.436

assign (( resid 12 and name HN
	 ))
       (( resid 11 and name HB2
	 )) 4.2 2.1 0.8 volume=90696.750 peak=510 ppm1=7.500 ppm2=1.310

assign (( resid 61 and name HN
	 ))
       (( resid 15 and name HD2%
	 )) 4.1 2.0 0.8 volume=109288.750 peak=511 ppm1=7.937 ppm2=0.668

assign (( resid 24 and name HD%
	 ))
       (( resid 15 and name HD1%
	 )) 3.4 1.7 0.7 volume=321517.250 peak=512 ppm1=6.856 ppm2=0.458

assign (( resid 61 and name HD%
	 ))
       (( resid 15 and name HD1%
	 )) 3.9 1.9 0.8 volume=149202.750 peak=513 ppm1=7.266 ppm2=0.458

assign (( resid 24 and name HE%
	 ) or (resid 26 and name HE%
	 ))
       (( resid 15 and name HD1%
	 )) 3.7 1.9 0.7 volume=191719.750 peak=514 ppm1=7.177 ppm2=0.458

assign (( resid 26 and name HD%
	 ) or (resid 26 and name HZ
	 ))
       (( resid 15 and name HD1%
	 )) 3.5 1.8 0.7 volume=270163.250 peak=515 ppm1=7.144 ppm2=0.454

assign (( resid 12 and name HA
	 ))
       (( resid 15 and name HD1%
	 )) 3.8 1.9 0.8 volume=159988.750 peak=516 ppm1=3.402 ppm2=0.457

assign (( resid 61 and name HB2
	 ))
       (( resid 15 and name HD1%
	 )) 3.8 1.9 0.8 volume=164828.250 peak=517 ppm1=2.863 ppm2=0.455

assign (( resid 11 and name HD2%
	 ))
       (( resid 15 and name HD1%
	 )) 3.2 1.4 0.6 volume=510363.000 peak=518 ppm1=0.747 ppm2=0.456

assign (( resid 12 and name HG1%
	 ))
       (( resid 15 and name HD1%
	 )) 3.9 1.9 0.8 volume=148424.500 peak=519 ppm1=0.962 ppm2=0.457

assign (( resid 61 and name HB2
	 ))
       (( resid 15 and name HD2%
	 )) 3.3 1.6 0.7 volume=403508.500 peak=520 ppm1=2.870 ppm2=0.667

assign (( resid 61 and name HB1
	 ))
       (( resid 15 and name HD2%
	 )) 3.9 1.9 0.8 volume=146469.750 peak=521 ppm1=3.429 ppm2=0.665

assign (( resid 59 and name HB1
	 ))
       (( resid 18 and name HG1%
	 )) 3.6 1.8 0.7 volume=238738.000 peak=522 ppm1=2.839 ppm2=0.918

assign (( resid 45 and name HA
	 ))
       (( resid 11 and name HD2%
	 ) or ( resid 44 and name HG2%
	 )) 3.8 1.9 0.8 volume=159304.500 peak=523 ppm1=3.731 ppm2=0.754

assign (( resid 18 and name HG2%
	 ))
       (( resid 58 and name HD2%
	 )) 3.5 1.7 0.7 volume=277404.750 peak=524 ppm1=1.105 ppm2=0.838

assign (( resid 12 and name HA
	 ))
       (( resid 11 and name HD1%
	 ) or ( resid 11 and name HD2%
	 )) 4.1 2.0 0.8 volume=112033.250 peak=525 ppm1=3.396 ppm2=0.736

assign (( resid 13 and name HB1
	 ) or (resid 13 and name HB2
	 ))
       (( resid 9 and name HB%
	 )) 3.5 1.8 0.7 volume=262510.500 peak=526 ppm1=2.833 ppm2=1.437

assign (( resid 46 and name HB1
	 ) or (resid 46 and name HB2
	 ))
       (( resid 42 and name HG2%
	 )) 4.0 2.0 0.8 volume=129831.250 peak=527 ppm1=2.784 ppm2=1.203

assign (( resid 26 and name HD%
	 ))
       (( resid 26 and name HB2
	 )) 3.1 1.4 0.6 volume=563809.500 peak=528 ppm1=7.143 ppm2=2.956

assign (( resid 26 and name HD%
	 ))
       (( resid 26 and name HB1
	 )) 3.1 1.4 0.6 volume=598386.750 peak=529 ppm1=7.142 ppm2=3.108

assign (( resid 27 and name HN
	 ))
       (( resid 26 and name HB1
	 )) 3.6 1.8 0.7 volume=239970.250 peak=530 ppm1=8.117 ppm2=3.107

assign (( resid 27 and name HN
	 ))
       (( resid 26 and name HB2
	 )) 3.7 1.8 0.7 volume=208824.750 peak=531 ppm1=8.118 ppm2=2.947

assign (( resid 20 and name HN
	 ))
       (( resid 19 and name HB2
	 )) 4.0 2.0 0.8 volume=125373.250 peak=532 ppm1=7.810 ppm2=2.887

assign (( resid 26 and name HN
	 ))
       (( resid 26 and name HB1
	 )) 3.2 1.5 0.6 volume=426198.500 peak=533 ppm1=8.187 ppm2=3.103

assign (( resid 26 and name HN
	 ))
       (( resid 26 and name HB2
	 )) 3.0 1.2 0.6 volume=733879.750 peak=534 ppm1=8.186 ppm2=2.948

assign (( resid 26 and name HN
	 ))
       (( resid 26 and name HA
	 )) 3.2 1.4 0.6 volume=508878.750 peak=535 ppm1=8.186 ppm2=4.675

assign (( resid 7 and name HN
	 ))
       (( resid 10 and name HB2
	 )) 3.8 1.9 0.8 volume=154498.500 peak=536 ppm1=8.184 ppm2=2.186

assign (( resid 16 and name HE21
	 ) or (resid 17 and name HD%
	 ))
       (( resid 18 and name HA
	 )) 3.9 1.9 0.8 volume=144808.500 peak=537 ppm1=7.259 ppm2=3.741

assign (( resid 17 and name HB2
	 ) or (resid 17 and name HB1
	 ))
       (( resid 18 and name HG2%
	 )) 3.8 1.9 0.8 volume=169154.750 peak=538 ppm1=3.234 ppm2=1.105

assign (( resid 48 and name HB2
	 ))
       (( resid 11 and name HD1%
	 ) or ( resid 11 and name HD2%
	 )) 3.4 1.7 0.7 volume=298706.750 peak=539 ppm1=3.232 ppm2=0.745

assign (( resid 58 and name HB1
	 ))
       (( resid 18 and name HG1%
	 )) 3.9 2.0 0.8 volume=138952.500 peak=540 ppm1=1.862 ppm2=0.918

assign (( resid 58 and name HD1%
	 ))
       (( resid 18 and name HG2%
	 )) 4.0 2.0 0.8 volume=127006.250 peak=541 ppm1=0.799 ppm2=1.102

assign (( resid 44 and name HA
	 ))
       (( resid 47 and name HB2
	 ) or ( resid 47 and name HB1
	 )) 3.4 1.6 0.7 volume=351120.250 peak=542 ppm1=4.000 ppm2=2.079

assign (( resid 55 and name HA
	 ))
       (( resid 58 and name HB1
	 )) 3.8 1.9 0.8 volume=179775.250 peak=543 ppm1=4.015 ppm2=1.869

assign (( resid 64 and name HD1
	 ))
       (( resid 63 and name HB%
	 )) 3.2 1.5 0.6 volume=448079.750 peak=544 ppm1=3.752 ppm2=1.245

assign (( resid 40 and name HD1
	 ))
       (( resid 39 and name HB%
	 )) 3.5 1.7 0.7 volume=289285.750 peak=545 ppm1=3.738 ppm2=1.344

assign (( resid 40 and name HD2
	 ))
       (( resid 39 and name HB%
	 )) 3.3 1.6 0.7 volume=357469.000 peak=546 ppm1=3.611 ppm2=1.345

assign (( resid 64 and name HD2
	 ))
       (( resid 63 and name HB%
	 )) 3.1 1.4 0.6 volume=526087.750 peak=547 ppm1=3.628 ppm2=1.247

assign (( resid 30 and name HN
	 ))
       (( resid 29 and name HD1
	 )) 4.1 2.1 0.8 volume=103131.500 peak=548 ppm1=8.108 ppm2=3.737

assign (( resid 30 and name HN
	 ))
       (( resid 29 and name HD2
	 )) 4.0 2.0 0.8 volume=124677.500 peak=549 ppm1=8.108 ppm2=3.590

assign (( resid 29 and name HD1
	 ))
       (( resid 28 and name HB2
	 ) or ( resid 28 and name HB1
	 )) 4.1 2.0 0.8 volume=110146.750 peak=550 ppm1=3.742 ppm2=1.758

assign (( resid 29 and name HD2
	 ))
       (( resid 28 and name HB2
	 ) or ( resid 28 and name HB1
	 )) 4.0 2.0 0.8 volume=129204.000 peak=551 ppm1=3.586 ppm2=1.756

assign (( resid 48 and name HN
	 ))
       (( resid 11 and name HD1%
	 ) or ( resid 11 and name HD2%
	 )) 3.8 1.9 0.8 volume=167081.750 peak=552 ppm1=8.227 ppm2=0.748

assign (( resid 20 and name HA1
	 ))
       (( resid 21 and name HB2
	 ) or ( resid 21 and name HB1
	 )) 3.9 2.0 0.8 volume=140678.000 peak=553 ppm1=3.972 ppm2=2.855

assign (( resid 65 and name HN
	 ))
       (( resid 64 and name HG2
	 ) or ( resid 64 and name HG1
	 )) 4.0 2.0 0.8 volume=129206.000 peak=554 ppm1=8.182 ppm2=2.010

assign (( resid 31 and name HN
	 ))
       (( resid 30 and name HG2%
	 )) 3.7 1.9 0.7 volume=187166.000 peak=555 ppm1=8.232 ppm2=1.192

assign (( resid 52 and name HN
	 ))
       (( resid 51 and name HG2
	 ) or ( resid 51 and name HG1
	 )) 4.0 2.0 0.8 volume=115728.500 peak=556 ppm1=7.880 ppm2=1.629

assign (( resid 63 and name HN
	 ))
       (( resid 24 and name HB1
	 )) 4.2 2.1 0.8 volume=95881.750 peak=557 ppm1=8.235 ppm2=2.874

assign (( resid 45 and name HN
	 ))
       (( resid 44 and name HA
	 )) 3.2 1.5 0.6 volume=480256.250 peak=558 ppm1=7.894 ppm2=3.997

assign (( resid 66 and name HN
	 ))
       (( resid 65 and name HB2
	 ) or ( resid 65 and name HB1
	 )) 3.4 1.6 0.7 volume=351907.500 peak=559 ppm1=8.240 ppm2=1.556

assign (( resid 24 and name HE%
	 ))
       (( resid 16 and name HG1
	 )) 4.0 2.0 0.8 volume=122275.750 peak=560 ppm1=7.163 ppm2=2.474

assign (( resid 24 and name HE%
	 ))
       (( resid 16 and name HG2
	 )) 3.9 2.0 0.8 volume=140699.750 peak=561 ppm1=7.163 ppm2=2.392

assign (( resid 24 and name HE%
	 ))
       (( resid 16 and name HB1
	 )) 4.2 2.1 0.8 volume=90271.750 peak=562 ppm1=7.166 ppm2=2.191

assign (( resid 17 and name HD%
	 ))
       (( resid 16 and name HB2
	 ) or ( resid 18 and name HB
	 )) 4.1 2.1 0.8 volume=104926.250 peak=563 ppm1=7.260 ppm2=2.056

assign (( resid 59 and name HB2
	 ))
       (( resid 18 and name HG1%
	 )) 3.6 1.8 0.7 volume=248942.750 peak=564 ppm1=2.721 ppm2=0.919

assign (( resid 14 and name HB%
	 ))
       (( resid 18 and name HG2%
	 )) 4.2 2.1 0.8 volume=95291.500 peak=565 ppm1=1.439 ppm2=1.106

assign (( resid 18 and name HG2%
	 ))
       (( resid 14 and name HB%
	 )) 3.6 1.8 0.7 volume=220723.750 peak=566 ppm1=1.104 ppm2=1.438

assign (( resid 9 and name HB%
	 ) or (resid 14 and name HB%
	 ))
       (( resid 12 and name HB
	 )) 3.6 1.8 0.7 volume=244059.500 peak=567 ppm1=1.441 ppm2=2.072

assign (( resid 46 and name HB1
	 ) or (resid 46 and name HB2
	 ))
       (( resid 45 and name HG1%
	 )) 3.7 1.8 0.7 volume=207341.750 peak=568 ppm1=2.781 ppm2=0.785

assign (( resid 13 and name HB1
	 ) or (resid 13 and name HB2
	 ))
       (( resid 12 and name HG2%
	 ) or ( resid 12 and name HG1%
	 )) 4.0 2.0 0.8 volume=114657.000 peak=569 ppm1=2.834 ppm2=0.964

assign (( resid 61 and name HD%
	 ))
       (( resid 15 and name HD2%
	 )) 3.3 1.6 0.7 volume=388369.000 peak=570 ppm1=7.263 ppm2=0.668

assign (( resid 24 and name HD%
	 ))
       (( resid 12 and name HG2%
	 ) or ( resid 12 and name HG1%
	 )) 4.1 2.0 0.8 volume=112598.250 peak=571 ppm1=6.859 ppm2=0.965

assign (( resid 24 and name HD%
	 ))
       (( resid 24 and name HA
	 )) 3.6 1.8 0.7 volume=232637.750 peak=572 ppm1=6.854 ppm2=5.004

assign (( resid 24 and name HZ
	 ))
       (( resid 12 and name HG2%
	 ) or ( resid 12 and name HG1%
	 )) 3.1 1.3 0.6 volume=616375.750 peak=573 ppm1=7.233 ppm2=0.965

assign (( resid 24 and name HE%
	 ) or (resid 26 and name HD%
	 ))
       (( resid 12 and name HG2%
	 ) or ( resid 12 and name HG1%
	 )) 3.0 1.3 0.6 volume=674497.250 peak=574 ppm1=7.161 ppm2=0.966

assign (( resid 26 and name HD%
	 ))
       (( resid 26 and name HA
	 )) 3.1 1.4 0.6 volume=585879.000 peak=575 ppm1=7.141 ppm2=4.669

assign (( resid 25 and name HD%
	 ))
       (( resid 63 and name HB%
	 )) 3.9 1.9 0.8 volume=151953.000 peak=576 ppm1=7.050 ppm2=1.248

assign (( resid 25 and name HE%
	 ))
       (( resid 63 and name HB%
	 )) 3.7 1.9 0.7 volume=195382.500 peak=577 ppm1=6.789 ppm2=1.250

assign (( resid 26 and name HE%
	 ))
       (( resid 26 and name HB2
	 )) 3.9 2.0 0.8 volume=138274.500 peak=578 ppm1=7.179 ppm2=2.953

assign (( resid 26 and name HD%
	 ) or (resid 26 and name HZ
	 ))
       (( resid 45 and name HG2%
	 )) 3.5 1.8 0.7 volume=251230.000 peak=579 ppm1=7.140 ppm2=0.861

assign (( resid 26 and name HE%
	 ))
       (( resid 45 and name HG2%
	 )) 3.8 1.9 0.8 volume=163530.000 peak=580 ppm1=7.182 ppm2=0.863

assign (( resid 26 and name HE%
	 ))
       (( resid 44 and name HG2%
	 )) 3.6 1.8 0.7 volume=235803.250 peak=581 ppm1=7.183 ppm2=0.755

assign (( resid 26 and name HD%
	 ) or (resid 26 and name HZ
	 ))
       (( resid 44 and name HG2%
	 )) 3.3 1.6 0.7 volume=355749.250 peak=582 ppm1=7.143 ppm2=0.760

assign (( resid 61 and name HE%
	 ))
       (( resid 58 and name HD2%
	 )) 3.9 1.9 0.8 volume=150438.000 peak=583 ppm1=6.776 ppm2=0.853

assign (( resid 17 and name HD%
	 ))
       (( resid 18 and name HG2%
	 )) 3.2 1.5 0.6 volume=441347.000 peak=584 ppm1=7.258 ppm2=1.105

assign (( resid 17 and name HD%
	 ))
       (( resid 18 and name HG1%
	 )) 3.5 1.7 0.7 volume=276058.000 peak=585 ppm1=7.259 ppm2=0.923

assign (( resid 50 and name HE%
	 ))
       (( resid 46 and name HB1
	 ) or ( resid 46 and name HB2
	 )) 4.1 2.0 0.8 volume=113355.500 peak=586 ppm1=7.318 ppm2=2.785

assign (( resid 50 and name HD%
	 ))
       (( resid 46 and name HB1
	 ) or ( resid 46 and name HB2
	 )) 3.5 1.8 0.7 volume=259403.000 peak=587 ppm1=7.266 ppm2=2.782

assign (( resid 17 and name HE%
	 ))
       (( resid 18 and name HG2%
	 )) 3.9 1.9 0.8 volume=153060.750 peak=588 ppm1=7.333 ppm2=1.102

assign (( resid 61 and name HD%
	 ))
       (( resid 58 and name HD2%
	 )) 3.4 1.7 0.7 volume=310532.500 peak=589 ppm1=7.260 ppm2=0.850

assign (( resid 7 and name HN
	 ))
       (( resid 10 and name HB1
	 )) 4.1 2.0 0.8 volume=113245.750 peak=590 ppm1=8.176 ppm2=2.117

assign (( resid 63 and name HN
	 ))
       (( resid 22 and name HB2
	 )) 4.0 2.0 0.8 volume=123075.750 peak=591 ppm1=8.235 ppm2=2.023

assign (( resid 63 and name HN
	 ))
       (( resid 22 and name HB1
	 )) 4.0 2.0 0.8 volume=114933.250 peak=592 ppm1=8.232 ppm2=1.930

assign (( resid 17 and name HE%
	 ))
       (( resid 18 and name HG1%
	 ) or ( resid 55 and name HD1%
	 )) 4.0 2.0 0.8 volume=117731.500 peak=593 ppm1=7.334 ppm2=0.932

assign (( resid 50 and name HE%
	 ))
       (( resid 46 and name HA
	 )) 4.1 2.0 0.8 volume=106496.500 peak=594 ppm1=7.318 ppm2=4.511

assign (( resid 50 and name HD%
	 ))
       (( resid 46 and name HA
	 )) 3.6 1.8 0.7 volume=235656.250 peak=595 ppm1=7.266 ppm2=4.510

assign (( resid 26 and name HE%
	 ))
       (( resid 26 and name HD%
	 ) or ( resid 26 and name HZ
	 )) 2.0 0.3 0.4 volume=7140335.250 peak=596 ppm1=7.182 ppm2=7.140

assign (( resid 17 and name HD%
	 ))
       (( resid 14 and name HB%
	 )) 3.7 1.9 0.7 volume=181885.750 peak=597 ppm1=7.262 ppm2=1.443

assign (( resid 5 and name HB
	 ))
       (( resid 5 and name HG2%
	 )) 3.1 1.4 0.6 volume=517179.000 peak=598 ppm1=4.238 ppm2=1.112

assign (( resid 15 and name HA
	 ))
       (( resid 18 and name HG1%
	 )) 4.0 2.0 0.8 volume=130914.000 peak=599 ppm1=3.878 ppm2=0.916

assign (( resid 8 and name HA2
	 ))
       (( resid 9 and name HB%
	 )) 4.1 2.0 0.8 volume=111430.000 peak=600 ppm1=3.800 ppm2=1.442

assign (( resid 48 and name HB1
	 ))
       (( resid 11 and name HD1%
	 ) or ( resid 11 and name HD2%
	 )) 3.6 1.8 0.7 volume=248552.250 peak=601 ppm1=2.998 ppm2=0.747

assign (( resid 58 and name HD1%
	 ))
       (( resid 11 and name HA
	 ) or ( resid 55 and name HA
	 )) 3.6 1.8 0.7 volume=223920.250 peak=602 ppm1=0.800 ppm2=4.023

assign (( resid 15 and name HA
	 ))
       (( resid 58 and name HD1%
	 )) 3.9 2.0 0.8 volume=132886.250 peak=603 ppm1=3.871 ppm2=0.802

assign (( resid 14 and name HB%
	 ))
       (( resid 11 and name HD1%
	 )) 3.1 1.4 0.6 volume=529648.500 peak=604 ppm1=1.440 ppm2=0.744

assign (( resid 6 and name HD1%
	 ) or (resid 58 and name HD2%
	 ))
       (( resid 14 and name HB%
	 )) 2.6 0.9 0.5 volume=1654784.250 peak=605 ppm1=0.839 ppm2=1.439

assign (( resid 6 and name HD2%
	 ) or (resid 58 and name HD1%
	 ))
       (( resid 14 and name HB%
	 )) 2.8 1.1 0.6 volume=960108.500 peak=606 ppm1=0.804 ppm2=1.440

assign (( resid 15 and name HD1%
	 ))
       (( resid 11 and name HG
	 )) 3.6 1.8 0.7 volume=214208.750 peak=607 ppm1=0.458 ppm2=1.375

assign (( resid 17 and name HB2
	 ) or (resid 17 and name HB1
	 ))
       (( resid 14 and name HB%
	 )) 3.9 1.9 0.8 volume=148010.500 peak=608 ppm1=3.229 ppm2=1.440

assign (( resid 24 and name HB2
	 ))
       (( resid 15 and name HD2%
	 )) 4.2 2.1 0.8 volume=95455.500 peak=609 ppm1=3.118 ppm2=0.663

assign (( resid 24 and name HB2
	 ))
       (( resid 15 and name HD1%
	 )) 4.3 2.1 0.9 volume=82017.000 peak=610 ppm1=3.125 ppm2=0.453

assign (( resid 61 and name HE%
	 ))
       (( resid 56 and name HB1
	 ) or ( resid 57 and name HB1
	 ) or ( resid 60 and name HB1
	 )) 4.0 2.0 0.8 volume=126968.750 peak=611 ppm1=6.775 ppm2=1.888

assign (( resid 61 and name HD%
	 ))
       (( resid 56 and name HB1
	 ) or ( resid 57 and name HB1
	 ) or ( resid 60 and name HB1
	 )) 3.9 1.9 0.8 volume=144163.250 peak=612 ppm1=7.260 ppm2=1.885

assign (( resid 58 and name HD1%
	 ))
       (( resid 61 and name HE%
	 )) 3.5 1.7 0.7 volume=295250.250 peak=613 ppm1=0.801 ppm2=6.777

assign (( resid 44 and name HG2%
	 ))
       (( resid 61 and name HE%
	 )) 4.2 2.1 0.8 volume=93081.000 peak=614 ppm1=0.763 ppm2=6.781

assign (( resid 44 and name HD1%
	 ))
       (( resid 61 and name HE%
	 )) 4.2 2.1 0.8 volume=88988.750 peak=615 ppm1=0.695 ppm2=6.777

assign (( resid 45 and name HG1%
	 ) or (resid 58 and name HD1%
	 ))
       (( resid 50 and name HD%
	 ) or ( resid 61 and name HD%
	 )) 3.3 1.6 0.7 volume=395190.000 peak=616 ppm1=0.798 ppm2=7.265

assign (( resid 44 and name HG2%
	 ))
       (( resid 61 and name HD%
	 )) 4.3 2.1 0.9 volume=80406.750 peak=617 ppm1=0.751 ppm2=7.263

assign (( resid 24 and name HD%
	 ))
       (( resid 16 and name HA
	 )) 4.0 2.0 0.8 volume=126840.000 peak=618 ppm1=6.859 ppm2=4.123

assign (( resid 24 and name HE%
	 ))
       (( resid 16 and name HA
	 )) 3.3 1.6 0.7 volume=369424.250 peak=619 ppm1=7.161 ppm2=4.120

assign (( resid 24 and name HZ
	 ))
       (( resid 16 and name HA
	 )) 4.2 2.1 0.8 volume=92716.750 peak=620 ppm1=7.229 ppm2=4.120

assign (( resid 24 and name HE%
	 ))
       (( resid 15 and name HD2%
	 )) 3.9 2.0 0.8 volume=137323.500 peak=621 ppm1=7.149 ppm2=0.677

assign (( resid 7 and name HN
	 ))
       (( resid 6 and name HD2%
	 )) 3.8 1.9 0.8 volume=168026.000 peak=622 ppm1=8.182 ppm2=0.810

assign (( resid 54 and name HN
	 ))
       (( resid 57 and name HB1
	 ) or ( resid 58 and name HB1
	 )) 4.0 2.0 0.8 volume=115861.250 peak=623 ppm1=8.282 ppm2=1.866

assign (( resid 11 and name HN
	 ))
       (( resid 10 and name HB1
	 )) 4.3 2.2 0.9 volume=77084.250 peak=624 ppm1=7.399 ppm2=2.120

assign (( resid 41 and name HN
	 ))
       (( resid 41 and name HB2
	 )) 3.1 1.4 0.6 volume=575694.000 peak=625 ppm1=8.420 ppm2=1.993

assign (( resid 43 and name HN
	 ))
       (( resid 46 and name HB1
	 ) or ( resid 46 and name HB2
	 )) 4.2 2.1 0.8 volume=88552.500 peak=626 ppm1=8.448 ppm2=2.783

assign (( resid 24 and name HD%
	 ))
       (( resid 11 and name HD1%
	 ) or ( resid 11 and name HD2%
	 ) or ( resid 44 and name HG2%
	 )) 4.2 2.1 0.8 volume=90249.500 peak=627 ppm1=6.857 ppm2=0.753

assign (( resid 66 and name HN
	 ))
       (( resid 65 and name HD1%
	 )) 4.0 2.0 0.8 volume=127287.000 peak=628 ppm1=8.241 ppm2=0.877

assign (( resid 66 and name HN
	 ))
       (( resid 65 and name HD2%
	 )) 3.9 2.0 0.8 volume=135098.250 peak=629 ppm1=8.234 ppm2=0.908

assign (( resid 16 and name HN
	 ))
       (( resid 12 and name HG2%
	 ) or ( resid 12 and name HG1%
	 )) 4.1 2.0 0.8 volume=112032.250 peak=630 ppm1=8.130 ppm2=0.967

assign (( resid 15 and name HN
	 ))
       (( resid 14 and name HB%
	 )) 2.7 1.0 0.5 volume=1380581.000 peak=631 ppm1=8.102 ppm2=1.441

assign (( resid 61 and name HD%
	 ))
       (( resid 58 and name HA
	 )) 2.9 1.2 0.6 volume=805399.500 peak=632 ppm1=7.262 ppm2=4.203

assign (( resid 61 and name HE%
	 ))
       (( resid 58 and name HA
	 )) 3.5 1.8 0.7 volume=266001.500 peak=633 ppm1=6.776 ppm2=4.198

assign (( resid 25 and name HD%
	 ))
       (( resid 63 and name HA
	 )) 4.1 2.1 0.8 volume=102375.000 peak=634 ppm1=7.051 ppm2=4.427

assign (( resid 25 and name HE%
	 ))
       (( resid 63 and name HA
	 )) 3.9 1.9 0.8 volume=147102.500 peak=635 ppm1=6.790 ppm2=4.428

assign (( resid 25 and name HD%
	 ))
       (( resid 64 and name HD1
	 )) 4.3 2.2 0.9 volume=78259.250 peak=636 ppm1=7.048 ppm2=3.749

assign (( resid 25 and name HD%
	 ))
       (( resid 64 and name HD2
	 )) 4.2 2.1 0.8 volume=89872.000 peak=637 ppm1=7.044 ppm2=3.624

assign (( resid 25 and name HE%
	 ))
       (( resid 64 and name HD1
	 )) 3.9 2.0 0.8 volume=138116.250 peak=638 ppm1=6.784 ppm2=3.754

assign (( resid 25 and name HE%
	 ))
       (( resid 64 and name HD2
	 )) 4.2 2.1 0.8 volume=88530.500 peak=639 ppm1=6.792 ppm2=3.629

assign (( resid 61 and name HE%
	 ))
       (( resid 47 and name HB2
	 ) or ( resid 47 and name HB1
	 )) 4.2 2.1 0.8 volume=96659.000 peak=640 ppm1=6.782 ppm2=2.075

assign (( resid 61 and name HE%
	 ))
       (( resid 47 and name HG1
	 ) or ( resid 47 and name HG2
	 )) 4.4 2.2 0.9 volume=72159.250 peak=641 ppm1=6.777 ppm2=2.447

assign (( resid 25 and name HD%
	 ))
       (( resid 26 and name HA
	 )) 3.6 1.8 0.7 volume=215529.250 peak=642 ppm1=7.054 ppm2=4.667

assign (( resid 25 and name HE%
	 ) or (resid 61 and name HE%
	 ))
       (( resid 26 and name HA
	 )) 3.8 1.9 0.8 volume=156975.000 peak=643 ppm1=6.786 ppm2=4.659

assign (( resid 25 and name HE%
	 ) or (resid 41 and name HE22
	 ))
       (( resid 27 and name HA
	 )) 3.8 1.9 0.8 volume=177680.750 peak=644 ppm1=6.781 ppm2=4.731

assign (( resid 61 and name HE%
	 ))
       (( resid 57 and name HG2
	 ) or ( resid 57 and name HG1
	 )) 4.2 2.1 0.8 volume=93224.250 peak=645 ppm1=6.776 ppm2=1.702

assign (( resid 50 and name HE%
	 ))
       (( resid 45 and name HG1%
	 )) 3.8 1.9 0.8 volume=174418.750 peak=646 ppm1=7.319 ppm2=0.786

assign (( resid 24 and name HD%
	 ))
       (( resid 23 and name HA1
	 )) 4.1 2.1 0.8 volume=105573.250 peak=647 ppm1=6.857 ppm2=3.976

assign (( resid 24 and name HD%
	 ))
       (( resid 23 and name HA2
	 )) 3.9 2.0 0.8 volume=135573.500 peak=648 ppm1=6.854 ppm2=3.766

assign (( resid 24 and name HD%
	 ))
       (( resid 19 and name HB1
	 )) 4.0 2.0 0.8 volume=122482.000 peak=649 ppm1=6.858 ppm2=3.260

assign (( resid 61 and name HE%
	 ))
       (( resid 44 and name HA
	 )) 4.2 2.1 0.8 volume=96965.000 peak=650 ppm1=6.780 ppm2=4.012

assign (( resid 44 and name HN
	 ))
       (( resid 43 and name HA2
	 )) 3.1 1.4 0.6 volume=589308.000 peak=651 ppm1=7.855 ppm2=4.059

assign (( resid 61 and name HE%
	 ))
       (( resid 44 and name HB
	 )) 4.0 2.0 0.8 volume=117529.000 peak=652 ppm1=6.772 ppm2=1.517

assign (( resid 17 and name HE%
	 ) or (resid 50 and name HE%
	 ))
       (( resid 45 and name HG2%
	 ) or ( resid 55 and name HD2%
	 )) 4.2 2.1 0.8 volume=95281.000 peak=653 ppm1=7.324 ppm2=0.860

assign (( resid 61 and name HE%
	 ))
       (( resid 60 and name HE%
	 ) or ( resid 64 and name HG2
	 ) or ( resid 64 and name HG1
	 )) 3.7 1.9 0.7 volume=185524.000 peak=654 ppm1=6.780 ppm2=2.000

assign (( resid 61 and name HN
	 ))
       (( resid 60 and name HB2
	 )) 3.9 2.0 0.8 volume=138122.500 peak=655 ppm1=7.929 ppm2=1.934

assign (( resid 61 and name HN
	 ))
       (( resid 60 and name HB1
	 )) 4.1 2.0 0.8 volume=112950.000 peak=656 ppm1=7.937 ppm2=1.884

assign (( resid 42 and name HN
	 ))
       (( resid 41 and name HB2
	 )) 4.0 2.0 0.8 volume=122344.000 peak=657 ppm1=8.026 ppm2=1.991

assign (( resid 12 and name HA
	 ))
       (( resid 9 and name HB%
	 ) or ( resid 14 and name HB%
	 )) 4.3 2.1 0.9 volume=83310.000 peak=658 ppm1=3.398 ppm2=1.442

assign (( resid 12 and name HN
	 ))
       (( resid 11 and name HG
	 )) 4.6 2.3 0.9 volume=53286.250 peak=659 ppm1=7.509 ppm2=1.366

assign (( resid 11 and name HG
	 ))
       (( resid 15 and name HD1%
	 )) 3.9 2.0 0.8 volume=138823.500 peak=660 ppm1=1.385 ppm2=0.451

assign (( resid 11 and name HB1
	 ))
       (( resid 7 and name HA
	 )) 4.0 2.0 0.8 volume=118841.750 peak=661 ppm1=1.737 ppm2=4.681

assign (( resid 11 and name HB2
	 ))
       (( resid 7 and name HA
	 )) 4.4 2.2 0.9 volume=65463.000 peak=662 ppm1=1.310 ppm2=4.676

assign (( resid 11 and name HD1%
	 ) or (resid 11 and name HD2%
	 ))
       (( resid 7 and name HA
	 )) 3.7 1.8 0.7 volume=209788.750 peak=663 ppm1=0.753 ppm2=4.676

assign (( resid 53 and name HN
	 ))
       (( resid 52 and name HB2
	 ) or ( resid 52 and name HB1
	 )) 4.2 2.1 0.8 volume=85798.250 peak=664 ppm1=8.820 ppm2=3.802

assign (( resid 48 and name HB2
	 ))
       (( resid 45 and name HG1%
	 ) or ( resid 58 and name HD1%
	 )) 3.9 2.0 0.8 volume=134202.000 peak=665 ppm1=3.232 ppm2=0.807

assign (( resid 44 and name HD1%
	 ))
       (( resid 61 and name HD%
	 )) 4.3 2.2 0.9 volume=77767.250 peak=666 ppm1=0.700 ppm2=7.264

assign (( resid 44 and name HD1%
	 ))
       (( resid 61 and name HB1
	 )) 4.2 2.1 0.8 volume=86044.000 peak=667 ppm1=0.702 ppm2=3.414

assign (( resid 65 and name HD2%
	 ))
       (( resid 22 and name HD1
	 )) 4.0 2.0 0.8 volume=122767.250 peak=668 ppm1=0.915 ppm2=3.263

assign (( resid 65 and name HD1%
	 ))
       (( resid 22 and name HD1
	 )) 3.9 1.9 0.8 volume=144358.750 peak=669 ppm1=0.875 ppm2=3.266

assign (( resid 51 and name HD1
	 ) or (resid 51 and name HD2
	 ))
       (( resid 47 and name HG1
	 ) or ( resid 47 and name HG2
	 )) 4.3 2.2 0.9 volume=77469.500 peak=670 ppm1=3.218 ppm2=2.447

assign (( resid 14 and name HN
	 ))
       (( resid 6 and name HD2%
	 )) 4.4 2.2 0.9 volume=67915.250 peak=671 ppm1=7.758 ppm2=0.814

assign (( resid 63 and name HB%
	 ))
       (( resid 24 and name HA
	 )) 3.5 1.8 0.7 volume=255973.250 peak=672 ppm1=1.245 ppm2=5.011

assign (( resid 9 and name HA
	 ))
       (( resid 9 and name HB%
	 )) 2.7 1.0 0.5 volume=1311902.000 peak=673 ppm1=4.087 ppm2=1.440

assign (( resid 58 and name HG
	 ))
       (( resid 15 and name HD2%
	 )) 3.8 1.9 0.8 volume=178717.500 peak=674 ppm1=1.546 ppm2=0.667

assign (( resid 15 and name HD1%
	 ))
       (( resid 58 and name HD2%
	 )) 4.1 2.1 0.8 volume=98721.000 peak=675 ppm1=0.450 ppm2=0.848

assign (( resid 52 and name HN
	 ))
       (( resid 51 and name HB2
	 )) 3.3 1.6 0.7 volume=406370.500 peak=676 ppm1=7.885 ppm2=1.938

assign (( resid 49 and name HB1
	 ))
       (( resid 45 and name HG1%
	 )) 4.1 2.0 0.8 volume=108531.250 peak=677 ppm1=2.754 ppm2=0.785

assign (( resid 59 and name HN
	 ))
       (( resid 58 and name HG
	 )) 3.8 1.9 0.8 volume=163437.250 peak=678 ppm1=8.044 ppm2=1.559

assign (( resid 15 and name HA
	 ))
       (( resid 18 and name HB
	 )) 3.6 1.8 0.7 volume=216316.000 peak=679 ppm1=3.875 ppm2=2.053

assign (( resid 61 and name HE%
	 ))
       (( resid 60 and name HB2
	 )) 4.1 2.1 0.8 volume=104689.000 peak=680 ppm1=6.780 ppm2=1.948

assign (( resid 61 and name HD%
	 ))
       (( resid 60 and name HB2
	 )) 4.0 2.0 0.8 volume=123635.500 peak=681 ppm1=7.264 ppm2=1.955

assign (( resid 51 and name HB2
	 ))
       (( resid 51 and name HD1
	 ) or ( resid 51 and name HD2
	 )) 4.0 2.0 0.8 volume=122052.250 peak=682 ppm1=1.933 ppm2=3.218

assign (( resid 51 and name HB1
	 ))
       (( resid 51 and name HD1
	 ) or ( resid 51 and name HD2
	 )) 3.8 1.9 0.8 volume=172146.250 peak=683 ppm1=1.835 ppm2=3.218

assign (( resid 51 and name HG2
	 ))
       (( resid 51 and name HD1
	 ) or ( resid 51 and name HD2
	 )) 3.2 1.5 0.6 volume=477961.000 peak=684 ppm1=1.623 ppm2=3.218

assign (( resid 22 and name HB2
	 ))
       (( resid 22 and name HD1
	 ) or ( resid 22 and name HD2
	 )) 3.3 1.6 0.7 volume=397961.000 peak=685 ppm1=2.016 ppm2=3.269

assign (( resid 22 and name HB1
	 ))
       (( resid 22 and name HD1
	 ) or ( resid 22 and name HD2
	 )) 3.5 1.8 0.7 volume=272991.750 peak=686 ppm1=1.939 ppm2=3.265

assign (( resid 22 and name HG2
	 ))
       (( resid 22 and name HD1
	 ) or ( resid 22 and name HD2
	 )) 3.3 1.6 0.7 volume=392672.250 peak=687 ppm1=1.812 ppm2=3.267

assign (( resid 22 and name HG1
	 ))
       (( resid 22 and name HD1
	 ) or ( resid 22 and name HD2
	 )) 2.9 1.1 0.6 volume=905651.750 peak=688 ppm1=1.711 ppm2=3.261

assign (( resid 56 and name HN
	 ))
       (( resid 56 and name HA
	 )) 2.7 1.0 0.5 volume=1266488.500 peak=689 ppm1=8.132 ppm2=4.120

assign (( resid 56 and name HN
	 ))
       (( resid 56 and name HB1
	 )) 2.6 0.9 0.5 volume=1717716.500 peak=690 ppm1=8.133 ppm2=1.888

assign (( resid 56 and name HN
	 ))
       (( resid 54 and name HB1
	 )) 4.1 2.0 0.8 volume=107792.000 peak=691 ppm1=8.137 ppm2=2.815

assign (( resid 56 and name HN
	 ))
       (( resid 56 and name HD1
	 ) or ( resid 56 and name HD2
	 )) 3.9 1.9 0.8 volume=145112.750 peak=692 ppm1=8.134 ppm2=3.229

assign (( resid 57 and name HN
	 ))
       (( resid 54 and name HB1
	 )) 4.3 2.2 0.9 volume=78002.000 peak=693 ppm1=7.811 ppm2=2.815

assign (( resid 17 and name HB2
	 ) or (resid 17 and name HB1
	 ))
       (( resid 14 and name HA
	 )) 3.2 1.5 0.6 volume=484346.250 peak=694 ppm1=3.230 ppm2=4.222

assign (( resid 56 and name HD1
	 ) or (resid 56 and name HD2
	 ))
       (( resid 56 and name HA
	 )) 4.1 2.1 0.8 volume=104450.000 peak=695 ppm1=3.239 ppm2=4.117

assign (( resid 56 and name HB1
	 ))
       (( resid 56 and name HA
	 )) 2.9 1.2 0.6 volume=869599.500 peak=696 ppm1=1.888 ppm2=4.118

assign (( resid 56 and name HG2
	 ))
       (( resid 56 and name HA
	 )) 3.5 1.7 0.7 volume=273450.500 peak=697 ppm1=1.733 ppm2=4.121

assign (( resid 56 and name HG1
	 ))
       (( resid 56 and name HA
	 )) 3.4 1.7 0.7 volume=310742.750 peak=698 ppm1=1.700 ppm2=4.116

assign (( resid 3 and name HB1
	 ))
       (( resid 3 and name HD2
	 ) or ( resid 3 and name HD1
	 )) 3.9 2.0 0.8 volume=140071.500 peak=699 ppm1=2.227 ppm2=3.633

assign (( resid 46 and name HN
	 ) or (resid 49 and name HN
	 ))
       (( resid 45 and name HB
	 )) 3.5 1.7 0.7 volume=285051.000 peak=700 ppm1=7.978 ppm2=1.982

assign (( resid 67 and name HB1
	 ))
       (( resid 67 and name HD1
	 )) 3.9 2.0 0.8 volume=136632.000 peak=701 ppm1=2.286 ppm2=3.793

assign (( resid 64 and name HG2
	 ) or (resid 64 and name HG1
	 ))
       (( resid 64 and name HD2
	 )) 2.5 0.8 0.5 volume=2134735.750 peak=702 ppm1=2.008 ppm2=3.628

assign (( resid 67 and name HB1
	 ))
       (( resid 67 and name HD2
	 )) 3.9 1.9 0.8 volume=149062.500 peak=703 ppm1=2.268 ppm2=3.626

assign (( resid 3 and name HD2
	 ) or (resid 3 and name HD1
	 ))
       (( resid 2 and name HA1
	 )) 3.0 1.2 0.6 volume=740017.750 peak=704 ppm1=3.635 ppm2=4.192

assign (( resid 40 and name HD1
	 ))
       (( resid 39 and name HA
	 )) 2.9 1.2 0.6 volume=832189.500 peak=705 ppm1=3.739 ppm2=4.569

assign (( resid 40 and name HD2
	 ))
       (( resid 39 and name HA
	 )) 3.1 1.4 0.6 volume=572294.500 peak=706 ppm1=3.614 ppm2=4.571

assign (( resid 67 and name HD1
	 ))
       (( resid 66 and name HA
	 )) 3.0 1.3 0.6 volume=667502.250 peak=707 ppm1=3.791 ppm2=4.607

assign (( resid 67 and name HD2
	 ))
       (( resid 66 and name HA
	 )) 3.1 1.4 0.6 volume=568876.750 peak=708 ppm1=3.621 ppm2=4.604

assign (( resid 29 and name HD1
	 ))
       (( resid 28 and name HA
	 )) 2.9 1.2 0.6 volume=840574.750 peak=709 ppm1=3.739 ppm2=4.476

assign (( resid 29 and name HD2
	 ))
       (( resid 28 and name HA
	 )) 3.0 1.3 0.6 volume=694260.250 peak=710 ppm1=3.592 ppm2=4.476

assign (( resid 64 and name HD1
	 ))
       (( resid 63 and name HA
	 )) 2.9 1.2 0.6 volume=850815.500 peak=711 ppm1=3.753 ppm2=4.426

assign (( resid 64 and name HD2
	 ))
       (( resid 63 and name HA
	 )) 3.0 1.2 0.6 volume=755119.250 peak=712 ppm1=3.629 ppm2=4.425

assign (( resid 13 and name HB1
	 ) or (resid 13 and name HB2
	 ))
       (( resid 10 and name HA
	 )) 3.1 1.3 0.6 volume=617473.750 peak=713 ppm1=2.832 ppm2=4.144

assign (( resid 64 and name HG2
	 ) or (resid 64 and name HG1
	 ))
       (( resid 64 and name HD1
	 )) 2.7 0.9 0.5 volume=1399758.250 peak=714 ppm1=2.003 ppm2=3.746

assign (( resid 64 and name HD1
	 ))
       (( resid 64 and name HB2
	 )) 4.0 2.0 0.8 volume=126872.500 peak=715 ppm1=3.756 ppm2=1.854

assign (( resid 64 and name HD2
	 ))
       (( resid 64 and name HB2
	 )) 4.2 2.1 0.8 volume=95246.500 peak=716 ppm1=3.632 ppm2=1.856

assign (( resid 64 and name HB1
	 ))
       (( resid 64 and name HB2
	 )) 2.7 1.0 0.5 volume=1250167.500 peak=717 ppm1=2.266 ppm2=1.856

assign (( resid 67 and name HD1
	 ))
       (( resid 67 and name HB2
	 )) 4.0 2.0 0.8 volume=122089.000 peak=718 ppm1=3.801 ppm2=1.911

assign (( resid 67 and name HD2
	 ))
       (( resid 67 and name HG2
	 )) 3.6 1.8 0.7 volume=213079.250 peak=719 ppm1=3.621 ppm2=1.901

assign (( resid 29 and name HD2
	 ))
       (( resid 29 and name HB2
	 )) 3.3 1.6 0.7 volume=365687.250 peak=720 ppm1=3.587 ppm2=1.931

assign (( resid 29 and name HD2
	 ))
       (( resid 29 and name HG2
	 ) or ( resid 29 and name HG1
	 )) 3.6 1.8 0.7 volume=236054.000 peak=721 ppm1=3.588 ppm2=2.000

assign (( resid 29 and name HD2
	 ))
       (( resid 29 and name HB1
	 )) 4.5 2.3 0.9 volume=59983.500 peak=722 ppm1=3.587 ppm2=2.229

assign (( resid 29 and name HB1
	 ))
       (( resid 29 and name HA
	 )) 3.3 1.5 0.7 volume=412549.750 peak=723 ppm1=2.234 ppm2=4.470

assign (( resid 25 and name HN
	 ))
       (( resid 25 and name HA
	 )) 4.6 2.3 0.9 volume=56126.000 peak=724 ppm1=8.447 ppm2=4.729

assign (( resid 16 and name HE22
	 ))
       (( resid 16 and name HG2
	 )) 4.3 2.2 0.9 volume=75900.500 peak=725 ppm1=6.726 ppm2=2.391

assign (( resid 27 and name HD22
	 ))
       (( resid 27 and name HD21
	 )) 2.0 0.3 0.4 volume=7868771.250 peak=726 ppm1=7.466 ppm2=6.849

assign (( resid 66 and name HN
	 ))
       (( resid 66 and name HG2
	 )) 4.3 2.2 0.9 volume=77795.500 peak=727 ppm1=8.236 ppm2=1.417

assign (( resid 58 and name HD1%
	 ))
       (( resid 58 and name HG
	 )) 3.1 1.4 0.6 volume=515269.500 peak=728 ppm1=0.800 ppm2=1.558

assign (( resid 58 and name HG
	 ))
       (( resid 58 and name HD1%
	 )) 3.4 1.7 0.7 volume=319742.500 peak=729 ppm1=1.552 ppm2=0.800

assign (( resid 58 and name HG
	 ))
       (( resid 58 and name HD2%
	 )) 3.4 1.7 0.7 volume=332911.250 peak=730 ppm1=1.552 ppm2=0.839

assign (( resid 22 and name HD2
	 ))
       (( resid 65 and name HD1%
	 )) 4.0 2.0 0.8 volume=118994.750 peak=731 ppm1=3.263 ppm2=0.871

assign (( resid 67 and name HD2
	 ))
       (( resid 66 and name HB1
	 ) or ( resid 66 and name HB2
	 )) 4.1 2.1 0.8 volume=99890.750 peak=732 ppm1=3.620 ppm2=1.795

assign (( resid 58 and name HD2%
	 ))
       (( resid 18 and name HG2%
	 )) 3.2 1.5 0.6 volume=427694.000 peak=733 ppm1=0.840 ppm2=1.105

assign (( resid 18 and name HG1%
	 ))
       (( resid 19 and name HA
	 )) 3.7 1.9 0.7 volume=188428.500 peak=734 ppm1=0.918 ppm2=4.787

assign (( resid 9 and name HB%
	 ) or (resid 14 and name HB%
	 ))
       (( resid 10 and name HG2
	 ) or ( resid 10 and name HG1
	 )) 3.9 2.0 0.8 volume=135159.750 peak=735 ppm1=1.440 ppm2=2.552

assign (( resid 48 and name HB2
	 ))
       (( resid 6 and name HD1%
	 ) or ( resid 58 and name HD2%
	 )) 3.8 1.9 0.8 volume=165399.500 peak=736 ppm1=3.244 ppm2=0.843

assign (( resid 53 and name HB2
	 ))
       (( resid 53 and name HA
	 )) 3.2 1.5 0.6 volume=447495.750 peak=737 ppm1=3.170 ppm2=4.837

assign (( resid 53 and name HB2
	 ))
       (( resid 48 and name HA
	 )) 3.4 1.6 0.7 volume=353934.000 peak=738 ppm1=3.169 ppm2=4.815

assign (( resid 18 and name HN
	 ))
       (( resid 20 and name HN
	 )) 4.1 2.1 0.8 volume=102899.250 peak=739 ppm1=8.288 ppm2=7.816

assign (( resid 54 and name HN
	 ))
       (( resid 57 and name HN
	 )) 4.1 2.1 0.8 volume=100435.000 peak=740 ppm1=8.281 ppm2=7.805

assign (( resid 55 and name HA
	 ))
       (( resid 58 and name HB2
	 )) 3.7 1.8 0.7 volume=203387.000 peak=741 ppm1=4.017 ppm2=1.792

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