*HEADER    HORMONE                                 31-MAY-19   6RVA              
*TITLE     STRUCTURE OF [ASP58]-IGF-I ANALOGUE                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INSULIN-LIKE GROWTH FACTOR I;                              
*COMPND   3 CHAIN: X;                                                            
*COMPND   4 SYNONYM: IGF-I,MECHANO GROWTH FACTOR,MGF,SOMATOMEDIN-C;              
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: IGF1, IBP1;                                                    
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    IGF-I ANALOGUE, HORMONE                                               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    J.JIRACEK,L.ZAKOVA,O.SOCHA                                            
*REVDAT   1   02-OCT-19 6RVA    0                                                
# Restraints file 1: coupling_komplet.tbl
!!j coupling data sidechain
assign (resid  19 and name HA )
       (resid  19 and name CA  ) 
       (resid  19 and name CB )
       (resid  19 and name HB2 )  12.0 1.0
assign (resid  48 and name HA )
       (resid  48 and name CA  ) 
       (resid  48 and name CB )
       (resid  48 and name HB2 )  12.0 1.0
assign (resid  49 and name HA )
       (resid  49 and name CA  ) 
       (resid  49 and name CB )
       (resid  49 and name HB1 )  12.0 1.0
assign (resid  12 and name HA  )
       (resid  12 and name CA   ) 
       (resid  12 and name CB  )
       (resid  12 and name HB )  10.0 1.0
assign (resid  61 and name HA  )
       (resid  61 and name CA   ) 
       (resid  61 and name CB  )
       (resid  61 and name HB2 )  10.0 1.0
assign (resid  50 and name HA  )
       (resid  50 and name CA   ) 
       (resid  50 and name CB  )
       (resid  50 and name HB2 )  10.0 1.0

!!j coupling data HN-HA
assign (resid  49 and name HN )
       (resid  49 and name N  ) 
       (resid  49 and name CA )
       (resid  49 and name HA )  10.0 1.0
assign (resid  48 and name HN )
       (resid  48 and name N  ) 
       (resid  48 and name CA )
       (resid  48 and name HA )  10.0 1.0
assign (resid  51 and name HN )
       (resid  51 and name N  ) 
       (resid  51 and name CA )
       (resid  51 and name HA )  9.0 1.0
assign (resid  61 and name HN )
       (resid  61 and name N  ) 
       (resid  61 and name CA )
       (resid  61 and name HA )  9.0 1.0

# Restraints file 2: dih.tbl
! REMARK  error margins are set to conservative default values of double the standard deviation 
!         observed in TALOS-N, capped at a minimum of +/-20 degree.

! REMARK Phi/Psi Angles From 'Strong' Predictions 
assign (resid    8 and name C    ) (resid    9 and name N    )
       (resid    9 and name CA   ) (resid    9 and name C    )    1.0  -62.6   20.0 2
assign (resid    9 and name N    ) (resid    9 and name CA   )
       (resid    9 and name C    ) (resid   10 and name N    )    1.0  -38.2   20.0 2
assign (resid    9 and name C    ) (resid   10 and name N    )
       (resid   10 and name CA   ) (resid   10 and name C    )    1.0  -67.0   20.0 2
assign (resid   10 and name N    ) (resid   10 and name CA   )
       (resid   10 and name C    ) (resid   11 and name N    )    1.0  -34.9   20.0 2
assign (resid   10 and name C    ) (resid   11 and name N    )
       (resid   11 and name CA   ) (resid   11 and name C    )    1.0  -68.4   20.0 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
       (resid   11 and name C    ) (resid   12 and name N    )    1.0  -41.8   20.0 2
assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )    1.0  -61.5   20.0 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )    1.0  -42.3   20.0 2
assign (resid   12 and name C    ) (resid   13 and name N    )
       (resid   13 and name CA   ) (resid   13 and name C    )    1.0  -67.8   20.0 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name C    ) (resid   14 and name N    )    1.0  -34.5   20.0 2
assign (resid   13 and name C    ) (resid   14 and name N    )
       (resid   14 and name CA   ) (resid   14 and name C    )    1.0  -66.3   20.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name C    ) (resid   15 and name N    )    1.0  -40.6   20.0 2
assign (resid   14 and name C    ) (resid   15 and name N    )
       (resid   15 and name CA   ) (resid   15 and name C    )    1.0  -66.3   20.0 2
assign (resid   15 and name N    ) (resid   15 and name CA   )
       (resid   15 and name C    ) (resid   16 and name N    )    1.0  -35.7   20.0 2
assign (resid   15 and name C    ) (resid   16 and name N    )
       (resid   16 and name CA   ) (resid   16 and name C    )    1.0  -64.8   20.0 2
assign (resid   16 and name N    ) (resid   16 and name CA   )
       (resid   16 and name C    ) (resid   17 and name N    )    1.0  -34.9   20.0 2
assign (resid   16 and name C    ) (resid   17 and name N    )
       (resid   17 and name CA   ) (resid   17 and name C    )    1.0  -69.9   20.0 2
assign (resid   17 and name N    ) (resid   17 and name CA   )
       (resid   17 and name C    ) (resid   18 and name N    )    1.0  -36.2   22.4 2
assign (resid   44 and name C    ) (resid   45 and name N    )
       (resid   45 and name CA   ) (resid   45 and name C    )    1.0  -64.2   20.0 2
assign (resid   45 and name N    ) (resid   45 and name CA   )
       (resid   45 and name C    ) (resid   46 and name N    )    1.0  -39.6   20.0 2
assign (resid   45 and name C    ) (resid   46 and name N    )
       (resid   46 and name CA   ) (resid   46 and name C    )    1.0  -67.8   20.0 2
assign (resid   46 and name N    ) (resid   46 and name CA   )
       (resid   46 and name C    ) (resid   47 and name N    )    1.0  -36.1   20.0 2
assign (resid   46 and name C    ) (resid   47 and name N    )
       (resid   47 and name CA   ) (resid   47 and name C    )    1.0  -71.8   20.0 2
assign (resid   47 and name N    ) (resid   47 and name CA   )
       (resid   47 and name C    ) (resid   48 and name N    )    1.0  -27.9   20.0 2
assign (resid   54 and name C    ) (resid   55 and name N    )
       (resid   55 and name CA   ) (resid   55 and name C    )    1.0  -58.7   20.0 2
assign (resid   55 and name N    ) (resid   55 and name CA   )
       (resid   55 and name C    ) (resid   56 and name N    )    1.0  -34.0   20.0 2
assign (resid   55 and name C    ) (resid   56 and name N    )
       (resid   56 and name CA   ) (resid   56 and name C    )    1.0  -67.6   20.0 2
assign (resid   56 and name N    ) (resid   56 and name CA   )
       (resid   56 and name C    ) (resid   57 and name N    )    1.0  -30.3   20.0 2
assign (resid   56 and name C    ) (resid   57 and name N    )
       (resid   57 and name CA   ) (resid   57 and name C    )    1.0  -71.1   20.0 2
assign (resid   57 and name N    ) (resid   57 and name CA   )
       (resid   57 and name C    ) (resid   58 and name N    )    1.0  -33.4   25.3 2
assign (resid   57 and name C    ) (resid   58 and name N    )
       (resid   58 and name CA   ) (resid   58 and name C    )    1.0  -66.5   20.0 2
assign (resid   58 and name N    ) (resid   58 and name CA   )
       (resid   58 and name C    ) (resid   59 and name N    )    1.0  -37.8   20.0 2
assign (resid   58 and name C    ) (resid   59 and name N    )
       (resid   59 and name CA   ) (resid   59 and name C    )    1.0  -67.6   20.0 2
assign (resid   59 and name N    ) (resid   59 and name CA   )
       (resid   59 and name C    ) (resid   60 and name N    )    1.0  -26.0   20.0 2
assign (resid   59 and name C    ) (resid   60 and name N    )
       (resid   60 and name CA   ) (resid   60 and name C    )    1.0  -71.7   20.0 2
assign (resid   60 and name N    ) (resid   60 and name CA   )
       (resid   60 and name C    ) (resid   61 and name N    )    1.0  -24.4   20.0 2

! Jcoupling converted
assign (resid  45 and name N     ) (resid  45 and name CA    )
       (resid  45 and name CB    ) (resid  45 and name CG1   )   1.0  180.0   20.0 2
assign (resid  62 and name N     ) (resid  62 and name CA    )   
       (resid  62 and name CB    ) (resid  62 and name SG    )   1.0  -60.0   20.0 2
assign (resid  53 and name N     ) (resid  53 and name CA    )   
       (resid  53 and name CB    ) (resid  53 and name SG    )   1.0  60.0   20.0 2
# 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

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1  32.208 -19.438  13.814
    2    H2   GLY   1           HT2      GLY   1  33.425 -18.300  14.146
    3    H3   GLY   1           HT3      GLY   1  31.793 -17.826  14.140
    4    HA2  GLY   1           HA2      GLY   1  31.642 -18.252  16.291
    5    HA3  GLY   1           HA1      GLY   1  32.035 -19.938  15.948
    6    H    GLY   2           HN       GLY   2  33.622 -16.752  16.217
    7    HA2  GLY   2           HA2      GLY   2  36.176 -17.947  16.871
    8    HA3  GLY   2           HA1      GLY   2  35.805 -16.226  16.825
    9    HA   PRO   3           HA       PRO   3  35.999 -17.762  21.265
   10    HB2  PRO   3           HB2      PRO   3  38.260 -16.434  22.024
   11    HB3  PRO   3           HB1      PRO   3  38.283 -18.064  21.325
   12    HG2  PRO   3           HG2      PRO   3  38.900 -15.451  20.056
   13    HG3  PRO   3           HG1      PRO   3  39.648 -17.036  19.807
   14    HD2  PRO   3           HD2      PRO   3  37.791 -15.915  18.090
   15    HD3  PRO   3           HD1      PRO   3  38.102 -17.660  18.224
   16    H    GLU   4           HN       GLU   4  34.094 -16.177  20.871
   17    HA   GLU   4           HA       GLU   4  32.907 -14.331  21.549
   18    HB2  GLU   4           HB2      GLU   4  35.186 -14.028  23.521
   19    HB3  GLU   4           HB1      GLU   4  33.594 -13.279  23.644
   20    HG2  GLU   4           HG2      GLU   4  34.075 -16.269  23.547
   21    HG3  GLU   4           HG1      GLU   4  33.802 -15.352  25.027
   22    H    THR   5           HN       THR   5  34.385 -13.905  19.299
   23    HA   THR   5           HA       THR   5  35.309 -11.118  19.661
   24    HB   THR   5           HB       THR   5  36.974 -11.501  17.887
   25    HG1  THR   5           HG1      THR   5  36.782 -13.213  16.721
   26   HG21  THR   5          HG21      THR   5  37.440 -11.918  20.368
   27   HG22  THR   5          HG22      THR   5  38.546 -12.686  19.229
   28   HG23  THR   5          HG23      THR   5  37.278 -13.635  20.001
   29    H    LEU   6           HN       LEU   6  35.106  -9.785  17.713
   30    HA   LEU   6           HA       LEU   6  32.724 -10.572  16.159
   31    HB2  LEU   6           HB2      LEU   6  33.925  -7.826  16.603
   32    HB3  LEU   6           HB1      LEU   6  32.411  -8.179  15.771
   33    HG   LEU   6           HG       LEU   6  32.985  -8.874  18.665
   34   HD11  LEU   6          HD11      LEU   6  32.774  -6.386  18.065
   35   HD12  LEU   6          HD12      LEU   6  31.652  -6.997  19.281
   36   HD13  LEU   6          HD13      LEU   6  31.104  -6.744  17.624
   37   HD21  LEU   6          HD21      LEU   6  30.555  -9.123  16.874
   38   HD22  LEU   6          HD22      LEU   6  30.437  -9.163  18.633
   39   HD23  LEU   6          HD23      LEU   6  31.365 -10.398  17.784
   40    H    CYS   7           HN       CYS   7  33.022 -11.164  14.118
   41    HA   CYS   7           HA       CYS   7  34.840  -9.756  12.378
   42    HB2  CYS   7           HB2      CYS   7  36.350 -11.354  13.563
   43    HB3  CYS   7           HB1      CYS   7  35.381 -12.681  12.921
   44    H    GLY   8           HN       GLY   8  34.148  -9.869  10.304
   45    HA2  GLY   8           HA2      GLY   8  33.185 -10.961   8.418
   46    HA3  GLY   8           HA1      GLY   8  32.353 -12.060   9.514
   47    H    ALA   9           HN       ALA   9  30.313 -11.695   8.647
   48    HA   ALA   9           HA       ALA   9  29.175  -9.182   8.110
   49    HB1  ALA   9           HB1      ALA   9  27.831 -11.779   8.898
   50    HB2  ALA   9           HB2      ALA   9  28.190 -11.242   7.257
   51    HB3  ALA   9           HB3      ALA   9  27.002 -10.373   8.228
   52    H    GLU  10           HN       GLU  10  29.277 -11.127  11.060
   53    HA   GLU  10           HA       GLU  10  27.453  -9.634  12.596
   54    HB2  GLU  10           HB2      GLU  10  29.865 -11.279  13.376
   55    HB3  GLU  10           HB1      GLU  10  28.760 -10.570  14.553
   56    HG2  GLU  10           HG2      GLU  10  26.895 -11.816  13.652
   57    HG3  GLU  10           HG1      GLU  10  27.875 -12.398  12.306
   58    H    LEU  11           HN       LEU  11  30.936  -9.244  12.053
   59    HA   LEU  11           HA       LEU  11  31.380  -7.189  13.927
   60    HB2  LEU  11           HB2      LEU  11  33.217  -8.388  12.868
   61    HB3  LEU  11           HB1      LEU  11  32.768  -7.738  11.292
   62    HG   LEU  11           HG       LEU  11  33.174  -5.436  12.157
   63   HD11  LEU  11          HD11      LEU  11  33.975  -6.977  14.631
   64   HD12  LEU  11          HD12      LEU  11  32.761  -5.705  14.500
   65   HD13  LEU  11          HD13      LEU  11  34.473  -5.311  14.341
   66   HD21  LEU  11          HD21      LEU  11  34.996  -6.412  10.986
   67   HD22  LEU  11          HD22      LEU  11  35.403  -7.471  12.336
   68   HD23  LEU  11          HD23      LEU  11  35.693  -5.735  12.454
   69    H    VAL  12           HN       VAL  12  30.520  -7.061  10.479
   70    HA   VAL  12           HA       VAL  12  30.543  -4.275  10.217
   71    HB   VAL  12           HB       VAL  12  29.113  -6.466   8.727
   72   HG11  VAL  12          HG11      VAL  12  28.609  -4.601   7.036
   73   HG12  VAL  12          HG12      VAL  12  28.978  -3.453   8.323
   74   HG13  VAL  12          HG13      VAL  12  27.624  -4.568   8.501
   75   HG21  VAL  12          HG21      VAL  12  31.220  -4.486   7.821
   76   HG22  VAL  12          HG22      VAL  12  30.735  -5.991   7.037
   77   HG23  VAL  12          HG23      VAL  12  31.623  -6.037   8.559
   78    H    ASP  13           HN       ASP  13  27.977  -6.517  11.160
   79    HA   ASP  13           HA       ASP  13  25.848  -4.688  11.250
   80    HB2  ASP  13           HB2      ASP  13  25.618  -7.170  11.376
   81    HB3  ASP  13           HB1      ASP  13  26.254  -7.111  13.019
   82    H    ALA  14           HN       ALA  14  28.236  -5.630  13.698
   83    HA   ALA  14           HA       ALA  14  27.148  -4.175  15.852
   84    HB1  ALA  14           HB1      ALA  14  29.083  -5.933  15.781
   85    HB2  ALA  14           HB2      ALA  14  29.122  -4.642  16.983
   86    HB3  ALA  14           HB3      ALA  14  30.107  -4.520  15.526
   87    H    LEU  15           HN       LEU  15  29.413  -3.268  13.290
   88    HA   LEU  15           HA       LEU  15  30.116  -0.726  14.290
   89    HB2  LEU  15           HB2      LEU  15  30.023  -1.854  11.488
   90    HB3  LEU  15           HB1      LEU  15  30.630  -0.237  11.847
   91    HG   LEU  15           HG       LEU  15  31.681  -2.684  13.277
   92   HD11  LEU  15          HD11      LEU  15  33.453  -2.842  11.665
   93   HD12  LEU  15          HD12      LEU  15  32.934  -1.365  10.853
   94   HD13  LEU  15          HD13      LEU  15  31.949  -2.824  10.745
   95   HD21  LEU  15          HD21      LEU  15  32.174  -0.536  14.330
   96   HD22  LEU  15          HD22      LEU  15  32.712   0.131  12.789
   97   HD23  LEU  15          HD23      LEU  15  33.646  -1.142  13.571
   98    H    GLN  16           HN       GLN  16  27.480  -1.781  12.171
   99    HA   GLN  16           HA       GLN  16  26.468   0.797  11.583
  100    HB2  GLN  16           HB2      GLN  16  25.158  -1.924  11.628
  101    HB3  GLN  16           HB1      GLN  16  24.343  -0.462  11.070
  102    HG2  GLN  16           HG2      GLN  16  25.966  -0.132   9.324
  103    HG3  GLN  16           HG1      GLN  16  26.989  -1.421   9.957
  104   HE21  GLN  16          HE21      GLN  16  25.716  -1.257   7.252
  105   HE22  GLN  16          HE22      GLN  16  24.743  -2.642   7.124
  106    H    PHE  17           HN       PHE  17  25.743  -1.542  14.145
  107    HA   PHE  17           HA       PHE  17  23.604  -0.113  15.327
  108    HB2  PHE  17           HB2      PHE  17  23.854  -2.390  15.930
  109    HB3  PHE  17           HB1      PHE  17  25.538  -2.165  16.403
  110    HD1  PHE  17           HD1      PHE  17  22.011  -1.464  17.334
  111    HD2  PHE  17           HD2      PHE  17  26.136  -1.234  18.543
  112    HE1  PHE  17           HE1      PHE  17  21.304  -0.924  19.651
  113    HE2  PHE  17           HE2      PHE  17  25.421  -0.702  20.860
  114    HZ   PHE  17           HZ       PHE  17  23.009  -0.547  21.413
  115    H    VAL  18           HN       VAL  18  27.063  -0.248  16.176
  116    HA   VAL  18           HA       VAL  18  26.918   1.560  18.325
  117    HB   VAL  18           HB       VAL  18  29.217   0.851  16.488
  118   HG11  VAL  18          HG11      VAL  18  30.629   1.757  18.351
  119   HG12  VAL  18          HG12      VAL  18  29.162   2.388  19.096
  120   HG13  VAL  18          HG13      VAL  18  29.685   2.999  17.527
  121   HG21  VAL  18          HG21      VAL  18  28.663  -0.018  19.337
  122   HG22  VAL  18          HG22      VAL  18  29.860  -0.680  18.222
  123   HG23  VAL  18          HG23      VAL  18  28.141  -0.951  17.933
  124    H    CYS  19           HN       CYS  19  27.809   2.095  14.923
  125    HA   CYS  19           HA       CYS  19  28.206   4.897  15.209
  126    HB2  CYS  19           HB2      CYS  19  27.589   3.257  12.739
  127    HB3  CYS  19           HB1      CYS  19  28.193   4.912  12.747
  128    H    GLY  20           HN       GLY  20  25.458   2.912  14.272
  129    HA2  GLY  20           HA2      GLY  20  23.196   3.490  14.614
  130    HA3  GLY  20           HA1      GLY  20  23.675   5.179  14.753
  131    H    ASP  21           HN       ASP  21  21.720   5.293  13.262
  132    HA   ASP  21           HA       ASP  21  21.841   4.407  10.587
  133    HB2  ASP  21           HB2      ASP  21  19.824   5.330  11.859
  134    HB3  ASP  21           HB1      ASP  21  20.459   6.932  11.487
  135    H    ARG  22           HN       ARG  22  23.634   6.813  12.205
  136    HA   ARG  22           HA       ARG  22  24.010   8.735  10.201
  137    HB2  ARG  22           HB2      ARG  22  25.887   7.780  12.377
  138    HB3  ARG  22           HB1      ARG  22  26.138   9.231  11.406
  139    HG2  ARG  22           HG2      ARG  22  23.902  10.064  12.184
  140    HG3  ARG  22           HG1      ARG  22  23.812   8.675  13.266
  141    HD2  ARG  22           HD2      ARG  22  24.680  10.512  14.555
  142    HD3  ARG  22           HD1      ARG  22  26.023   9.412  14.242
  143    HE   ARG  22           HE       ARG  22  27.010  11.069  12.945
  144   HH11  ARG  22          HH11      ARG  22  23.641  11.788  13.512
  145   HH12  ARG  22          HH12      ARG  22  23.740  13.377  12.826
  146   HH21  ARG  22          HH21      ARG  22  27.106  13.158  12.048
  147   HH22  ARG  22          HH22      ARG  22  25.683  14.145  12.004
  148    H    GLY  23           HN       GLY  23  25.600   5.635  10.807
  149    HA2  GLY  23           HA2      GLY  23  26.513   4.292   9.066
  150    HA3  GLY  23           HA1      GLY  23  26.721   5.743   8.091
  151    H    PHE  24           HN       PHE  24  28.884   4.541   7.889
  152    HA   PHE  24           HA       PHE  24  30.802   5.912   9.571
  153    HB2  PHE  24           HB2      PHE  24  31.996   3.811  10.182
  154    HB3  PHE  24           HB1      PHE  24  30.417   3.978  10.944
  155    HD1  PHE  24           HD1      PHE  24  32.376   2.179   8.408
  156    HD2  PHE  24           HD2      PHE  24  28.529   2.592  10.266
  157    HE1  PHE  24           HE1      PHE  24  31.653   0.043   7.396
  158    HE2  PHE  24           HE2      PHE  24  27.810   0.456   9.256
  159    HZ   PHE  24           HZ       PHE  24  29.367  -0.821   7.821
  160    H    TYR  25           HN       TYR  25  33.079   5.384   8.863
  161    HA   TYR  25           HA       TYR  25  33.190   4.576   6.030
  162    HB2  TYR  25           HB2      TYR  25  34.530   6.503   5.452
  163    HB3  TYR  25           HB1      TYR  25  33.035   7.072   6.196
  164    HD1  TYR  25           HD1      TYR  25  36.665   6.649   6.634
  165    HD2  TYR  25           HD2      TYR  25  33.026   8.028   8.449
  166    HE1  TYR  25           HE1      TYR  25  37.980   7.819   8.371
  167    HE2  TYR  25           HE2      TYR  25  34.338   9.208  10.189
  168    HH   TYR  25           HH       TYR  25  37.397   8.589  10.918
  169    H    PHE  26           HN       PHE  26  35.487   4.288   5.299
  170    HA   PHE  26           HA       PHE  26  37.062   3.095   7.495
  171    HB2  PHE  26           HB2      PHE  26  37.061   2.485   4.526
  172    HB3  PHE  26           HB1      PHE  26  38.101   1.707   5.718
  173    HD1  PHE  26           HD1      PHE  26  34.682   2.002   4.415
  174    HD2  PHE  26           HD2      PHE  26  37.165   0.197   7.417
  175    HE1  PHE  26           HE1      PHE  26  32.868   0.397   4.949
  176    HE2  PHE  26           HE2      PHE  26  35.352  -1.408   7.952
  177    HZ   PHE  26           HZ       PHE  26  33.203  -1.308   6.718
  178    H    ASN  27           HN       ASN  27  39.184   3.617   7.768
  179    HA   ASN  27           HA       ASN  27  40.074   6.130   6.720
  180    HB2  ASN  27           HB2      ASN  27  41.426   4.029   8.418
  181    HB3  ASN  27           HB1      ASN  27  42.192   5.550   7.965
  182   HD21  ASN  27          HD21      ASN  27  41.557   4.831  10.711
  183   HD22  ASN  27          HD22      ASN  27  40.394   5.935  11.267
  184    H    LYS  28           HN       LYS  28  42.002   6.498   5.493
  185    HA   LYS  28           HA       LYS  28  42.202   4.824   3.228
  186    HB2  LYS  28           HB2      LYS  28  43.924   7.102   4.211
  187    HB3  LYS  28           HB1      LYS  28  44.193   6.286   2.670
  188    HG2  LYS  28           HG2      LYS  28  41.858   6.823   2.008
  189    HG3  LYS  28           HG1      LYS  28  41.655   7.707   3.520
  190    HD2  LYS  28           HD2      LYS  28  43.827   8.343   1.507
  191    HD3  LYS  28           HD1      LYS  28  42.257   9.148   1.524
  192    HE2  LYS  28           HE2      LYS  28  42.674   9.818   3.895
  193    HE3  LYS  28           HE1      LYS  28  44.285   9.111   3.778
  194    HZ1  LYS  28           HZ1      LYS  28  44.754  10.616   1.933
  195    HZ2  LYS  28           HZ2      LYS  28  44.367  11.469   3.351
  196    HZ3  LYS  28           HZ3      LYS  28  43.221  11.321   2.106
  197    HA   PRO  29           HA       PRO  29  45.237   1.872   4.507
  198    HB2  PRO  29           HB2      PRO  29  46.584   1.456   2.156
  199    HB3  PRO  29           HB1      PRO  29  44.962   0.816   2.482
  200    HG2  PRO  29           HG2      PRO  29  45.774   3.213   0.916
  201    HG3  PRO  29           HG1      PRO  29  44.512   2.016   0.578
  202    HD2  PRO  29           HD2      PRO  29  43.966   4.465   1.616
  203    HD3  PRO  29           HD1      PRO  29  42.983   3.030   1.977
  204    H    THR  30           HN       THR  30  46.200   4.900   3.135
  205    HA   THR  30           HA       THR  30  48.739   4.763   4.604
  206    HB   THR  30           HB       THR  30  49.225   4.133   2.248
  207    HG1  THR  30           HG1      THR  30  50.953   5.120   2.935
  208   HG21  THR  30          HG21      THR  30  48.257   6.931   1.605
  209   HG22  THR  30          HG22      THR  30  47.337   5.464   1.270
  210   HG23  THR  30          HG23      THR  30  48.881   5.739   0.465
  211    H    GLY  31           HN       GLY  31  49.575   6.801   5.201
  212    HA2  GLY  31           HA2      GLY  31  47.983   9.178   4.567
  213    HA3  GLY  31           HA1      GLY  31  48.089   8.702   6.259
  214    H    TYR  32           HN       TYR  32  49.981   9.030   7.394
  215    HA   TYR  32           HA       TYR  32  52.245  10.232   5.941
  216    HB2  TYR  32           HB2      TYR  32  50.952  12.096   6.836
  217    HB3  TYR  32           HB1      TYR  32  50.948  11.354   8.436
  218    HD1  TYR  32           HD1      TYR  32  53.177  12.749   5.793
  219    HD2  TYR  32           HD2      TYR  32  52.781  11.621   9.919
  220    HE1  TYR  32           HE1      TYR  32  55.364  13.808   6.293
  221    HE2  TYR  32           HE2      TYR  32  54.967  12.680  10.419
  222    HH   TYR  32           HH       TYR  32  57.154  13.606   8.007
  223    H    GLY  33           HN       GLY  33  54.143   9.382   6.518
  224    HA2  GLY  33           HA2      GLY  33  55.787   8.561   7.987
  225    HA3  GLY  33           HA1      GLY  33  54.546   8.330   9.215
  226    H    SER  34           HN       SER  34  56.145   6.284   9.081
  227    HA   SER  34           HA       SER  34  54.830   4.285   7.344
  228    HB2  SER  34           HB2      SER  34  56.900   2.969   7.555
  229    HB3  SER  34           HB1      SER  34  57.221   4.559   6.869
  230    HG   SER  34           HG       SER  34  58.606   3.771   8.677
  231    H    SER  35           HN       SER  35  55.034   5.378  10.520
  232    HA   SER  35           HA       SER  35  55.135   2.989  11.993
  233    HB2  SER  35           HB2      SER  35  54.218   4.313  13.801
  234    HB3  SER  35           HB1      SER  35  55.397   5.282  12.920
  235    HG   SER  35           HG       SER  35  53.030   6.023  13.455
  236    H    SER  36           HN       SER  36  52.494   4.710  10.409
  237    HA   SER  36           HA       SER  36  50.375   3.200  11.523
  238    HB2  SER  36           HB2      SER  36  49.030   4.101   9.683
  239    HB3  SER  36           HB1      SER  36  50.027   5.365  10.399
  240    HG   SER  36           HG       SER  36  50.107   4.232   7.893
  241    H    ARG  37           HN       ARG  37  52.404   2.760   8.718
  242    HA   ARG  37           HA       ARG  37  50.982   0.643   7.503
  243    HB2  ARG  37           HB2      ARG  37  52.770   1.886   6.347
  244    HB3  ARG  37           HB1      ARG  37  53.962   1.182   7.440
  245    HG2  ARG  37           HG2      ARG  37  53.377  -1.073   6.661
  246    HG3  ARG  37           HG1      ARG  37  52.141  -0.398   5.598
  247    HD2  ARG  37           HD2      ARG  37  53.855   0.848   4.367
  248    HD3  ARG  37           HD1      ARG  37  55.100   0.226   5.445
  249    HE   ARG  37           HE       ARG  37  53.708  -1.951   4.308
  250   HH11  ARG  37          HH11      ARG  37  55.881   0.637   3.445
  251   HH12  ARG  37          HH12      ARG  37  56.599  -0.241   2.136
  252   HH21  ARG  37          HH21      ARG  37  54.666  -3.080   2.589
  253   HH22  ARG  37          HH22      ARG  37  55.917  -2.330   1.654
  254    H    ARG  38           HN       ARG  38  53.607   0.654   9.889
  255    HA   ARG  38           HA       ARG  38  53.952  -2.138  10.064
  256    HB2  ARG  38           HB2      ARG  38  55.550  -0.499  10.998
  257    HB3  ARG  38           HB1      ARG  38  54.361  -0.057  12.224
  258    HG2  ARG  38           HG2      ARG  38  54.353  -2.369  13.067
  259    HG3  ARG  38           HG1      ARG  38  55.528  -2.827  11.833
  260    HD2  ARG  38           HD2      ARG  38  57.148  -1.227  12.768
  261    HD3  ARG  38           HD1      ARG  38  55.976  -0.748  13.994
  262    HE   ARG  38           HE       ARG  38  57.566  -3.166  13.978
  263   HH11  ARG  38          HH11      ARG  38  54.654  -1.603  15.106
  264   HH12  ARG  38          HH12      ARG  38  54.498  -2.632  16.492
  265   HH21  ARG  38          HH21      ARG  38  57.329  -4.500  15.801
  266   HH22  ARG  38          HH22      ARG  38  55.996  -4.258  16.881
  267    H    ALA  39           HN       ALA  39  51.867   0.092  11.871
  268    HA   ALA  39           HA       ALA  39  50.774  -1.959  13.543
  269    HB1  ALA  39           HB1      ALA  39  48.969  -0.006  13.822
  270    HB2  ALA  39           HB2      ALA  39  50.262   0.942  13.088
  271    HB3  ALA  39           HB3      ALA  39  50.553   0.073  14.594
  272    HA   PRO  40           HA       PRO  40  47.533  -3.430  10.943
  273    HB2  PRO  40           HB2      PRO  40  45.534  -3.924  12.741
  274    HB3  PRO  40           HB1      PRO  40  47.004  -4.911  12.629
  275    HG2  PRO  40           HG2      PRO  40  46.291  -2.794  14.585
  276    HG3  PRO  40           HG1      PRO  40  47.177  -4.309  14.823
  277    HD2  PRO  40           HD2      PRO  40  48.380  -1.836  14.608
  278    HD3  PRO  40           HD1      PRO  40  49.189  -3.374  14.241
  279    H    GLN  41           HN       GLN  41  47.568  -0.901  10.340
  280    HA   GLN  41           HA       GLN  41  44.947   0.288  10.935
  281    HB2  GLN  41           HB2      GLN  41  47.394   1.495   9.623
  282    HB3  GLN  41           HB1      GLN  41  45.894   2.353   9.980
  283    HG2  GLN  41           HG2      GLN  41  47.688   1.015  12.025
  284    HG3  GLN  41           HG1      GLN  41  47.576   2.751  11.741
  285   HE21  GLN  41          HE21      GLN  41  46.567   0.536  13.920
  286   HE22  GLN  41          HE22      GLN  41  45.064   1.194  14.352
  287    H    THR  42           HN       THR  42  45.842  -1.926   8.898
  288    HA   THR  42           HA       THR  42  45.410  -0.946   6.305
  289    HB   THR  42           HB       THR  42  44.844  -3.697   7.431
  290    HG1  THR  42           HG1      THR  42  46.971  -3.309   7.660
  291   HG21  THR  42          HG21      THR  42  43.705  -3.409   5.314
  292   HG22  THR  42          HG22      THR  42  45.147  -4.385   5.036
  293   HG23  THR  42          HG23      THR  42  45.139  -2.678   4.595
  294    H    GLY  43           HN       GLY  43  43.169  -2.308   8.682
  295    HA2  GLY  43           HA2      GLY  43  40.980  -0.764   7.625
  296    HA3  GLY  43           HA1      GLY  43  40.829  -2.485   7.282
  297    H    ILE  44           HN       ILE  44  39.130  -0.822   8.973
  298    HA   ILE  44           HA       ILE  44  39.667  -1.294  11.723
  299    HB   ILE  44           HB       ILE  44  37.365  -0.619  12.096
  300   HG12  ILE  44          HG12      ILE  44  37.042  -0.872   9.087
  301   HG13  ILE  44          HG11      ILE  44  36.354  -1.980  10.269
  302   HG21  ILE  44          HG21      ILE  44  38.554   0.920   9.768
  303   HG22  ILE  44          HG22      ILE  44  39.045   1.110  11.451
  304   HG23  ILE  44          HG23      ILE  44  37.410   1.545  10.955
  305   HD11  ILE  44          HD11      ILE  44  35.667   0.920   9.822
  306   HD12  ILE  44          HD12      ILE  44  35.245   0.085  11.317
  307   HD13  ILE  44          HD13      ILE  44  34.598  -0.480   9.776
  308    H    VAL  45           HN       VAL  45  38.149  -3.163   9.194
  309    HA   VAL  45           HA       VAL  45  36.789  -5.041  10.798
  310    HB   VAL  45           HB       VAL  45  37.916  -5.211   8.006
  311   HG11  VAL  45          HG11      VAL  45  37.884  -7.483   8.813
  312   HG12  VAL  45          HG12      VAL  45  36.422  -7.264   7.850
  313   HG13  VAL  45          HG13      VAL  45  36.328  -7.235   9.609
  314   HG21  VAL  45          HG21      VAL  45  35.607  -4.938   7.349
  315   HG22  VAL  45          HG22      VAL  45  35.959  -3.683   8.537
  316   HG23  VAL  45          HG23      VAL  45  35.056  -5.122   9.013
  317    H    ASP  46           HN       ASP  46  40.026  -5.117   9.355
  318    HA   ASP  46           HA       ASP  46  40.742  -7.659  10.356
  319    HB2  ASP  46           HB2      ASP  46  42.370  -5.289   9.446
  320    HB3  ASP  46           HB1      ASP  46  43.112  -6.797   9.982
  321    H    GLU  47           HN       GLU  47  41.096  -4.391  11.683
  322    HA   GLU  47           HA       GLU  47  42.773  -5.052  13.836
  323    HB2  GLU  47           HB2      GLU  47  42.288  -2.741  13.135
  324    HB3  GLU  47           HB1      GLU  47  40.623  -2.925  13.683
  325    HG2  GLU  47           HG2      GLU  47  41.388  -3.303  15.977
  326    HG3  GLU  47           HG1      GLU  47  43.067  -3.200  15.451
  327    H    CYS  48           HN       CYS  48  39.213  -4.765  13.749
  328    HA   CYS  48           HA       CYS  48  38.857  -5.693  16.435
  329    HB2  CYS  48           HB2      CYS  48  36.912  -5.468  14.128
  330    HB3  CYS  48           HB1      CYS  48  36.479  -5.900  15.777
  331    H    CYS  49           HN       CYS  49  38.665  -7.225  13.250
  332    HA   CYS  49           HA       CYS  49  37.654  -9.711  14.052
  333    HB2  CYS  49           HB2      CYS  49  37.770  -9.007  11.697
  334    HB3  CYS  49           HB1      CYS  49  39.531  -9.086  11.757
  335    H    PHE  50           HN       PHE  50  41.032  -8.658  13.602
  336    HA   PHE  50           HA       PHE  50  42.026 -11.161  14.633
  337    HB2  PHE  50           HB2      PHE  50  43.307  -8.611  13.666
  338    HB3  PHE  50           HB1      PHE  50  44.267  -9.880  14.433
  339    HD1  PHE  50           HD1      PHE  50  41.830  -9.208  11.690
  340    HD2  PHE  50           HD2      PHE  50  44.927 -11.788  13.179
  341    HE1  PHE  50           HE1      PHE  50  41.845 -10.416   9.526
  342    HE2  PHE  50           HE2      PHE  50  44.945 -13.005  11.016
  343    HZ   PHE  50           HZ       PHE  50  43.408 -12.324   9.190
  344    H    ARG  51           HN       ARG  51  42.835  -7.819  15.583
  345    HA   ARG  51           HA       ARG  51  43.354  -8.637  18.301
  346    HB2  ARG  51           HB2      ARG  51  43.357  -5.895  17.025
  347    HB3  ARG  51           HB1      ARG  51  43.926  -6.266  18.653
  348    HG2  ARG  51           HG2      ARG  51  45.600  -7.820  17.722
  349    HG3  ARG  51           HG1      ARG  51  45.037  -7.451  16.091
  350    HD2  ARG  51           HD2      ARG  51  46.979  -6.090  16.512
  351    HD3  ARG  51           HD1      ARG  51  45.569  -5.036  16.536
  352    HE   ARG  51           HE       ARG  51  46.166  -5.975  19.161
  353   HH11  ARG  51          HH11      ARG  51  47.220  -3.768  16.676
  354   HH12  ARG  51          HH12      ARG  51  47.940  -2.661  17.795
  355   HH21  ARG  51          HH21      ARG  51  47.119  -4.508  20.606
  356   HH22  ARG  51          HH22      ARG  51  47.883  -3.075  20.004
  357    H    SER  52           HN       SER  52  42.351  -7.483  20.152
  358    HA   SER  52           HA       SER  52  39.455  -7.363  19.790
  359    HB2  SER  52           HB2      SER  52  40.292  -8.638  21.685
  360    HB3  SER  52           HB1      SER  52  41.200  -7.243  22.262
  361    HG   SER  52           HG       SER  52  39.443  -6.593  23.193
  362    H    CYS  53           HN       CYS  53  38.879  -5.434  18.895
  363    HA   CYS  53           HA       CYS  53  40.091  -2.951  19.808
  364    HB2  CYS  53           HB2      CYS  53  38.729  -1.900  18.090
  365    HB3  CYS  53           HB1      CYS  53  39.524  -3.320  17.414
  366    H    ASP  54           HN       ASP  54  39.197  -1.505  21.170
  367    HA   ASP  54           HA       ASP  54  37.022  -2.331  22.836
  368    HB2  ASP  54           HB2      ASP  54  38.598   0.236  22.638
  369    HB3  ASP  54           HB1      ASP  54  37.304  -0.009  23.810
  370    H    LEU  55           HN       LEU  55  34.997  -1.300  23.112
  371    HA   LEU  55           HA       LEU  55  33.638  -0.670  20.720
  372    HB2  LEU  55           HB2      LEU  55  32.909  -0.244  23.626
  373    HB3  LEU  55           HB1      LEU  55  31.802   0.078  22.291
  374    HG   LEU  55           HG       LEU  55  33.170  -2.593  22.699
  375   HD11  LEU  55          HD11      LEU  55  31.645  -1.962  24.605
  376   HD12  LEU  55          HD12      LEU  55  31.119  -3.386  23.708
  377   HD13  LEU  55          HD13      LEU  55  30.330  -1.833  23.437
  378   HD21  LEU  55          HD21      LEU  55  32.446  -2.377  20.443
  379   HD22  LEU  55          HD22      LEU  55  30.963  -1.546  20.910
  380   HD23  LEU  55          HD23      LEU  55  31.147  -3.270  21.234
  381    H    ARG  56           HN       ARG  56  35.005   1.361  23.282
  382    HA   ARG  56           HA       ARG  56  33.976   3.831  22.423
  383    HB2  ARG  56           HB2      ARG  56  35.067   3.507  24.606
  384    HB3  ARG  56           HB1      ARG  56  36.613   3.257  23.794
  385    HG2  ARG  56           HG2      ARG  56  36.519   5.516  22.854
  386    HG3  ARG  56           HG1      ARG  56  34.934   5.773  23.585
  387    HD2  ARG  56           HD2      ARG  56  35.902   5.499  25.820
  388    HD3  ARG  56           HD1      ARG  56  37.483   5.189  25.111
  389    HE   ARG  56           HE       ARG  56  36.575   7.669  24.154
  390   HH11  ARG  56          HH11      ARG  56  37.533   6.133  27.135
  391   HH12  ARG  56          HH12      ARG  56  38.114   7.602  27.844
  392   HH21  ARG  56          HH21      ARG  56  37.344   9.579  25.106
  393   HH22  ARG  56          HH22      ARG  56  38.009   9.539  26.706
  394    H    ARG  57           HN       ARG  57  37.062   2.215  21.621
  395    HA   ARG  57           HA       ARG  57  38.012   4.220  19.876
  396    HB2  ARG  57           HB2      ARG  57  39.417   2.404  20.897
  397    HB3  ARG  57           HB1      ARG  57  38.645   1.258  19.802
  398    HG2  ARG  57           HG2      ARG  57  39.469   2.421  17.882
  399    HG3  ARG  57           HG1      ARG  57  40.069   3.744  18.881
  400    HD2  ARG  57           HD2      ARG  57  41.807   2.456  19.777
  401    HD3  ARG  57           HD1      ARG  57  41.016   0.935  19.379
  402    HE   ARG  57           HE       ARG  57  41.481   2.083  16.955
  403   HH11  ARG  57          HH11      ARG  57  43.423   1.322  19.749
  404   HH12  ARG  57          HH12      ARG  57  44.868   1.052  18.833
  405   HH21  ARG  57          HH21      ARG  57  43.411   1.720  15.763
  406   HH22  ARG  57          HH22      ARG  57  44.862   1.274  16.598
  407    H    LEU  58           HN       LEU  58  35.992   1.363  19.425
  408    HA   LEU  58           HA       LEU  58  35.982   1.264  16.628
  409    HB2  LEU  58           HB2      LEU  58  34.961  -0.378  18.352
  410    HB3  LEU  58           HB1      LEU  58  33.534   0.654  18.261
  411    HG   LEU  58           HG       LEU  58  33.648   0.381  15.729
  412   HD11  LEU  58          HD11      LEU  58  34.868  -1.839  15.120
  413   HD12  LEU  58          HD12      LEU  58  35.760  -1.585  16.620
  414   HD13  LEU  58          HD13      LEU  58  35.845  -0.386  15.331
  415   HD21  LEU  58          HD21      LEU  58  33.156  -1.983  17.557
  416   HD22  LEU  58          HD22      LEU  58  32.739  -1.998  15.844
  417   HD23  LEU  58          HD23      LEU  58  31.966  -0.841  16.929
  418    H    ASP  59           HN       ASP  59  34.192   3.280  18.865
  419    HA   ASP  59           HA       ASP  59  32.254   4.283  17.086
  420    HB2  ASP  59           HB2      ASP  59  32.309   4.527  19.614
  421    HB3  ASP  59           HB1      ASP  59  33.464   5.835  19.368
  422    H    MET  60           HN       MET  60  35.629   4.913  17.357
  423    HA   MET  60           HA       MET  60  35.753   7.528  16.318
  424    HB2  MET  60           HB2      MET  60  37.721   5.240  16.191
  425    HB3  MET  60           HB1      MET  60  38.084   6.879  15.655
  426    HG2  MET  60           HG2      MET  60  37.667   7.765  17.872
  427    HG3  MET  60           HG1      MET  60  37.114   6.191  18.443
  428    HE1  MET  60           HE1      MET  60  41.273   7.713  17.524
  429    HE2  MET  60           HE2      MET  60  39.703   8.331  17.015
  430    HE3  MET  60           HE3      MET  60  40.454   7.010  16.122
  431    H    TYR  61           HN       TYR  61  35.473   4.386  14.781
  432    HA   TYR  61           HA       TYR  61  35.960   5.351  12.095
  433    HB2  TYR  61           HB2      TYR  61  34.508   2.812  12.835
  434    HB3  TYR  61           HB1      TYR  61  35.456   3.162  11.396
  435    HD1  TYR  61           HD1      TYR  61  35.609   1.358  14.330
  436    HD2  TYR  61           HD2      TYR  61  37.939   4.159  12.061
  437    HE1  TYR  61           HE1      TYR  61  37.671   0.523  15.417
  438    HE2  TYR  61           HE2      TYR  61  40.006   3.329  13.150
  439    HH   TYR  61           HH       TYR  61  40.810   1.361  14.295
  440    H    CYS  62           HN       CYS  62  33.331   5.639  14.212
  441    HA   CYS  62           HA       CYS  62  31.229   5.479  12.260
  442    HB2  CYS  62           HB2      CYS  62  31.292   6.749  15.008
  443    HB3  CYS  62           HB1      CYS  62  29.843   6.465  14.047
  444    H    ALA  63           HN       ALA  63  29.864   7.372  11.693
  445    HA   ALA  63           HA       ALA  63  31.413   9.439  10.580
  446    HB1  ALA  63           HB1      ALA  63  29.025   8.443   9.961
  447    HB2  ALA  63           HB2      ALA  63  29.467  10.095   9.541
  448    HB3  ALA  63           HB3      ALA  63  28.473   9.785  10.964
  449    HA   PRO  64           HA       PRO  64  31.704  12.628  13.581
  450    HB2  PRO  64           HB2      PRO  64  30.050  14.382  11.818
  451    HB3  PRO  64           HB1      PRO  64  31.661  14.669  12.502
  452    HG2  PRO  64           HG2      PRO  64  31.338  14.052   9.937
  453    HG3  PRO  64           HG1      PRO  64  32.721  13.454  10.870
  454    HD2  PRO  64           HD2      PRO  64  30.286  11.963   9.960
  455    HD3  PRO  64           HD1      PRO  64  31.951  11.389  10.196
  456    H    LEU  65           HN       LEU  65  30.586  13.368  15.361
  457    HA   LEU  65           HA       LEU  65  27.650  12.990  15.341
  458    HB2  LEU  65           HB2      LEU  65  29.552  12.765  17.690
  459    HB3  LEU  65           HB1      LEU  65  27.816  12.458  17.718
  460    HG   LEU  65           HG       LEU  65  29.838  10.928  16.053
  461   HD11  LEU  65          HD11      LEU  65  29.141   9.052  17.608
  462   HD12  LEU  65          HD12      LEU  65  28.364  10.275  18.614
  463   HD13  LEU  65          HD13      LEU  65  30.110  10.319  18.360
  464   HD21  LEU  65          HD21      LEU  65  27.723  10.935  14.921
  465   HD22  LEU  65          HD22      LEU  65  26.844  10.688  16.430
  466   HD23  LEU  65          HD23      LEU  65  27.833   9.388  15.762
  467    H    LYS  66           HN       LYS  66  26.350  14.541  16.265
  468    HA   LYS  66           HA       LYS  66  27.704  17.092  16.809
  469    HB2  LYS  66           HB2      LYS  66  24.863  16.574  15.899
  470    HB3  LYS  66           HB1      LYS  66  25.577  18.164  16.172
  471    HG2  LYS  66           HG2      LYS  66  26.692  16.137  14.220
  472    HG3  LYS  66           HG1      LYS  66  25.590  17.435  13.759
  473    HD2  LYS  66           HD2      LYS  66  27.228  19.083  14.714
  474    HD3  LYS  66           HD1      LYS  66  28.345  17.747  14.989
  475    HE2  LYS  66           HE2      LYS  66  28.331  17.219  12.588
  476    HE3  LYS  66           HE1      LYS  66  27.204  18.545  12.299
  477    HZ1  LYS  66           HZ1      LYS  66  28.980  19.958  13.464
  478    HZ2  LYS  66           HZ2      LYS  66  29.255  19.481  11.857
  479    HZ3  LYS  66           HZ3      LYS  66  30.030  18.669  13.132
  480    HA   PRO  67           HA       PRO  67  26.230  16.993  20.969
  481    HB2  PRO  67           HB2      PRO  67  25.915  19.659  21.484
  482    HB3  PRO  67           HB1      PRO  67  27.502  18.875  21.351
  483    HG2  PRO  67           HG2      PRO  67  26.024  20.507  19.346
  484    HG3  PRO  67           HG1      PRO  67  27.752  20.485  19.734
  485    HD2  PRO  67           HD2      PRO  67  26.698  19.213  17.565
  486    HD3  PRO  67           HD1      PRO  67  28.167  18.658  18.396
  487    H    ALA  68           HN       ALA  68  24.369  17.267  22.297
  488    HA   ALA  68           HA       ALA  68  21.893  17.043  20.986
  489    HB1  ALA  68           HB1      ALA  68  22.422  17.781  23.874
  490    HB2  ALA  68           HB2      ALA  68  22.335  16.136  23.242
  491    HB3  ALA  68           HB3      ALA  68  20.903  17.167  23.222
  492    H    LYS  69           HN       LYS  69  23.477  19.782  22.544
  493    HA   LYS  69           HA       LYS  69  21.213  21.531  21.940
  494    HB2  LYS  69           HB2      LYS  69  22.362  21.745  24.117
  495    HB3  LYS  69           HB1      LYS  69  23.859  22.150  23.277
  496    HG2  LYS  69           HG2      LYS  69  22.782  24.124  22.277
  497    HG3  LYS  69           HG1      LYS  69  21.267  23.713  23.082
  498    HD2  LYS  69           HD2      LYS  69  22.330  23.973  25.276
  499    HD3  LYS  69           HD1      LYS  69  23.877  24.318  24.503
  500    HE2  LYS  69           HE2      LYS  69  22.771  26.410  25.173
  501    HE3  LYS  69           HE1      LYS  69  22.882  26.308  23.416
  502    HZ1  LYS  69           HZ1      LYS  69  20.650  25.880  23.207
  503    HZ2  LYS  69           HZ2      LYS  69  20.652  26.950  24.528
  504    HZ3  LYS  69           HZ3      LYS  69  20.493  25.278  24.785
  505    H    SER  70           HN       SER  70  21.097  22.757  20.174
  506    HA   SER  70           HA       SER  70  23.042  22.638  18.116
  507    HB2  SER  70           HB2      SER  70  20.713  24.521  18.533
  508    HB3  SER  70           HB1      SER  70  21.671  24.439  17.058
  509    HG   SER  70           HG       SER  70  21.066  22.242  16.891
  510    H    ALA  71           HN       ALA  71  24.460  24.222  17.339
  511    HA   ALA  71           HA       ALA  71  25.420  26.072  19.405
  512    HB1  ALA  71           HB1      ALA  71  27.378  26.305  17.801
  513    HB2  ALA  71           HB2      ALA  71  26.639  25.015  16.852
  514    HB3  ALA  71           HB3      ALA  71  27.156  24.705  18.510
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1  27.721 -14.741  19.028
    2    H2   GLY   1           HT2      GLY   1  26.091 -15.188  19.205
    3    H3   GLY   1           HT3      GLY   1  26.531 -13.997  18.075
    4    HA2  GLY   1           HA2      GLY   1  26.357 -16.780  17.714
    5    HA3  GLY   1           HA1      GLY   1  26.737 -15.538  16.519
    6    H    GLY   2           HN       GLY   2  29.072 -14.523  17.129
    7    HA2  GLY   2           HA2      GLY   2  30.927 -16.685  16.663
    8    HA3  GLY   2           HA1      GLY   2  31.315 -14.967  16.727
    9    HA   PRO   3           HA       PRO   3  32.577 -17.185  20.706
   10    HB2  PRO   3           HB2      PRO   3  35.282 -17.217  20.325
   11    HB3  PRO   3           HB1      PRO   3  34.213 -18.528  19.792
   12    HG2  PRO   3           HG2      PRO   3  35.446 -16.330  18.216
   13    HG3  PRO   3           HG1      PRO   3  35.163 -18.023  17.774
   14    HD2  PRO   3           HD2      PRO   3  33.563 -15.933  16.941
   15    HD3  PRO   3           HD1      PRO   3  33.007 -17.617  17.074
   16    H    GLU   4           HN       GLU   4  31.727 -14.798  20.965
   17    HA   GLU   4           HA       GLU   4  32.001 -12.717  21.900
   18    HB2  GLU   4           HB2      GLU   4  34.500 -14.037  22.987
   19    HB3  GLU   4           HB1      GLU   4  33.806 -12.528  23.579
   20    HG2  GLU   4           HG2      GLU   4  31.707 -13.713  24.131
   21    HG3  GLU   4           HG1      GLU   4  32.416 -15.221  23.558
   22    H    THR   5           HN       THR   5  32.851 -12.930  19.238
   23    HA   THR   5           HA       THR   5  34.787 -10.745  19.164
   24    HB   THR   5           HB       THR   5  36.135 -12.845  19.021
   25    HG1  THR   5           HG1      THR   5  37.049 -11.176  17.990
   26   HG21  THR   5          HG21      THR   5  35.892 -14.325  17.155
   27   HG22  THR   5          HG22      THR   5  34.734 -13.249  16.372
   28   HG23  THR   5          HG23      THR   5  34.279 -14.118  17.838
   29    H    LEU   6           HN       LEU   6  34.718  -9.544  17.224
   30    HA   LEU   6           HA       LEU   6  32.359 -10.128  15.537
   31    HB2  LEU   6           HB2      LEU   6  33.615  -7.412  15.913
   32    HB3  LEU   6           HB1      LEU   6  32.020  -7.804  15.274
   33    HG   LEU   6           HG       LEU   6  31.918  -8.981  17.745
   34   HD11  LEU   6          HD11      LEU   6  32.717  -7.070  19.266
   35   HD12  LEU   6          HD12      LEU   6  33.658  -6.509  17.884
   36   HD13  LEU   6          HD13      LEU   6  33.970  -8.100  18.577
   37   HD21  LEU   6          HD21      LEU   6  30.394  -7.207  18.302
   38   HD22  LEU   6          HD22      LEU   6  30.285  -7.439  16.557
   39   HD23  LEU   6          HD23      LEU   6  31.207  -6.085  17.210
   40    H    CYS   7           HN       CYS   7  32.673 -10.398  13.414
   41    HA   CYS   7           HA       CYS   7  34.883  -9.223  11.996
   42    HB2  CYS   7           HB2      CYS   7  35.941 -11.195  13.116
   43    HB3  CYS   7           HB1      CYS   7  34.814 -12.237  12.249
   44    H    GLY   8           HN       GLY   8  34.599  -9.271   9.776
   45    HA2  GLY   8           HA2      GLY   8  33.448  -9.422   7.789
   46    HA3  GLY   8           HA1      GLY   8  32.864 -10.978   8.367
   47    H    ALA   9           HN       ALA   9  30.726 -11.024   8.140
   48    HA   ALA   9           HA       ALA   9  29.035  -8.788   8.012
   49    HB1  ALA   9           HB1      ALA   9  28.603 -11.728   8.408
   50    HB2  ALA   9           HB2      ALA   9  28.085 -10.690   7.080
   51    HB3  ALA   9           HB3      ALA   9  27.249 -10.619   8.631
   52    H    GLU  10           HN       GLU  10  30.009 -10.835  10.729
   53    HA   GLU  10           HA       GLU  10  28.131  -9.917  12.615
   54    HB2  GLU  10           HB2      GLU  10  30.942 -10.975  12.916
   55    HB3  GLU  10           HB1      GLU  10  29.887 -10.641  14.289
   56    HG2  GLU  10           HG2      GLU  10  28.258 -12.245  13.500
   57    HG3  GLU  10           HG1      GLU  10  29.147 -12.473  11.996
   58    H    LEU  11           HN       LEU  11  31.349  -8.706  11.733
   59    HA   LEU  11           HA       LEU  11  31.432  -6.654  13.690
   60    HB2  LEU  11           HB2      LEU  11  33.462  -7.458  12.578
   61    HB3  LEU  11           HB1      LEU  11  32.864  -6.851  11.034
   62    HG   LEU  11           HG       LEU  11  32.827  -4.550  11.961
   63   HD11  LEU  11          HD11      LEU  11  33.891  -5.975  14.408
   64   HD12  LEU  11          HD12      LEU  11  32.474  -4.933  14.294
   65   HD13  LEU  11          HD13      LEU  11  34.091  -4.241  14.160
   66   HD21  LEU  11          HD21      LEU  11  34.848  -5.491  10.812
   67   HD22  LEU  11          HD22      LEU  11  35.502  -5.902  12.399
   68   HD23  LEU  11          HD23      LEU  11  35.221  -4.214  11.969
   69    H    VAL  12           HN       VAL  12  30.393  -6.718  10.314
   70    HA   VAL  12           HA       VAL  12  29.940  -3.988   9.978
   71    HB   VAL  12           HB       VAL  12  28.731  -6.445   8.721
   72   HG11  VAL  12          HG11      VAL  12  27.734  -4.789   7.046
   73   HG12  VAL  12          HG12      VAL  12  28.051  -3.521   8.229
   74   HG13  VAL  12          HG13      VAL  12  26.930  -4.826   8.617
   75   HG21  VAL  12          HG21      VAL  12  29.962  -5.550   6.754
   76   HG22  VAL  12          HG22      VAL  12  31.033  -5.844   8.123
   77   HG23  VAL  12          HG23      VAL  12  30.526  -4.199   7.740
   78    H    ASP  13           HN       ASP  13  27.785  -6.538  11.180
   79    HA   ASP  13           HA       ASP  13  25.477  -4.953  11.472
   80    HB2  ASP  13           HB2      ASP  13  25.528  -7.446  11.567
   81    HB3  ASP  13           HB1      ASP  13  26.299  -7.334  13.148
   82    H    ALA  14           HN       ALA  14  28.106  -5.724  13.742
   83    HA   ALA  14           HA       ALA  14  27.046  -4.354  15.971
   84    HB1  ALA  14           HB1      ALA  14  28.897  -5.966  16.125
   85    HB2  ALA  14           HB2      ALA  14  29.323  -4.420  16.859
   86    HB3  ALA  14           HB3      ALA  14  29.946  -4.842  15.261
   87    H    LEU  15           HN       LEU  15  29.176  -3.298  13.338
   88    HA   LEU  15           HA       LEU  15  29.771  -0.733  14.331
   89    HB2  LEU  15           HB2      LEU  15  29.613  -1.852  11.531
   90    HB3  LEU  15           HB1      LEU  15  30.110  -0.191  11.856
   91    HG   LEU  15           HG       LEU  15  31.417  -2.539  13.239
   92   HD11  LEU  15          HD11      LEU  15  32.348  -1.167  10.697
   93   HD12  LEU  15          HD12      LEU  15  31.603  -2.765  10.743
   94   HD13  LEU  15          HD13      LEU  15  33.154  -2.492  11.536
   95   HD21  LEU  15          HD21      LEU  15  32.138   0.365  12.719
   96   HD22  LEU  15          HD22      LEU  15  33.287  -0.812  13.355
   97   HD23  LEU  15          HD23      LEU  15  31.845  -0.401  14.281
   98    H    GLN  16           HN       GLN  16  27.112  -1.879  12.272
   99    HA   GLN  16           HA       GLN  16  25.927   0.666  11.853
  100    HB2  GLN  16           HB2      GLN  16  24.807  -2.137  11.755
  101    HB3  GLN  16           HB1      GLN  16  23.874  -0.705  11.316
  102    HG2  GLN  16           HG2      GLN  16  25.421  -0.149   9.553
  103    HG3  GLN  16           HG1      GLN  16  26.544  -1.406  10.072
  104   HE21  GLN  16          HE21      GLN  16  25.189  -1.161   7.416
  105   HE22  GLN  16          HE22      GLN  16  24.300  -2.594   7.224
  106    H    PHE  17           HN       PHE  17  25.455  -1.853  14.299
  107    HA   PHE  17           HA       PHE  17  23.235  -0.716  15.606
  108    HB2  PHE  17           HB2      PHE  17  23.821  -2.963  16.128
  109    HB3  PHE  17           HB1      PHE  17  25.462  -2.509  16.587
  110    HD1  PHE  17           HD1      PHE  17  21.888  -2.341  17.573
  111    HD2  PHE  17           HD2      PHE  17  25.955  -1.549  18.740
  112    HE1  PHE  17           HE1      PHE  17  21.144  -1.960  19.909
  113    HE2  PHE  17           HE2      PHE  17  25.205  -1.181  21.077
  114    HZ   PHE  17           HZ       PHE  17  22.803  -1.384  21.661
  115    H    VAL  18           HN       VAL  18  26.714  -0.425  16.320
  116    HA   VAL  18           HA       VAL  18  26.406   1.356  18.494
  117    HB   VAL  18           HB       VAL  18  28.746   0.861  16.643
  118   HG11  VAL  18          HG11      VAL  18  29.028   3.050  17.630
  119   HG12  VAL  18          HG12      VAL  18  30.059   1.925  18.515
  120   HG13  VAL  18          HG13      VAL  18  28.526   2.447  19.211
  121   HG21  VAL  18          HG21      VAL  18  28.123  -0.074  19.463
  122   HG22  VAL  18          HG22      VAL  18  29.579  -0.457  18.544
  123   HG23  VAL  18          HG23      VAL  18  28.015  -1.069  18.010
  124    H    CYS  19           HN       CYS  19  27.045   1.905  15.047
  125    HA   CYS  19           HA       CYS  19  26.432   4.768  15.473
  126    HB2  CYS  19           HB2      CYS  19  28.241   3.509  13.394
  127    HB3  CYS  19           HB1      CYS  19  27.875   5.229  13.529
  128    H    GLY  20           HN       GLY  20  24.200   3.567  15.207
  129    HA2  GLY  20           HA2      GLY  20  23.353   2.725  12.650
  130    HA3  GLY  20           HA1      GLY  20  22.301   3.307  13.934
  131    H    ASP  21           HN       ASP  21  23.323   5.908  14.215
  132    HA   ASP  21           HA       ASP  21  22.278   7.112  11.747
  133    HB2  ASP  21           HB2      ASP  21  22.662   8.188  14.545
  134    HB3  ASP  21           HB1      ASP  21  22.141   9.181  13.185
  135    H    ARG  22           HN       ARG  22  25.061   7.242  13.932
  136    HA   ARG  22           HA       ARG  22  26.426   9.342  12.623
  137    HB2  ARG  22           HB2      ARG  22  27.403   7.081  14.376
  138    HB3  ARG  22           HB1      ARG  22  28.456   8.363  13.786
  139    HG2  ARG  22           HG2      ARG  22  26.994  10.027  14.847
  140    HG3  ARG  22           HG1      ARG  22  25.962   8.729  15.454
  141    HD2  ARG  22           HD2      ARG  22  27.950   7.773  16.634
  142    HD3  ARG  22           HD1      ARG  22  28.886   9.170  16.110
  143    HE   ARG  22           HE       ARG  22  26.549  10.040  17.405
  144   HH11  ARG  22          HH11      ARG  22  29.579   8.452  18.035
  145   HH12  ARG  22          HH12      ARG  22  29.692   9.020  19.666
  146   HH21  ARG  22          HH21      ARG  22  26.717  10.792  19.578
  147   HH22  ARG  22          HH22      ARG  22  28.087  10.331  20.534
  148    H    GLY  23           HN       GLY  23  26.465   5.833  12.172
  149    HA2  GLY  23           HA2      GLY  23  27.066   4.586  10.329
  150    HA3  GLY  23           HA1      GLY  23  27.295   6.090   9.444
  151    H    PHE  24           HN       PHE  24  29.116   4.498   8.707
  152    HA   PHE  24           HA       PHE  24  31.559   5.476   9.904
  153    HB2  PHE  24           HB2      PHE  24  32.517   3.229  10.279
  154    HB3  PHE  24           HB1      PHE  24  31.127   3.528  11.324
  155    HD1  PHE  24           HD1      PHE  24  32.438   1.593   8.506
  156    HD2  PHE  24           HD2      PHE  24  28.940   2.485  10.831
  157    HE1  PHE  24           HE1      PHE  24  31.297  -0.388   7.558
  158    HE2  PHE  24           HE2      PHE  24  27.802   0.499   9.888
  159    HZ   PHE  24           HZ       PHE  24  28.981  -0.938   8.251
  160    H    TYR  25           HN       TYR  25  33.487   4.812   8.663
  161    HA   TYR  25           HA       TYR  25  32.900   3.853   5.948
  162    HB2  TYR  25           HB2      TYR  25  33.927   5.737   4.868
  163    HB3  TYR  25           HB1      TYR  25  32.709   6.372   5.975
  164    HD1  TYR  25           HD1      TYR  25  36.318   5.949   5.368
  165    HD2  TYR  25           HD2      TYR  25  33.342   7.550   8.018
  166    HE1  TYR  25           HE1      TYR  25  38.064   7.259   6.528
  167    HE2  TYR  25           HE2      TYR  25  35.091   8.868   9.181
  168    HH   TYR  25           HH       TYR  25  38.110   8.301   9.198
  169    H    PHE  26           HN       PHE  26  34.983   3.579   4.688
  170    HA   PHE  26           HA       PHE  26  37.082   2.599   6.522
  171    HB2  PHE  26           HB2      PHE  26  36.409   1.767   3.689
  172    HB3  PHE  26           HB1      PHE  26  37.741   1.115   4.644
  173    HD1  PHE  26           HD1      PHE  26  34.149   1.065   4.054
  174    HD2  PHE  26           HD2      PHE  26  37.261  -0.150   6.753
  175    HE1  PHE  26           HE1      PHE  26  32.594  -0.547   5.121
  176    HE2  PHE  26           HE2      PHE  26  35.707  -1.754   7.820
  177    HZ   PHE  26           HZ       PHE  26  33.375  -1.960   7.004
  178    H    ASN  27           HN       ASN  27  39.097   3.397   6.399
  179    HA   ASN  27           HA       ASN  27  39.630   5.797   5.018
  180    HB2  ASN  27           HB2      ASN  27  41.444   3.780   6.345
  181    HB3  ASN  27           HB1      ASN  27  42.038   5.285   5.645
  182   HD21  ASN  27          HD21      ASN  27  42.192   4.703   8.479
  183   HD22  ASN  27          HD22      ASN  27  41.195   5.817   9.285
  184    H    LYS  28           HN       LYS  28  40.388   2.426   4.277
  185    HA   LYS  28           HA       LYS  28  41.155   3.281   1.554
  186    HB2  LYS  28           HB2      LYS  28  42.438   1.093   3.190
  187    HB3  LYS  28           HB1      LYS  28  42.814   1.466   1.509
  188    HG2  LYS  28           HG2      LYS  28  43.425   3.791   2.211
  189    HG3  LYS  28           HG1      LYS  28  43.185   3.307   3.889
  190    HD2  LYS  28           HD2      LYS  28  45.100   1.908   2.005
  191    HD3  LYS  28           HD1      LYS  28  45.585   3.192   3.112
  192    HE2  LYS  28           HE2      LYS  28  44.274   0.582   3.936
  193    HE3  LYS  28           HE1      LYS  28  45.988   0.954   4.091
  194    HZ1  LYS  28           HZ1      LYS  28  45.043   3.043   5.326
  195    HZ2  LYS  28           HZ2      LYS  28  45.255   1.567   6.139
  196    HZ3  LYS  28           HZ3      LYS  28  43.713   2.023   5.591
  197    HA   PRO  29           HA       PRO  29  37.525   0.334   1.506
  198    HB2  PRO  29           HB2      PRO  29  37.108   1.929  -0.983
  199    HB3  PRO  29           HB1      PRO  29  35.937   1.453   0.262
  200    HG2  PRO  29           HG2      PRO  29  36.823   3.945   0.115
  201    HG3  PRO  29           HG1      PRO  29  36.548   3.164   1.682
  202    HD2  PRO  29           HD2      PRO  29  39.138   3.704   0.273
  203    HD3  PRO  29           HD1      PRO  29  38.762   3.768   2.008
  204    H    THR  30           HN       THR  30  39.943   1.294  -0.854
  205    HA   THR  30           HA       THR  30  39.775  -1.401  -2.064
  206    HB   THR  30           HB       THR  30  40.450  -0.413  -4.205
  207    HG1  THR  30           HG1      THR  30  41.550   1.376  -3.679
  208   HG21  THR  30          HG21      THR  30  38.030   0.812  -2.864
  209   HG22  THR  30          HG22      THR  30  38.082  -0.624  -3.886
  210   HG23  THR  30          HG23      THR  30  38.357   0.970  -4.589
  211    H    GLY  31           HN       GLY  31  41.837  -2.155  -3.010
  212    HA2  GLY  31           HA2      GLY  31  44.148  -1.094  -1.503
  213    HA3  GLY  31           HA1      GLY  31  43.920  -2.802  -1.874
  214    H    TYR  32           HN       TYR  32  42.919  -0.758  -4.409
  215    HA   TYR  32           HA       TYR  32  45.112  -1.670  -6.044
  216    HB2  TYR  32           HB2      TYR  32  42.664  -0.006  -6.657
  217    HB3  TYR  32           HB1      TYR  32  43.849  -0.497  -7.866
  218    HD1  TYR  32           HD1      TYR  32  41.188  -1.636  -5.597
  219    HD2  TYR  32           HD2      TYR  32  44.083  -2.840  -8.532
  220    HE1  TYR  32           HE1      TYR  32  40.062  -3.837  -5.805
  221    HE2  TYR  32           HE2      TYR  32  42.958  -5.041  -8.739
  222    HH   TYR  32           HH       TYR  32  40.679  -5.984  -8.334
  223    H    GLY  33           HN       GLY  33  46.992  -0.584  -5.887
  224    HA2  GLY  33           HA2      GLY  33  48.399   1.231  -6.389
  225    HA3  GLY  33           HA1      GLY  33  46.997   2.297  -6.368
  226    H    SER  34           HN       SER  34  46.508   0.586  -3.672
  227    HA   SER  34           HA       SER  34  48.168   2.367  -2.002
  228    HB2  SER  34           HB2      SER  34  46.334   2.385  -0.388
  229    HB3  SER  34           HB1      SER  34  45.765   2.952  -1.955
  230    HG   SER  34           HG       SER  34  44.451   1.321  -2.004
  231    H    SER  35           HN       SER  35  47.497  -0.835  -2.876
  232    HA   SER  35           HA       SER  35  48.947  -1.813  -0.525
  233    HB2  SER  35           HB2      SER  35  46.665  -2.316   0.003
  234    HB3  SER  35           HB1      SER  35  46.354  -2.897  -1.632
  235    HG   SER  35           HG       SER  35  46.783  -4.546   0.016
  236    H    SER  36           HN       SER  36  50.687  -2.855  -1.203
  237    HA   SER  36           HA       SER  36  50.544  -4.763  -3.379
  238    HB2  SER  36           HB2      SER  36  50.948  -2.688  -4.616
  239    HB3  SER  36           HB1      SER  36  52.338  -2.333  -3.595
  240    HG   SER  36           HG       SER  36  53.432  -3.971  -4.499
  241    H    ARG  37           HN       ARG  37  52.243  -6.249  -3.356
  242    HA   ARG  37           HA       ARG  37  53.861  -7.540  -2.369
  243    HB2  ARG  37           HB2      ARG  37  54.906  -4.772  -1.775
  244    HB3  ARG  37           HB1      ARG  37  55.804  -6.235  -1.380
  245    HG2  ARG  37           HG2      ARG  37  55.771  -6.915  -3.727
  246    HG3  ARG  37           HG1      ARG  37  54.819  -5.490  -4.143
  247    HD2  ARG  37           HD2      ARG  37  56.654  -4.036  -3.335
  248    HD3  ARG  37           HD1      ARG  37  57.605  -5.468  -2.947
  249    HE   ARG  37           HE       ARG  37  57.144  -4.363  -5.584
  250   HH11  ARG  37          HH11      ARG  37  57.969  -7.190  -3.709
  251   HH12  ARG  37          HH12      ARG  37  58.804  -7.957  -5.017
  252   HH21  ARG  37          HH21      ARG  37  58.240  -5.397  -7.278
  253   HH22  ARG  37          HH22      ARG  37  58.955  -6.954  -7.021
  254    H    ARG  38           HN       ARG  38  54.469  -5.142   0.109
  255    HA   ARG  38           HA       ARG  38  52.869  -6.681   2.029
  256    HB2  ARG  38           HB2      ARG  38  55.780  -5.900   2.281
  257    HB3  ARG  38           HB1      ARG  38  54.791  -6.450   3.634
  258    HG2  ARG  38           HG2      ARG  38  54.330  -8.559   2.445
  259    HG3  ARG  38           HG1      ARG  38  55.321  -8.016   1.090
  260    HD2  ARG  38           HD2      ARG  38  57.277  -7.856   2.604
  261    HD3  ARG  38           HD1      ARG  38  56.282  -8.436   3.936
  262    HE   ARG  38           HE       ARG  38  57.387 -10.030   1.791
  263   HH11  ARG  38          HH11      ARG  38  54.879  -9.735   4.198
  264   HH12  ARG  38          HH12      ARG  38  54.603 -11.440   4.290
  265   HH21  ARG  38          HH21      ARG  38  56.999 -12.262   1.931
  266   HH22  ARG  38          HH22      ARG  38  55.791 -12.862   3.017
  267    H    ALA  39           HN       ALA  39  52.372  -4.143   0.720
  268    HA   ALA  39           HA       ALA  39  53.037  -1.999   2.454
  269    HB1  ALA  39           HB1      ALA  39  51.869  -0.658   1.003
  270    HB2  ALA  39           HB2      ALA  39  50.573  -1.835   0.789
  271    HB3  ALA  39           HB3      ALA  39  52.109  -2.052  -0.048
  272    HA   PRO  40           HA       PRO  40  50.090  -2.191   5.699
  273    HB2  PRO  40           HB2      PRO  40  49.116   0.543   5.046
  274    HB3  PRO  40           HB1      PRO  40  49.874  -0.061   6.531
  275    HG2  PRO  40           HG2      PRO  40  51.176   1.532   4.842
  276    HG3  PRO  40           HG1      PRO  40  51.997   0.228   5.721
  277    HD2  PRO  40           HD2      PRO  40  51.120   0.303   2.852
  278    HD3  PRO  40           HD1      PRO  40  52.593  -0.386   3.570
  279    H    GLN  41           HN       GLN  41  48.804  -3.759   4.449
  280    HA   GLN  41           HA       GLN  41  46.410  -2.719   3.135
  281    HB2  GLN  41           HB2      GLN  41  45.994  -5.019   2.469
  282    HB3  GLN  41           HB1      GLN  41  47.671  -4.603   2.110
  283    HG2  GLN  41           HG2      GLN  41  48.360  -5.652   4.259
  284    HG3  GLN  41           HG1      GLN  41  46.687  -6.136   4.532
  285   HE21  GLN  41          HE21      GLN  41  49.536  -7.411   3.505
  286   HE22  GLN  41          HE22      GLN  41  48.962  -8.568   2.404
  287    H    THR  42           HN       THR  42  47.098  -2.817   6.182
  288    HA   THR  42           HA       THR  42  45.065  -4.504   7.304
  289    HB   THR  42           HB       THR  42  45.660  -3.427   9.420
  290    HG1  THR  42           HG1      THR  42  46.722  -1.590   9.468
  291   HG21  THR  42          HG21      THR  42  48.141  -3.896   9.353
  292   HG22  THR  42          HG22      THR  42  47.987  -4.116   7.610
  293   HG23  THR  42          HG23      THR  42  47.134  -5.195   8.715
  294    H    GLY  43           HN       GLY  43  43.332  -3.568   8.726
  295    HA2  GLY  43           HA2      GLY  43  42.357  -0.927   8.067
  296    HA3  GLY  43           HA1      GLY  43  41.388  -2.244   7.413
  297    H    ILE  44           HN       ILE  44  39.965  -0.828   9.000
  298    HA   ILE  44           HA       ILE  44  40.188  -1.260  11.793
  299    HB   ILE  44           HB       ILE  44  37.944  -0.379  11.940
  300   HG12  ILE  44          HG12      ILE  44  37.792  -0.829   8.937
  301   HG13  ILE  44          HG11      ILE  44  36.932  -1.772  10.149
  302   HG21  ILE  44          HG21      ILE  44  39.759   1.201  11.323
  303   HG22  ILE  44          HG22      ILE  44  38.210   1.695  10.644
  304   HG23  ILE  44          HG23      ILE  44  39.413   0.915   9.619
  305   HD11  ILE  44          HD11      ILE  44  35.945   0.452  10.954
  306   HD12  ILE  44          HD12      ILE  44  35.356  -0.176   9.416
  307   HD13  ILE  44          HD13      ILE  44  36.542   1.128   9.439
  308    H    VAL  45           HN       VAL  45  38.716  -3.075   9.185
  309    HA   VAL  45           HA       VAL  45  37.148  -4.814  10.758
  310    HB   VAL  45           HB       VAL  45  38.339  -5.118   8.006
  311   HG11  VAL  45          HG11      VAL  45  36.666  -7.015   7.818
  312   HG12  VAL  45          HG12      VAL  45  36.496  -6.943   9.572
  313   HG13  VAL  45          HG13      VAL  45  38.056  -7.356   8.851
  314   HG21  VAL  45          HG21      VAL  45  35.583  -4.462   9.092
  315   HG22  VAL  45          HG22      VAL  45  35.891  -4.858   7.400
  316   HG23  VAL  45          HG23      VAL  45  36.625  -3.425   8.118
  317    H    ASP  46           HN       ASP  46  40.426  -5.095   9.479
  318    HA   ASP  46           HA       ASP  46  40.932  -7.699  10.424
  319    HB2  ASP  46           HB2      ASP  46  42.764  -5.385   9.784
  320    HB3  ASP  46           HB1      ASP  46  43.356  -6.981  10.245
  321    H    GLU  47           HN       GLU  47  41.365  -4.505  11.917
  322    HA   GLU  47           HA       GLU  47  42.822  -5.362  14.166
  323    HB2  GLU  47           HB2      GLU  47  42.562  -2.997  13.537
  324    HB3  GLU  47           HB1      GLU  47  40.843  -3.081  13.918
  325    HG2  GLU  47           HG2      GLU  47  42.067  -2.096  15.796
  326    HG3  GLU  47           HG1      GLU  47  41.412  -3.662  16.267
  327    H    CYS  48           HN       CYS  48  39.310  -4.808  13.825
  328    HA   CYS  48           HA       CYS  48  38.681  -5.808  16.437
  329    HB2  CYS  48           HB2      CYS  48  36.964  -5.357  13.989
  330    HB3  CYS  48           HB1      CYS  48  36.355  -5.842  15.565
  331    H    CYS  49           HN       CYS  49  38.646  -7.217  13.188
  332    HA   CYS  49           HA       CYS  49  37.418  -9.650  13.826
  333    HB2  CYS  49           HB2      CYS  49  37.741  -8.853  11.514
  334    HB3  CYS  49           HB1      CYS  49  39.478  -9.102  11.675
  335    H    PHE  50           HN       PHE  50  40.875  -8.794  13.657
  336    HA   PHE  50           HA       PHE  50  41.629 -11.393  14.666
  337    HB2  PHE  50           HB2      PHE  50  43.159  -8.943  13.815
  338    HB3  PHE  50           HB1      PHE  50  43.971 -10.303  14.599
  339    HD1  PHE  50           HD1      PHE  50  41.855  -9.293  11.704
  340    HD2  PHE  50           HD2      PHE  50  44.414 -12.311  13.377
  341    HE1  PHE  50           HE1      PHE  50  41.879 -10.462   9.522
  342    HE2  PHE  50           HE2      PHE  50  44.442 -13.488  11.195
  343    HZ   PHE  50           HZ       PHE  50  43.180 -12.568   9.266
  344    H    ARG  51           HN       ARG  51  42.491  -8.085  15.699
  345    HA   ARG  51           HA       ARG  51  42.916  -8.949  18.420
  346    HB2  ARG  51           HB2      ARG  51  43.049  -6.244  17.085
  347    HB3  ARG  51           HB1      ARG  51  43.358  -6.498  18.802
  348    HG2  ARG  51           HG2      ARG  51  45.152  -8.091  18.253
  349    HG3  ARG  51           HG1      ARG  51  44.842  -7.852  16.533
  350    HD2  ARG  51           HD2      ARG  51  45.391  -5.458  16.763
  351    HD3  ARG  51           HD1      ARG  51  45.693  -5.691  18.483
  352    HE   ARG  51           HE       ARG  51  47.447  -6.439  16.304
  353   HH11  ARG  51          HH11      ARG  51  46.515  -7.000  19.622
  354   HH12  ARG  51          HH12      ARG  51  48.057  -7.644  20.070
  355   HH21  ARG  51          HH21      ARG  51  49.457  -7.295  16.923
  356   HH22  ARG  51          HH22      ARG  51  49.707  -7.813  18.557
  357    H    SER  52           HN       SER  52  41.853  -7.831  20.255
  358    HA   SER  52           HA       SER  52  38.970  -7.658  19.776
  359    HB2  SER  52           HB2      SER  52  39.723  -9.068  21.624
  360    HB3  SER  52           HB1      SER  52  40.583  -7.707  22.339
  361    HG   SER  52           HG       SER  52  38.712  -6.803  22.905
  362    H    CYS  53           HN       CYS  53  38.748  -5.629  18.804
  363    HA   CYS  53           HA       CYS  53  39.873  -3.256  19.996
  364    HB2  CYS  53           HB2      CYS  53  38.645  -2.069  18.262
  365    HB3  CYS  53           HB1      CYS  53  39.442  -3.469  17.554
  366    H    ASP  54           HN       ASP  54  38.742  -1.596  21.049
  367    HA   ASP  54           HA       ASP  54  36.401  -2.527  22.543
  368    HB2  ASP  54           HB2      ASP  54  38.305  -0.215  22.911
  369    HB3  ASP  54           HB1      ASP  54  36.839  -0.404  23.871
  370    H    LEU  55           HN       LEU  55  34.526  -1.221  22.790
  371    HA   LEU  55           HA       LEU  55  33.543  -0.128  20.380
  372    HB2  LEU  55           HB2      LEU  55  32.534   0.068  23.225
  373    HB3  LEU  55           HB1      LEU  55  31.644   0.673  21.827
  374    HG   LEU  55           HG       LEU  55  32.613  -2.188  22.074
  375   HD11  LEU  55          HD11      LEU  55  29.973  -0.906  22.813
  376   HD12  LEU  55          HD12      LEU  55  31.007  -1.915  23.822
  377   HD13  LEU  55          HD13      LEU  55  30.124  -2.631  22.476
  378   HD21  LEU  55          HD21      LEU  55  30.762  -2.448  20.303
  379   HD22  LEU  55          HD22      LEU  55  32.232  -1.625  19.785
  380   HD23  LEU  55          HD23      LEU  55  30.792  -0.691  20.182
  381    H    ARG  56           HN       ARG  56  34.941   1.341  23.257
  382    HA   ARG  56           HA       ARG  56  34.296   4.002  22.752
  383    HB2  ARG  56           HB2      ARG  56  35.296   3.273  24.866
  384    HB3  ARG  56           HB1      ARG  56  36.796   2.867  24.036
  385    HG2  ARG  56           HG2      ARG  56  37.070   5.042  25.075
  386    HG3  ARG  56           HG1      ARG  56  36.978   5.283  23.333
  387    HD2  ARG  56           HD2      ARG  56  34.578   5.842  23.536
  388    HD3  ARG  56           HD1      ARG  56  34.675   5.610  25.280
  389    HE   ARG  56           HE       ARG  56  35.717   7.676  25.439
  390   HH11  ARG  56          HH11      ARG  56  35.680   6.558  22.129
  391   HH12  ARG  56          HH12      ARG  56  36.241   8.066  21.490
  392   HH21  ARG  56          HH21      ARG  56  36.456   9.635  24.570
  393   HH22  ARG  56          HH22      ARG  56  36.680   9.795  22.858
  394    H    ARG  57           HN       ARG  57  37.004   2.039  21.567
  395    HA   ARG  57           HA       ARG  57  38.097   4.266  20.056
  396    HB2  ARG  57           HB2      ARG  57  39.269   2.115  21.202
  397    HB3  ARG  57           HB1      ARG  57  39.040   1.498  19.564
  398    HG2  ARG  57           HG2      ARG  57  40.286   3.276  18.606
  399    HG3  ARG  57           HG1      ARG  57  40.238   4.210  20.101
  400    HD2  ARG  57           HD2      ARG  57  42.426   3.247  19.972
  401    HD3  ARG  57           HD1      ARG  57  41.539   2.339  21.191
  402    HE   ARG  57           HE       ARG  57  41.212   1.058  18.703
  403   HH11  ARG  57          HH11      ARG  57  43.655   1.768  21.087
  404   HH12  ARG  57          HH12      ARG  57  44.587   0.355  20.728
  405   HH21  ARG  57          HH21      ARG  57  42.452  -0.788  18.251
  406   HH22  ARG  57          HH22      ARG  57  43.913  -1.084  19.133
  407    H    LEU  58           HN       LEU  58  35.825   1.728  19.611
  408    HA   LEU  58           HA       LEU  58  36.102   1.300  16.828
  409    HB2  LEU  58           HB2      LEU  58  34.840  -0.164  18.456
  410    HB3  LEU  58           HB1      LEU  58  33.556   1.046  18.434
  411    HG   LEU  58           HG       LEU  58  33.555   0.809  15.892
  412   HD11  LEU  58          HD11      LEU  58  34.445  -1.460  15.139
  413   HD12  LEU  58          HD12      LEU  58  35.317  -1.524  16.669
  414   HD13  LEU  58          HD13      LEU  58  35.666  -0.248  15.511
  415   HD21  LEU  58          HD21      LEU  58  32.775  -1.458  17.737
  416   HD22  LEU  58          HD22      LEU  58  32.357  -1.458  16.022
  417   HD23  LEU  58          HD23      LEU  58  31.748  -0.185  17.078
  418    H    ASP  59           HN       ASP  59  34.309   3.653  18.741
  419    HA   ASP  59           HA       ASP  59  32.660   4.656  16.684
  420    HB2  ASP  59           HB2      ASP  59  32.349   6.593  18.132
  421    HB3  ASP  59           HB1      ASP  59  32.305   5.113  19.084
  422    H    MET  60           HN       MET  60  36.028   4.851  17.052
  423    HA   MET  60           HA       MET  60  36.546   7.415  16.008
  424    HB2  MET  60           HB2      MET  60  38.168   4.869  16.024
  425    HB3  MET  60           HB1      MET  60  38.787   6.409  15.433
  426    HG2  MET  60           HG2      MET  60  38.313   7.437  17.634
  427    HG3  MET  60           HG1      MET  60  37.720   5.885  18.223
  428    HE1  MET  60           HE1      MET  60  41.046   6.708  15.915
  429    HE2  MET  60           HE2      MET  60  41.924   7.295  17.326
  430    HE3  MET  60           HE3      MET  60  40.371   8.011  16.905
  431    H    TYR  61           HN       TYR  61  35.963   4.264  14.529
  432    HA   TYR  61           HA       TYR  61  36.584   5.160  11.851
  433    HB2  TYR  61           HB2      TYR  61  34.939   2.731  12.504
  434    HB3  TYR  61           HB1      TYR  61  36.064   2.988  11.173
  435    HD1  TYR  61           HD1      TYR  61  35.722   1.214  14.107
  436    HD2  TYR  61           HD2      TYR  61  38.523   3.825  12.146
  437    HE1  TYR  61           HE1      TYR  61  37.574   0.246  15.441
  438    HE2  TYR  61           HE2      TYR  61  40.369   2.851  13.484
  439    HH   TYR  61           HH       TYR  61  40.553   0.278  14.757
  440    H    CYS  62           HN       CYS  62  33.951   5.620  13.924
  441    HA   CYS  62           HA       CYS  62  31.891   5.606  11.909
  442    HB2  CYS  62           HB2      CYS  62  31.965   6.508  14.781
  443    HB3  CYS  62           HB1      CYS  62  30.539   6.677  13.764
  444    H    ALA  63           HN       ALA  63  30.859   7.431  11.037
  445    HA   ALA  63           HA       ALA  63  32.542   9.636  10.512
  446    HB1  ALA  63           HB1      ALA  63  29.606   9.813   9.988
  447    HB2  ALA  63           HB2      ALA  63  30.521   8.563   9.146
  448    HB3  ALA  63           HB3      ALA  63  30.964  10.258   8.954
  449    HA   PRO  64           HA       PRO  64  31.350  12.341  13.796
  450    HB2  PRO  64           HB2      PRO  64  31.685  14.777  12.627
  451    HB3  PRO  64           HB1      PRO  64  33.044  13.725  13.067
  452    HG2  PRO  64           HG2      PRO  64  31.803  14.207  10.409
  453    HG3  PRO  64           HG1      PRO  64  33.503  13.953  10.837
  454    HD2  PRO  64           HD2      PRO  64  31.864  11.990   9.768
  455    HD3  PRO  64           HD1      PRO  64  33.315  11.652  10.734
  456    H    LEU  65           HN       LEU  65  29.711  13.795  14.548
  457    HA   LEU  65           HA       LEU  65  27.169  13.442  13.279
  458    HB2  LEU  65           HB2      LEU  65  28.051  15.113  15.640
  459    HB3  LEU  65           HB1      LEU  65  26.374  14.961  15.117
  460    HG   LEU  65           HG       LEU  65  28.113  12.570  15.765
  461   HD11  LEU  65          HD11      LEU  65  27.936  13.810  17.815
  462   HD12  LEU  65          HD12      LEU  65  26.731  12.524  17.895
  463   HD13  LEU  65          HD13      LEU  65  26.234  14.173  17.516
  464   HD21  LEU  65          HD21      LEU  65  25.754  11.583  16.072
  465   HD22  LEU  65          HD22      LEU  65  26.253  11.934  14.418
  466   HD23  LEU  65          HD23      LEU  65  25.164  13.034  15.263
  467    H    LYS  66           HN       LYS  66  25.871  14.941  12.254
  468    HA   LYS  66           HA       LYS  66  27.243  16.974  10.805
  469    HB2  LYS  66           HB2      LYS  66  24.302  16.290  10.988
  470    HB3  LYS  66           HB1      LYS  66  24.978  17.469   9.865
  471    HG2  LYS  66           HG2      LYS  66  25.903  14.593  10.002
  472    HG3  LYS  66           HG1      LYS  66  24.651  15.152   8.893
  473    HD2  LYS  66           HD2      LYS  66  26.294  16.842   8.006
  474    HD3  LYS  66           HD1      LYS  66  27.535  16.084   9.003
  475    HE2  LYS  66           HE2      LYS  66  27.143  13.933   7.863
  476    HE3  LYS  66           HE1      LYS  66  25.914  14.698   6.854
  477    HZ1  LYS  66           HZ1      LYS  66  28.083  14.576   5.755
  478    HZ2  LYS  66           HZ2      LYS  66  28.763  15.528   6.989
  479    HZ3  LYS  66           HZ3      LYS  66  27.572  16.178   5.967
  480    HA   PRO  67           HA       PRO  67  26.570  20.410  13.490
  481    HB2  PRO  67           HB2      PRO  67  26.350  22.457  11.689
  482    HB3  PRO  67           HB1      PRO  67  27.888  21.656  12.069
  483    HG2  PRO  67           HG2      PRO  67  26.074  21.270   9.744
  484    HG3  PRO  67           HG1      PRO  67  27.843  21.298   9.804
  485    HD2  PRO  67           HD2      PRO  67  26.395  18.988   9.661
  486    HD3  PRO  67           HD1      PRO  67  27.993  19.086  10.431
  487    H    ALA  68           HN       ALA  68  25.009  22.002  14.185
  488    HA   ALA  68           HA       ALA  68  22.331  21.177  13.960
  489    HB1  ALA  68           HB1      ALA  68  23.568  23.750  14.943
  490    HB2  ALA  68           HB2      ALA  68  22.980  22.396  15.908
  491    HB3  ALA  68           HB3      ALA  68  21.838  23.421  15.036
  492    H    LYS  69           HN       LYS  69  24.147  23.716  12.317
  493    HA   LYS  69           HA       LYS  69  22.010  25.001  11.028
  494    HB2  LYS  69           HB2      LYS  69  24.297  25.916  11.092
  495    HB3  LYS  69           HB1      LYS  69  24.843  24.615  10.034
  496    HG2  LYS  69           HG2      LYS  69  23.307  25.374   8.272
  497    HG3  LYS  69           HG1      LYS  69  22.715  26.656   9.330
  498    HD2  LYS  69           HD2      LYS  69  24.964  27.644   9.420
  499    HD3  LYS  69           HD1      LYS  69  25.583  26.354   8.388
  500    HE2  LYS  69           HE2      LYS  69  24.057  27.053   6.585
  501    HE3  LYS  69           HE1      LYS  69  23.421  28.336   7.613
  502    HZ1  LYS  69           HZ1      LYS  69  25.220  28.982   5.992
  503    HZ2  LYS  69           HZ2      LYS  69  26.301  28.104   6.968
  504    HZ3  LYS  69           HZ3      LYS  69  25.470  29.444   7.605
  505    H    SER  70           HN       SER  70  24.021  22.264   9.974
  506    HA   SER  70           HA       SER  70  22.846  21.931   7.433
  507    HB2  SER  70           HB2      SER  70  24.957  20.859   8.041
  508    HB3  SER  70           HB1      SER  70  24.130  19.873   9.244
  509    HG   SER  70           HG       SER  70  24.472  18.854   7.159
  510    H    ALA  71           HN       ALA  71  22.054  20.537  10.595
  511    HA   ALA  71           HA       ALA  71  20.214  19.375  11.340
  512    HB1  ALA  71           HB1      ALA  71  18.724  20.768   9.113
  513    HB2  ALA  71           HB2      ALA  71  19.200  21.589  10.599
  514    HB3  ALA  71           HB3      ALA  71  18.090  20.220  10.665
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1  33.369 -16.305  27.163
    2    H2   GLY   1           HT2      GLY   1  32.054 -15.944  28.177
    3    H3   GLY   1           HT3      GLY   1  32.155 -15.245  26.632
    4    HA2  GLY   1           HA2      GLY   1  32.223 -17.786  25.925
    5    HA3  GLY   1           HA1      GLY   1  31.293 -17.915  27.418
    6    H    GLY   2           HN       GLY   2  31.474 -16.044  24.394
    7    HA2  GLY   2           HA2      GLY   2  28.783 -16.410  23.686
    8    HA3  GLY   2           HA1      GLY   2  28.911 -14.879  24.546
    9    HA   PRO   3           HA       PRO   3  30.043 -14.241  20.062
   10    HB2  PRO   3           HB2      PRO   3  28.046 -12.495  19.436
   11    HB3  PRO   3           HB1      PRO   3  27.856 -14.254  19.326
   12    HG2  PRO   3           HG2      PRO   3  26.905 -12.376  21.423
   13    HG3  PRO   3           HG1      PRO   3  26.123 -13.817  20.754
   14    HD2  PRO   3           HD2      PRO   3  27.451 -13.761  23.182
   15    HD3  PRO   3           HD1      PRO   3  27.190 -15.232  22.220
   16    H    GLU   4           HN       GLU   4  31.633 -13.206  21.818
   17    HA   GLU   4           HA       GLU   4  31.333 -10.300  21.931
   18    HB2  GLU   4           HB2      GLU   4  33.452 -12.101  23.122
   19    HB3  GLU   4           HB1      GLU   4  33.289 -10.369  23.413
   20    HG2  GLU   4           HG2      GLU   4  31.126 -12.400  24.021
   21    HG3  GLU   4           HG1      GLU   4  32.265 -11.784  25.216
   22    H    THR   5           HN       THR   5  32.399 -12.376  19.667
   23    HA   THR   5           HA       THR   5  34.719 -10.744  18.884
   24    HB   THR   5           HB       THR   5  33.819 -13.489  17.984
   25    HG1  THR   5           HG1      THR   5  35.462 -14.199  19.222
   26   HG21  THR   5          HG21      THR   5  36.099 -13.473  16.876
   27   HG22  THR   5          HG22      THR   5  36.138 -11.734  17.172
   28   HG23  THR   5          HG23      THR   5  34.889 -12.425  16.137
   29    H    LEU   6           HN       LEU   6  34.496  -9.350  17.262
   30    HA   LEU   6           HA       LEU   6  32.132  -9.593  15.508
   31    HB2  LEU   6           HB2      LEU   6  33.836  -7.165  16.126
   32    HB3  LEU   6           HB1      LEU   6  32.382  -7.185  15.133
   33    HG   LEU   6           HG       LEU   6  32.482  -7.968  18.060
   34   HD11  LEU   6          HD11      LEU   6  31.592  -5.439  16.653
   35   HD12  LEU   6          HD12      LEU   6  32.828  -5.595  17.901
   36   HD13  LEU   6          HD13      LEU   6  31.128  -5.834  18.309
   37   HD21  LEU   6          HD21      LEU   6  30.260  -7.738  16.019
   38   HD22  LEU   6          HD22      LEU   6  29.946  -7.728  17.753
   39   HD23  LEU   6          HD23      LEU   6  30.689  -9.138  16.998
   40    H    CYS   7           HN       CYS   7  32.460 -10.113  13.458
   41    HA   CYS   7           HA       CYS   7  34.711  -9.193  11.941
   42    HB2  CYS   7           HB2      CYS   7  35.638 -11.135  13.284
   43    HB3  CYS   7           HB1      CYS   7  34.541 -12.177  12.377
   44    H    GLY   8           HN       GLY   8  34.491  -9.596   9.714
   45    HA2  GLY   8           HA2      GLY   8  33.328  -9.868   7.750
   46    HA3  GLY   8           HA1      GLY   8  32.635 -11.302   8.500
   47    H    ALA   9           HN       ALA   9  30.515 -11.215   8.148
   48    HA   ALA   9           HA       ALA   9  28.978  -8.885   7.808
   49    HB1  ALA   9           HB1      ALA   9  27.992 -10.824   6.953
   50    HB2  ALA   9           HB2      ALA   9  27.042 -10.506   8.407
   51    HB3  ALA   9           HB3      ALA   9  28.297 -11.744   8.427
   52    H    GLU  10           HN       GLU  10  29.703 -10.827  10.676
   53    HA   GLU  10           HA       GLU  10  27.827  -9.656  12.418
   54    HB2  GLU  10           HB2      GLU  10  29.077 -11.702  12.960
   55    HB3  GLU  10           HB1      GLU  10  30.566 -10.775  13.042
   56    HG2  GLU  10           HG2      GLU  10  29.652  -9.430  14.884
   57    HG3  GLU  10           HG1      GLU  10  28.132 -10.319  14.787
   58    H    LEU  11           HN       LEU  11  31.144  -8.736  11.573
   59    HA   LEU  11           HA       LEU  11  31.371  -6.605  13.407
   60    HB2  LEU  11           HB2      LEU  11  33.327  -7.542  12.293
   61    HB3  LEU  11           HB1      LEU  11  32.723  -6.997  10.730
   62    HG   LEU  11           HG       LEU  11  32.837  -4.649  11.508
   63   HD11  LEU  11          HD11      LEU  11  33.853  -5.967  14.035
   64   HD12  LEU  11          HD12      LEU  11  32.488  -4.863  13.866
   65   HD13  LEU  11          HD13      LEU  11  34.136  -4.265  13.673
   66   HD21  LEU  11          HD21      LEU  11  35.453  -6.079  12.043
   67   HD22  LEU  11          HD22      LEU  11  35.237  -4.440  11.429
   68   HD23  LEU  11          HD23      LEU  11  34.803  -5.823  10.424
   69    H    VAL  12           HN       VAL  12  30.272  -6.707  10.035
   70    HA   VAL  12           HA       VAL  12  29.957  -3.966   9.650
   71    HB   VAL  12           HB       VAL  12  28.584  -6.375   8.475
   72   HG11  VAL  12          HG11      VAL  12  26.891  -4.662   8.327
   73   HG12  VAL  12          HG12      VAL  12  27.695  -4.693   6.758
   74   HG13  VAL  12          HG13      VAL  12  28.087  -3.430   7.927
   75   HG21  VAL  12          HG21      VAL  12  30.867  -6.028   7.778
   76   HG22  VAL  12          HG22      VAL  12  30.575  -4.311   7.500
   77   HG23  VAL  12          HG23      VAL  12  29.824  -5.512   6.452
   78    H    ASP  13           HN       ASP  13  27.638  -6.375  10.847
   79    HA   ASP  13           HA       ASP  13  25.478  -4.587  11.219
   80    HB2  ASP  13           HB2      ASP  13  25.283  -7.076  11.157
   81    HB3  ASP  13           HB1      ASP  13  26.054  -7.138  12.741
   82    H    ALA  14           HN       ALA  14  28.062  -5.706  13.372
   83    HA   ALA  14           HA       ALA  14  27.163  -4.445  15.722
   84    HB1  ALA  14           HB1      ALA  14  30.028  -4.978  14.919
   85    HB2  ALA  14           HB2      ALA  14  28.946  -6.177  15.627
   86    HB3  ALA  14           HB3      ALA  14  29.411  -4.752  16.556
   87    H    LEU  15           HN       LEU  15  29.211  -3.292  13.076
   88    HA   LEU  15           HA       LEU  15  30.024  -0.859  14.234
   89    HB2  LEU  15           HB2      LEU  15  29.624  -1.723  11.367
   90    HB3  LEU  15           HB1      LEU  15  30.264  -0.137  11.802
   91    HG   LEU  15           HG       LEU  15  31.476  -2.680  12.896
   92   HD11  LEU  15          HD11      LEU  15  33.134  -2.548  11.084
   93   HD12  LEU  15          HD12      LEU  15  32.275  -1.176  10.381
   94   HD13  LEU  15          HD13      LEU  15  31.519  -2.771  10.410
   95   HD21  LEU  15          HD21      LEU  15  32.095  -0.635  14.047
   96   HD22  LEU  15          HD22      LEU  15  32.408   0.179  12.517
   97   HD23  LEU  15          HD23      LEU  15  33.461  -1.132  13.050
   98    H    GLN  16           HN       GLN  16  27.191  -1.674  12.242
   99    HA   GLN  16           HA       GLN  16  26.163   0.958  12.090
  100    HB2  GLN  16           HB2      GLN  16  25.447  -0.893  10.602
  101    HB3  GLN  16           HB1      GLN  16  24.637  -1.654  11.971
  102    HG2  GLN  16           HG2      GLN  16  23.195   0.301  12.245
  103    HG3  GLN  16           HG1      GLN  16  24.043   1.132  10.943
  104   HE21  GLN  16          HE21      GLN  16  21.361   0.868  10.509
  105   HE22  GLN  16          HE22      GLN  16  21.039  -0.364   9.385
  106    H    PHE  17           HN       PHE  17  25.617  -1.711  14.354
  107    HA   PHE  17           HA       PHE  17  23.577  -0.513  15.887
  108    HB2  PHE  17           HB2      PHE  17  23.984  -2.843  16.162
  109    HB3  PHE  17           HB1      PHE  17  25.676  -2.571  16.575
  110    HD1  PHE  17           HD1      PHE  17  22.178  -2.221  17.763
  111    HD2  PHE  17           HD2      PHE  17  26.344  -1.831  18.776
  112    HE1  PHE  17           HE1      PHE  17  21.576  -2.001  20.160
  113    HE2  PHE  17           HE2      PHE  17  25.738  -1.623  21.171
  114    HZ   PHE  17           HZ       PHE  17  23.356  -1.705  21.865
  115    H    VAL  18           HN       VAL  18  27.101  -0.582  16.394
  116    HA   VAL  18           HA       VAL  18  27.130   0.907  18.777
  117    HB   VAL  18           HB       VAL  18  29.220   0.597  16.613
  118   HG11  VAL  18          HG11      VAL  18  29.725   2.605  17.866
  119   HG12  VAL  18          HG12      VAL  18  30.790   1.324  18.441
  120   HG13  VAL  18          HG13      VAL  18  29.377   1.788  19.389
  121   HG21  VAL  18          HG21      VAL  18  28.999  -0.682  19.352
  122   HG22  VAL  18          HG22      VAL  18  30.154  -1.081  18.080
  123   HG23  VAL  18          HG23      VAL  18  28.445  -1.456  17.868
  124    H    CYS  19           HN       CYS  19  27.534   1.957  15.395
  125    HA   CYS  19           HA       CYS  19  27.763   4.736  16.115
  126    HB2  CYS  19           HB2      CYS  19  27.255   3.423  13.435
  127    HB3  CYS  19           HB1      CYS  19  27.666   5.119  13.687
  128    H    GLY  20           HN       GLY  20  25.161   2.550  15.577
  129    HA2  GLY  20           HA2      GLY  20  22.888   2.870  15.845
  130    HA3  GLY  20           HA1      GLY  20  23.205   4.572  16.171
  131    H    ASP  21           HN       ASP  21  21.432   5.169  14.847
  132    HA   ASP  21           HA       ASP  21  21.120   4.410  12.145
  133    HB2  ASP  21           HB2      ASP  21  20.168   6.817  13.699
  134    HB3  ASP  21           HB1      ASP  21  19.734   6.532  12.015
  135    H    ARG  22           HN       ARG  22  23.355   6.520  13.664
  136    HA   ARG  22           HA       ARG  22  23.830   8.405  11.638
  137    HB2  ARG  22           HB2      ARG  22  25.653   7.209  13.730
  138    HB3  ARG  22           HB1      ARG  22  26.124   8.544  12.679
  139    HG2  ARG  22           HG2      ARG  22  24.306   9.913  13.521
  140    HG3  ARG  22           HG1      ARG  22  23.684   8.570  14.473
  141    HD2  ARG  22           HD2      ARG  22  26.453   9.731  14.832
  142    HD3  ARG  22           HD1      ARG  22  25.059  10.239  15.779
  143    HE   ARG  22           HE       ARG  22  25.227   7.450  15.956
  144   HH11  ARG  22          HH11      ARG  22  27.071  10.274  16.848
  145   HH12  ARG  22          HH12      ARG  22  27.787   9.517  18.226
  146   HH21  ARG  22          HH21      ARG  22  26.180   6.488  17.770
  147   HH22  ARG  22          HH22      ARG  22  27.290   7.390  18.747
  148    H    GLY  23           HN       GLY  23  25.046   5.121  12.126
  149    HA2  GLY  23           HA2      GLY  23  25.797   3.649  10.472
  150    HA3  GLY  23           HA1      GLY  23  25.803   4.982   9.320
  151    H    PHE  24           HN       PHE  24  27.906   3.738   8.864
  152    HA   PHE  24           HA       PHE  24  30.081   5.240  10.094
  153    HB2  PHE  24           HB2      PHE  24  31.396   3.187  10.541
  154    HB3  PHE  24           HB1      PHE  24  29.943   3.275  11.528
  155    HD1  PHE  24           HD1      PHE  24  31.650   1.522   8.805
  156    HD2  PHE  24           HD2      PHE  24  27.984   1.880  11.011
  157    HE1  PHE  24           HE1      PHE  24  30.881  -0.647   7.888
  158    HE2  PHE  24           HE2      PHE  24  27.219  -0.287  10.097
  159    HZ   PHE  24           HZ       PHE  24  28.663  -1.552   8.536
  160    H    TYR  25           HN       TYR  25  32.125   4.976   8.926
  161    HA   TYR  25           HA       TYR  25  31.919   3.796   6.255
  162    HB2  TYR  25           HB2      TYR  25  32.513   5.821   5.102
  163    HB3  TYR  25           HB1      TYR  25  31.103   6.177   6.098
  164    HD1  TYR  25           HD1      TYR  25  34.707   6.714   5.648
  165    HD2  TYR  25           HD2      TYR  25  31.309   7.539   8.146
  166    HE1  TYR  25           HE1      TYR  25  35.986   8.492   6.801
  167    HE2  TYR  25           HE2      TYR  25  32.592   9.318   9.299
  168    HH   TYR  25           HH       TYR  25  35.682  10.411   8.131
  169    H    PHE  26           HN       PHE  26  34.017   3.775   5.140
  170    HA   PHE  26           HA       PHE  26  36.252   3.725   7.077
  171    HB2  PHE  26           HB2      PHE  26  35.827   2.077   4.572
  172    HB3  PHE  26           HB1      PHE  26  37.262   2.012   5.596
  173    HD1  PHE  26           HD1      PHE  26  33.701   1.155   5.316
  174    HD2  PHE  26           HD2      PHE  26  37.155   1.085   7.867
  175    HE1  PHE  26           HE1      PHE  26  32.557  -0.452   6.820
  176    HE2  PHE  26           HE2      PHE  26  36.011  -0.520   9.372
  177    HZ   PHE  26           HZ       PHE  26  33.712  -1.289   8.849
  178    H    ASN  27           HN       ASN  27  35.052   5.104   4.166
  179    HA   ASN  27           HA       ASN  27  37.539   6.624   3.867
  180    HB2  ASN  27           HB2      ASN  27  37.472   4.563   2.303
  181    HB3  ASN  27           HB1      ASN  27  36.225   5.453   1.430
  182   HD21  ASN  27          HD21      ASN  27  37.552   5.880  -0.446
  183   HD22  ASN  27          HD22      ASN  27  38.893   6.921  -0.380
  184    H    LYS  28           HN       LYS  28  34.353   6.101   2.337
  185    HA   LYS  28           HA       LYS  28  33.877   8.992   2.616
  186    HB2  LYS  28           HB2      LYS  28  33.325   7.287   0.186
  187    HB3  LYS  28           HB1      LYS  28  32.726   8.928   0.395
  188    HG2  LYS  28           HG2      LYS  28  35.077   9.712   0.686
  189    HG3  LYS  28           HG1      LYS  28  35.632   8.074   0.347
  190    HD2  LYS  28           HD2      LYS  28  33.885   9.652  -1.555
  191    HD3  LYS  28           HD1      LYS  28  35.646   9.635  -1.649
  192    HE2  LYS  28           HE2      LYS  28  33.856   7.191  -1.809
  193    HE3  LYS  28           HE1      LYS  28  34.662   7.960  -3.172
  194    HZ1  LYS  28           HZ1      LYS  28  35.854   6.480  -0.918
  195    HZ2  LYS  28           HZ2      LYS  28  36.772   7.619  -1.782
  196    HZ3  LYS  28           HZ3      LYS  28  36.108   6.275  -2.584
  197    HA   PRO  29           HA       PRO  29  29.981   7.859   4.363
  198    HB2  PRO  29           HB2      PRO  29  28.362   9.869   3.406
  199    HB3  PRO  29           HB1      PRO  29  29.518  10.079   4.733
  200    HG2  PRO  29           HG2      PRO  29  29.780  10.800   1.855
  201    HG3  PRO  29           HG1      PRO  29  30.292  11.696   3.298
  202    HD2  PRO  29           HD2      PRO  29  32.040  10.288   1.797
  203    HD3  PRO  29           HD1      PRO  29  32.233  10.452   3.553
  204    H    THR  30           HN       THR  30  30.223   8.336   0.913
  205    HA   THR  30           HA       THR  30  28.004   6.425   0.527
  206    HB   THR  30           HB       THR  30  27.338   7.658  -1.494
  207    HG1  THR  30           HG1      THR  30  28.639   9.091  -2.259
  208   HG21  THR  30          HG21      THR  30  26.373   8.177   0.787
  209   HG22  THR  30          HG22      THR  30  26.254   9.493  -0.381
  210   HG23  THR  30          HG23      THR  30  27.494   9.536   0.873
  211    H    GLY  31           HN       GLY  31  28.131   5.221  -1.498
  212    HA2  GLY  31           HA2      GLY  31  30.571   5.263  -3.033
  213    HA3  GLY  31           HA1      GLY  31  30.464   3.882  -1.946
  214    H    TYR  32           HN       TYR  32  27.843   5.499  -3.711
  215    HA   TYR  32           HA       TYR  32  26.612   3.109  -4.531
  216    HB2  TYR  32           HB2      TYR  32  25.186   4.473  -5.869
  217    HB3  TYR  32           HB1      TYR  32  25.588   5.437  -4.448
  218    HD1  TYR  32           HD1      TYR  32  25.995   5.072  -8.064
  219    HD2  TYR  32           HD2      TYR  32  27.256   7.266  -4.594
  220    HE1  TYR  32           HE1      TYR  32  26.953   6.832  -9.525
  221    HE2  TYR  32           HE2      TYR  32  28.214   9.026  -6.054
  222    HH   TYR  32           HH       TYR  32  27.486   9.325  -9.289
  223    H    GLY  33           HN       GLY  33  29.217   4.963  -5.907
  224    HA2  GLY  33           HA2      GLY  33  29.100   3.861  -8.543
  225    HA3  GLY  33           HA1      GLY  33  30.471   4.704  -7.828
  226    H    SER  34           HN       SER  34  30.468   2.291  -9.476
  227    HA   SER  34           HA       SER  34  31.428   0.275  -7.550
  228    HB2  SER  34           HB2      SER  34  30.674   0.003 -10.466
  229    HB3  SER  34           HB1      SER  34  31.286  -1.304  -9.457
  230    HG   SER  34           HG       SER  34  29.482  -0.919  -8.067
  231    H    SER  35           HN       SER  35  32.634   2.767  -9.330
  232    HA   SER  35           HA       SER  35  34.861   1.642 -10.645
  233    HB2  SER  35           HB2      SER  35  35.615   3.881 -10.864
  234    HB3  SER  35           HB1      SER  35  33.855   3.966 -10.906
  235    HG   SER  35           HG       SER  35  35.596   4.511  -8.733
  236    H    SER  36           HN       SER  36  34.181   2.241  -7.315
  237    HA   SER  36           HA       SER  36  36.869   1.304  -6.609
  238    HB2  SER  36           HB2      SER  36  37.012   3.740  -6.459
  239    HB3  SER  36           HB1      SER  36  35.570   3.781  -5.449
  240    HG   SER  36           HG       SER  36  36.679   2.924  -3.811
  241    H    ARG  37           HN       ARG  37  36.961   0.145  -4.704
  242    HA   ARG  37           HA       ARG  37  34.534  -1.092  -3.847
  243    HB2  ARG  37           HB2      ARG  37  37.344  -1.195  -2.735
  244    HB3  ARG  37           HB1      ARG  37  36.013  -2.203  -2.166
  245    HG2  ARG  37           HG2      ARG  37  35.758  -3.213  -4.350
  246    HG3  ARG  37           HG1      ARG  37  36.934  -2.098  -5.048
  247    HD2  ARG  37           HD2      ARG  37  38.029  -4.224  -4.629
  248    HD3  ARG  37           HD1      ARG  37  38.665  -3.021  -3.512
  249    HE   ARG  37           HE       ARG  37  36.487  -4.385  -2.311
  250   HH11  ARG  37          HH11      ARG  37  39.807  -4.828  -3.292
  251   HH12  ARG  37          HH12      ARG  37  40.128  -6.024  -2.090
  252   HH21  ARG  37          HH21      ARG  37  36.940  -5.957  -0.745
  253   HH22  ARG  37          HH22      ARG  37  38.519  -6.661  -0.656
  254    H    ARG  38           HN       ARG  38  33.616  -1.060  -1.736
  255    HA   ARG  38           HA       ARG  38  33.254   1.511  -0.660
  256    HB2  ARG  38           HB2      ARG  38  31.575  -0.229  -0.386
  257    HB3  ARG  38           HB1      ARG  38  32.700  -1.205   0.560
  258    HG2  ARG  38           HG2      ARG  38  31.140  -0.005   2.041
  259    HG3  ARG  38           HG1      ARG  38  32.782   0.584   2.282
  260    HD2  ARG  38           HD2      ARG  38  32.350   2.519   0.885
  261    HD3  ARG  38           HD1      ARG  38  30.761   1.896   0.450
  262    HE   ARG  38           HE       ARG  38  30.794   2.097   3.220
  263   HH11  ARG  38          HH11      ARG  38  31.179   4.206   0.466
  264   HH12  ARG  38          HH12      ARG  38  30.536   5.585   1.283
  265   HH21  ARG  38          HH21      ARG  38  29.950   3.918   4.259
  266   HH22  ARG  38          HH22      ARG  38  29.844   5.426   3.415
  267    H    ALA  39           HN       ALA  39  35.193  -1.236   0.474
  268    HA   ALA  39           HA       ALA  39  36.720   0.643   2.166
  269    HB1  ALA  39           HB1      ALA  39  35.966  -2.188   2.919
  270    HB2  ALA  39           HB2      ALA  39  35.183  -0.738   3.547
  271    HB3  ALA  39           HB3      ALA  39  36.883  -1.046   3.902
  272    HA   PRO  40           HA       PRO  40  39.569  -1.823  -0.496
  273    HB2  PRO  40           HB2      PRO  40  40.796   0.264  -1.736
  274    HB3  PRO  40           HB1      PRO  40  39.262  -0.424  -2.305
  275    HG2  PRO  40           HG2      PRO  40  39.781   2.099  -0.860
  276    HG3  PRO  40           HG1      PRO  40  38.503   1.693  -2.013
  277    HD2  PRO  40           HD2      PRO  40  38.248   1.773   0.800
  278    HD3  PRO  40           HD1      PRO  40  37.075   1.094  -0.343
  279    H    GLN  41           HN       GLN  41  39.838  -0.810   2.322
  280    HA   GLN  41           HA       GLN  41  42.731  -0.875   2.448
  281    HB2  GLN  41           HB2      GLN  41  42.239   1.525   2.312
  282    HB3  GLN  41           HB1      GLN  41  41.114   1.377   3.662
  283    HG2  GLN  41           HG2      GLN  41  42.924   0.635   5.125
  284    HG3  GLN  41           HG1      GLN  41  44.062   0.705   3.781
  285   HE21  GLN  41          HE21      GLN  41  44.850   2.276   5.820
  286   HE22  GLN  41          HE22      GLN  41  44.493   3.913   5.546
  287    H    THR  42           HN       THR  42  42.948  -2.606   3.711
  288    HA   THR  42           HA       THR  42  41.060  -3.277   5.784
  289    HB   THR  42           HB       THR  42  42.580  -5.163   6.233
  290    HG1  THR  42           HG1      THR  42  44.586  -4.783   5.807
  291   HG21  THR  42          HG21      THR  42  40.926  -5.149   4.303
  292   HG22  THR  42          HG22      THR  42  42.261  -6.290   4.148
  293   HG23  THR  42          HG23      THR  42  42.289  -4.773   3.248
  294    H    GLY  43           HN       GLY  43  41.756  -3.671   8.034
  295    HA2  GLY  43           HA2      GLY  43  43.876  -2.986   9.459
  296    HA3  GLY  43           HA1      GLY  43  43.297  -1.385   9.011
  297    H    ILE  44           HN       ILE  44  40.845  -1.068   9.445
  298    HA   ILE  44           HA       ILE  44  40.379  -1.348  12.202
  299    HB   ILE  44           HB       ILE  44  38.552  -0.702   9.887
  300   HG12  ILE  44          HG12      ILE  44  39.631   1.061  12.099
  301   HG13  ILE  44          HG11      ILE  44  40.437   0.873  10.542
  302   HG21  ILE  44          HG21      ILE  44  38.016  -0.705  12.858
  303   HG22  ILE  44          HG22      ILE  44  37.154  -1.609  11.614
  304   HG23  ILE  44          HG23      ILE  44  37.012   0.144  11.684
  305   HD11  ILE  44          HD11      ILE  44  37.571   1.803  10.901
  306   HD12  ILE  44          HD12      ILE  44  38.450   1.696   9.376
  307   HD13  ILE  44          HD13      ILE  44  38.945   2.869  10.598
  308    H    VAL  45           HN       VAL  45  39.009  -3.092   9.416
  309    HA   VAL  45           HA       VAL  45  37.321  -4.800  10.897
  310    HB   VAL  45           HB       VAL  45  38.600  -5.101   8.178
  311   HG11  VAL  45          HG11      VAL  45  36.649  -6.878   9.668
  312   HG12  VAL  45          HG12      VAL  45  38.181  -7.341   8.922
  313   HG13  VAL  45          HG13      VAL  45  36.802  -6.901   7.910
  314   HG21  VAL  45          HG21      VAL  45  36.970  -3.326   8.271
  315   HG22  VAL  45          HG22      VAL  45  35.853  -4.325   9.200
  316   HG23  VAL  45          HG23      VAL  45  36.181  -4.709   7.509
  317    H    ASP  46           HN       ASP  46  40.620  -5.265   9.665
  318    HA   ASP  46           HA       ASP  46  40.937  -7.905  10.609
  319    HB2  ASP  46           HB2      ASP  46  42.931  -5.732   9.976
  320    HB3  ASP  46           HB1      ASP  46  43.404  -7.362  10.445
  321    H    GLU  47           HN       GLU  47  41.614  -4.757  12.115
  322    HA   GLU  47           HA       GLU  47  42.984  -5.736  14.368
  323    HB2  GLU  47           HB2      GLU  47  42.938  -3.362  13.729
  324    HB3  GLU  47           HB1      GLU  47  41.217  -3.293  14.116
  325    HG2  GLU  47           HG2      GLU  47  42.544  -2.426  15.988
  326    HG3  GLU  47           HG1      GLU  47  41.728  -3.913  16.460
  327    H    CYS  48           HN       CYS  48  39.522  -4.915  13.979
  328    HA   CYS  48           HA       CYS  48  38.789  -5.800  16.601
  329    HB2  CYS  48           HB2      CYS  48  37.129  -5.338  14.118
  330    HB3  CYS  48           HB1      CYS  48  36.479  -5.690  15.707
  331    H    CYS  49           HN       CYS  49  38.683  -7.298  13.395
  332    HA   CYS  49           HA       CYS  49  37.296  -9.635  14.102
  333    HB2  CYS  49           HB2      CYS  49  37.649  -8.929  11.772
  334    HB3  CYS  49           HB1      CYS  49  39.373  -9.258  11.937
  335    H    PHE  50           HN       PHE  50  40.796  -9.004  13.902
  336    HA   PHE  50           HA       PHE  50  41.372 -11.624  14.992
  337    HB2  PHE  50           HB2      PHE  50  43.048  -9.323  14.019
  338    HB3  PHE  50           HB1      PHE  50  43.782 -10.714  14.831
  339    HD1  PHE  50           HD1      PHE  50  41.724  -9.610  11.954
  340    HD2  PHE  50           HD2      PHE  50  43.999 -12.821  13.672
  341    HE1  PHE  50           HE1      PHE  50  41.605 -10.828   9.804
  342    HE2  PHE  50           HE2      PHE  50  43.883 -14.050  11.520
  343    HZ   PHE  50           HZ       PHE  50  42.688 -13.055   9.585
  344    H    ARG  51           HN       ARG  51  42.523  -8.367  15.874
  345    HA   ARG  51           HA       ARG  51  42.954  -9.141  18.620
  346    HB2  ARG  51           HB2      ARG  51  43.241  -6.515  17.158
  347    HB3  ARG  51           HB1      ARG  51  43.585  -6.712  18.876
  348    HG2  ARG  51           HG2      ARG  51  45.262  -8.420  18.382
  349    HG3  ARG  51           HG1      ARG  51  44.888  -8.320  16.660
  350    HD2  ARG  51           HD2      ARG  51  45.600  -5.979  16.615
  351    HD3  ARG  51           HD1      ARG  51  45.916  -6.023  18.347
  352    HE   ARG  51           HE       ARG  51  47.417  -8.068  17.144
  353   HH11  ARG  51          HH11      ARG  51  47.204  -4.585  17.175
  354   HH12  ARG  51          HH12      ARG  51  48.883  -4.360  16.849
  355   HH21  ARG  51          HH21      ARG  51  49.616  -7.739  16.721
  356   HH22  ARG  51          HH22      ARG  51  50.244  -6.129  16.594
  357    H    SER  52           HN       SER  52  42.098  -7.709  20.401
  358    HA   SER  52           HA       SER  52  39.200  -7.443  20.046
  359    HB2  SER  52           HB2      SER  52  40.938  -7.430  22.523
  360    HB3  SER  52           HB1      SER  52  39.186  -7.249  22.532
  361    HG   SER  52           HG       SER  52  39.071  -9.332  22.371
  362    H    CYS  53           HN       CYS  53  39.264  -5.476  18.812
  363    HA   CYS  53           HA       CYS  53  40.515  -3.109  19.789
  364    HB2  CYS  53           HB2      CYS  53  39.259  -1.968  18.046
  365    HB3  CYS  53           HB1      CYS  53  39.897  -3.479  17.404
  366    H    ASP  54           HN       ASP  54  39.656  -1.372  20.897
  367    HA   ASP  54           HA       ASP  54  37.561  -1.966  22.757
  368    HB2  ASP  54           HB2      ASP  54  39.139   0.537  22.168
  369    HB3  ASP  54           HB1      ASP  54  37.896   0.459  23.415
  370    H    LEU  55           HN       LEU  55  35.510  -1.095  22.912
  371    HA   LEU  55           HA       LEU  55  34.132  -0.575  20.495
  372    HB2  LEU  55           HB2      LEU  55  33.350  -0.202  23.389
  373    HB3  LEU  55           HB1      LEU  55  32.243   0.080  22.045
  374    HG   LEU  55           HG       LEU  55  33.737  -2.527  22.424
  375   HD11  LEU  55          HD11      LEU  55  30.861  -1.931  23.171
  376   HD12  LEU  55          HD12      LEU  55  32.180  -1.965  24.342
  377   HD13  LEU  55          HD13      LEU  55  31.752  -3.427  23.454
  378   HD21  LEU  55          HD21      LEU  55  31.764  -3.293  20.959
  379   HD22  LEU  55          HD22      LEU  55  32.976  -2.288  20.170
  380   HD23  LEU  55          HD23      LEU  55  31.443  -1.581  20.683
  381    H    ARG  56           HN       ARG  56  35.412   1.529  23.028
  382    HA   ARG  56           HA       ARG  56  34.220   3.934  22.225
  383    HB2  ARG  56           HB2      ARG  56  35.442   3.683  24.339
  384    HB3  ARG  56           HB1      ARG  56  36.955   3.495  23.450
  385    HG2  ARG  56           HG2      ARG  56  36.685   5.750  22.495
  386    HG3  ARG  56           HG1      ARG  56  35.163   5.940  23.365
  387    HD2  ARG  56           HD2      ARG  56  36.328   5.713  25.505
  388    HD3  ARG  56           HD1      ARG  56  37.853   5.440  24.668
  389    HE   ARG  56           HE       ARG  56  36.757   7.900  23.812
  390   HH11  ARG  56          HH11      ARG  56  38.182   6.389  26.615
  391   HH12  ARG  56          HH12      ARG  56  38.821   7.869  27.236
  392   HH21  ARG  56          HH21      ARG  56  37.609   9.823  24.648
  393   HH22  ARG  56          HH22      ARG  56  38.501   9.800  26.134
  394    H    ARG  57           HN       ARG  57  37.327   2.485  21.227
  395    HA   ARG  57           HA       ARG  57  38.060   4.562  19.458
  396    HB2  ARG  57           HB2      ARG  57  39.497   2.676  20.467
  397    HB3  ARG  57           HB1      ARG  57  38.899   1.708  19.116
  398    HG2  ARG  57           HG2      ARG  57  39.834   3.161  17.507
  399    HG3  ARG  57           HG1      ARG  57  40.075   4.444  18.695
  400    HD2  ARG  57           HD2      ARG  57  42.223   3.404  18.274
  401    HD3  ARG  57           HD1      ARG  57  41.689   2.951  19.889
  402    HE   ARG  57           HE       ARG  57  41.397   0.763  19.157
  403   HH11  ARG  57          HH11      ARG  57  41.964   2.887  16.440
  404   HH12  ARG  57          HH12      ARG  57  42.207   1.589  15.330
  405   HH21  ARG  57          HH21      ARG  57  41.749  -0.908  17.671
  406   HH22  ARG  57          HH22      ARG  57  42.084  -0.537  16.013
  407    H    LEU  58           HN       LEU  58  36.195   1.598  19.079
  408    HA   LEU  58           HA       LEU  58  36.039   1.513  16.276
  409    HB2  LEU  58           HB2      LEU  58  35.261  -0.246  17.968
  410    HB3  LEU  58           HB1      LEU  58  33.784   0.709  18.113
  411    HG   LEU  58           HG       LEU  58  33.675   0.594  15.538
  412   HD11  LEU  58          HD11      LEU  58  35.746  -1.522  16.164
  413   HD12  LEU  58          HD12      LEU  58  35.872  -0.193  15.020
  414   HD13  LEU  58          HD13      LEU  58  34.792  -1.538  14.682
  415   HD21  LEU  58          HD21      LEU  58  32.745  -1.783  15.664
  416   HD22  LEU  58          HD22      LEU  58  32.077  -0.635  16.822
  417   HD23  LEU  58          HD23      LEU  58  33.289  -1.805  17.340
  418    H    ASP  59           HN       ASP  59  34.253   3.390  18.652
  419    HA   ASP  59           HA       ASP  59  32.125   4.259  17.043
  420    HB2  ASP  59           HB2      ASP  59  33.503   5.549  19.390
  421    HB3  ASP  59           HB1      ASP  59  32.069   6.229  18.629
  422    H    MET  60           HN       MET  60  35.461   5.154  17.056
  423    HA   MET  60           HA       MET  60  35.340   7.753  15.983
  424    HB2  MET  60           HB2      MET  60  37.404   5.566  15.694
  425    HB3  MET  60           HB1      MET  60  37.630   7.204  15.103
  426    HG2  MET  60           HG2      MET  60  36.877   6.628  17.971
  427    HG3  MET  60           HG1      MET  60  38.556   6.732  17.439
  428    HE1  MET  60           HE1      MET  60  38.898  10.128  15.885
  429    HE2  MET  60           HE2      MET  60  39.204   8.397  15.737
  430    HE3  MET  60           HE3      MET  60  39.813   9.279  17.136
  431    H    TYR  61           HN       TYR  61  35.122   4.580  14.475
  432    HA   TYR  61           HA       TYR  61  35.302   5.603  11.781
  433    HB2  TYR  61           HB2      TYR  61  34.181   2.909  12.503
  434    HB3  TYR  61           HB1      TYR  61  35.099   3.383  11.080
  435    HD1  TYR  61           HD1      TYR  61  35.524   1.241  13.541
  436    HD2  TYR  61           HD2      TYR  61  37.326   4.927  12.263
  437    HE1  TYR  61           HE1      TYR  61  37.644   0.597  14.658
  438    HE2  TYR  61           HE2      TYR  61  39.439   4.291  13.389
  439    HH   TYR  61           HH       TYR  61  40.023   1.115  14.513
  440    H    CYS  62           HN       CYS  62  32.961   6.144  13.939
  441    HA   CYS  62           HA       CYS  62  30.615   5.416  12.461
  442    HB2  CYS  62           HB2      CYS  62  31.074   7.332  14.758
  443    HB3  CYS  62           HB1      CYS  62  29.484   6.982  14.086
  444    H    ALA  63           HN       ALA  63  29.048   7.101  11.738
  445    HA   ALA  63           HA       ALA  63  30.484   9.302  10.386
  446    HB1  ALA  63           HB1      ALA  63  27.910   8.205   9.358
  447    HB2  ALA  63           HB2      ALA  63  29.413   7.338   9.044
  448    HB3  ALA  63           HB3      ALA  63  29.222   9.004   8.493
  449    HA   PRO  64           HA       PRO  64  27.592  11.366  13.363
  450    HB2  PRO  64           HB2      PRO  64  29.374  13.631  12.602
  451    HB3  PRO  64           HB1      PRO  64  28.874  13.079  14.214
  452    HG2  PRO  64           HG2      PRO  64  31.329  12.633  13.320
  453    HG3  PRO  64           HG1      PRO  64  30.470  11.418  14.287
  454    HD2  PRO  64           HD2      PRO  64  30.946  11.465  11.315
  455    HD3  PRO  64           HD1      PRO  64  30.964  10.090  12.444
  456    H    LEU  65           HN       LEU  65  25.879  12.776  12.972
  457    HA   LEU  65           HA       LEU  65  25.146  13.178  10.229
  458    HB2  LEU  65           HB2      LEU  65  23.867  14.247  12.759
  459    HB3  LEU  65           HB1      LEU  65  23.128  14.220  11.158
  460    HG   LEU  65           HG       LEU  65  24.057  11.771  12.675
  461   HD11  LEU  65          HD11      LEU  65  22.132  12.603  13.809
  462   HD12  LEU  65          HD12      LEU  65  21.540  11.328  12.742
  463   HD13  LEU  65          HD13      LEU  65  21.334  13.022  12.293
  464   HD21  LEU  65          HD21      LEU  65  22.629  10.639  10.878
  465   HD22  LEU  65          HD22      LEU  65  24.161  11.320  10.329
  466   HD23  LEU  65          HD23      LEU  65  22.654  12.184  10.028
  467    H    LYS  66           HN       LYS  66  25.003  15.065   9.070
  468    HA   LYS  66           HA       LYS  66  26.919  17.065   9.697
  469    HB2  LYS  66           HB2      LYS  66  24.791  16.928   7.560
  470    HB3  LYS  66           HB1      LYS  66  25.979  18.226   7.676
  471    HG2  LYS  66           HG2      LYS  66  27.807  16.585   7.509
  472    HG3  LYS  66           HG1      LYS  66  26.626  15.278   7.398
  473    HD2  LYS  66           HD2      LYS  66  25.713  16.267   5.334
  474    HD3  LYS  66           HD1      LYS  66  26.885  17.582   5.441
  475    HE2  LYS  66           HE2      LYS  66  28.732  15.964   5.271
  476    HE3  LYS  66           HE1      LYS  66  27.571  14.638   5.183
  477    HZ1  LYS  66           HZ1      LYS  66  28.311  15.275   2.985
  478    HZ2  LYS  66           HZ2      LYS  66  27.814  16.880   3.248
  479    HZ3  LYS  66           HZ3      LYS  66  26.663  15.633   3.168
  480    HA   PRO  67           HA       PRO  67  24.721  20.076  12.055
  481    HB2  PRO  67           HB2      PRO  67  25.419  22.092   9.965
  482    HB3  PRO  67           HB1      PRO  67  25.732  22.123  11.710
  483    HG2  PRO  67           HG2      PRO  67  27.682  21.632   9.990
  484    HG3  PRO  67           HG1      PRO  67  27.589  20.770  11.537
  485    HD2  PRO  67           HD2      PRO  67  26.909  19.790   8.787
  486    HD3  PRO  67           HD1      PRO  67  27.641  18.919  10.154
  487    H    ALA  68           HN       ALA  68  22.641  20.844  12.183
  488    HA   ALA  68           HA       ALA  68  20.773  20.246  10.167
  489    HB1  ALA  68           HB1      ALA  68  20.670  21.877  12.686
  490    HB2  ALA  68           HB2      ALA  68  19.880  20.340  12.326
  491    HB3  ALA  68           HB3      ALA  68  19.286  21.830  11.593
  492    H    LYS  69           HN       LYS  69  22.354  23.270  11.068
  493    HA   LYS  69           HA       LYS  69  21.780  24.358   8.426
  494    HB2  LYS  69           HB2      LYS  69  20.757  26.402   9.275
  495    HB3  LYS  69           HB1      LYS  69  19.809  25.007   9.788
  496    HG2  LYS  69           HG2      LYS  69  20.965  25.042  11.981
  497    HG3  LYS  69           HG1      LYS  69  21.867  26.469  11.468
  498    HD2  LYS  69           HD2      LYS  69  19.761  27.713  11.181
  499    HD3  LYS  69           HD1      LYS  69  18.848  26.288  11.681
  500    HE2  LYS  69           HE2      LYS  69  19.973  26.329  13.875
  501    HE3  LYS  69           HE1      LYS  69  20.891  27.751  13.379
  502    HZ1  LYS  69           HZ1      LYS  69  18.584  28.742  12.908
  503    HZ2  LYS  69           HZ2      LYS  69  19.112  28.646  14.520
  504    HZ3  LYS  69           HZ3      LYS  69  18.003  27.507  13.917
  505    H    SER  70           HN       SER  70  22.955  26.385   8.031
  506    HA   SER  70           HA       SER  70  25.635  26.233   8.915
  507    HB2  SER  70           HB2      SER  70  25.957  28.316   7.688
  508    HB3  SER  70           HB1      SER  70  24.944  27.222   6.752
  509    HG   SER  70           HG       SER  70  23.249  28.481   7.093
  510    H    ALA  71           HN       ALA  71  22.841  27.847  10.187
  511    HA   ALA  71           HA       ALA  71  24.400  29.640  11.871
  512    HB1  ALA  71           HB1      ALA  71  21.419  29.116  11.796
  513    HB2  ALA  71           HB2      ALA  71  22.253  30.397  10.915
  514    HB3  ALA  71           HB3      ALA  71  22.220  30.416  12.679
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1  30.574 -15.764  10.070
    2    H2   GLY   1           HT2      GLY   1  32.253 -15.726   9.817
    3    H3   GLY   1           HT3      GLY   1  31.526 -14.628  10.892
    4    HA2  GLY   1           HA2      GLY   1  31.203 -16.191  12.526
    5    HA3  GLY   1           HA1      GLY   1  31.256 -17.519  11.365
    6    H    GLY   2           HN       GLY   2  32.786 -17.731  13.604
    7    HA2  GLY   2           HA2      GLY   2  35.349 -18.270  12.632
    8    HA3  GLY   2           HA1      GLY   2  35.415 -16.691  13.409
    9    HA   PRO   3           HA       PRO   3  35.920 -20.039  16.629
   10    HB2  PRO   3           HB2      PRO   3  38.353 -19.224  17.558
   11    HB3  PRO   3           HB1      PRO   3  38.164 -20.348  16.199
   12    HG2  PRO   3           HG2      PRO   3  38.773 -17.437  16.175
   13    HG3  PRO   3           HG1      PRO   3  39.406 -18.734  15.146
   14    HD2  PRO   3           HD2      PRO   3  37.418 -16.994  14.342
   15    HD3  PRO   3           HD1      PRO   3  37.610 -18.638  13.691
   16    H    GLU   4           HN       GLU   4  34.106 -18.419  17.277
   17    HA   GLU   4           HA       GLU   4  33.164 -17.094  18.899
   18    HB2  GLU   4           HB2      GLU   4  35.698 -17.901  20.340
   19    HB3  GLU   4           HB1      GLU   4  34.371 -17.027  21.099
   20    HG2  GLU   4           HG2      GLU   4  32.832 -18.847  20.616
   21    HG3  GLU   4           HG1      GLU   4  34.076 -19.702  19.705
   22    H    THR   5           HN       THR   5  34.459 -15.734  16.859
   23    HA   THR   5           HA       THR   5  35.438 -13.354  18.306
   24    HB   THR   5           HB       THR   5  37.029 -12.931  16.471
   25    HG1  THR   5           HG1      THR   5  37.275 -14.408  14.868
   26   HG21  THR   5          HG21      THR   5  37.492 -15.739  17.448
   27   HG22  THR   5          HG22      THR   5  37.544 -14.375  18.562
   28   HG23  THR   5          HG23      THR   5  38.669 -14.453  17.208
   29    H    LEU   6           HN       LEU   6  35.165 -11.340  17.083
   30    HA   LEU   6           HA       LEU   6  32.620 -11.362  15.651
   31    HB2  LEU   6           HB2      LEU   6  34.353  -9.055  16.577
   32    HB3  LEU   6           HB1      LEU   6  32.734  -8.914  15.891
   33    HG   LEU   6           HG       LEU   6  33.390 -10.490  18.394
   34   HD11  LEU   6          HD11      LEU   6  32.107  -7.757  18.088
   35   HD12  LEU   6          HD12      LEU   6  33.727  -8.057  18.714
   36   HD13  LEU   6          HD13      LEU   6  32.317  -8.635  19.603
   37   HD21  LEU   6          HD21      LEU   6  30.826  -9.739  16.966
   38   HD22  LEU   6          HD22      LEU   6  30.853 -10.293  18.640
   39   HD23  LEU   6          HD23      LEU   6  31.413 -11.358  17.354
   40    H    CYS   7           HN       CYS   7  33.285 -12.303  13.671
   41    HA   CYS   7           HA       CYS   7  34.652 -10.390  11.902
   42    HB2  CYS   7           HB2      CYS   7  35.233 -13.358  12.033
   43    HB3  CYS   7           HB1      CYS   7  35.869 -12.245  10.826
   44    H    GLY   8           HN       GLY   8  34.029 -10.522   9.708
   45    HA2  GLY   8           HA2      GLY   8  32.776 -11.342   7.885
   46    HA3  GLY   8           HA1      GLY   8  31.898 -12.397   8.988
   47    H    ALA   9           HN       ALA   9  29.890 -11.720   8.144
   48    HA   ALA   9           HA       ALA   9  29.037  -9.052   7.906
   49    HB1  ALA   9           HB1      ALA   9  27.412 -11.545   8.459
   50    HB2  ALA   9           HB2      ALA   9  27.820 -10.899   6.869
   51    HB3  ALA   9           HB3      ALA   9  26.750  -9.995   7.941
   52    H    GLU  10           HN       GLU  10  29.032 -11.285  10.633
   53    HA   GLU  10           HA       GLU  10  27.370  -9.850  12.380
   54    HB2  GLU  10           HB2      GLU  10  29.715 -11.686  12.902
   55    HB3  GLU  10           HB1      GLU  10  28.696 -11.034  14.186
   56    HG2  GLU  10           HG2      GLU  10  26.726 -12.077  13.231
   57    HG3  GLU  10           HG1      GLU  10  27.643 -12.608  11.822
   58    H    LEU  11           HN       LEU  11  30.858  -9.614  11.783
   59    HA   LEU  11           HA       LEU  11  31.399  -7.701  13.795
   60    HB2  LEU  11           HB2      LEU  11  33.181  -8.999  12.743
   61    HB3  LEU  11           HB1      LEU  11  32.844  -8.244  11.191
   62    HG   LEU  11           HG       LEU  11  33.414  -6.039  12.126
   63   HD11  LEU  11          HD11      LEU  11  32.788  -6.259  14.421
   64   HD12  LEU  11          HD12      LEU  11  34.538  -6.064  14.425
   65   HD13  LEU  11          HD13      LEU  11  33.830  -7.662  14.643
   66   HD21  LEU  11          HD21      LEU  11  35.676  -7.849  12.941
   67   HD22  LEU  11          HD22      LEU  11  35.730  -6.334  12.040
   68   HD23  LEU  11          HD23      LEU  11  35.164  -7.809  11.257
   69    H    VAL  12           HN       VAL  12  30.583  -7.395  10.359
   70    HA   VAL  12           HA       VAL  12  30.869  -4.610  10.152
   71    HB   VAL  12           HB       VAL  12  29.209  -6.623   8.646
   72   HG11  VAL  12          HG11      VAL  12  28.874  -4.691   6.999
   73   HG12  VAL  12          HG12      VAL  12  29.365  -3.611   8.304
   74   HG13  VAL  12          HG13      VAL  12  27.915  -4.602   8.476
   75   HG21  VAL  12          HG21      VAL  12  31.547  -6.757   8.174
   76   HG22  VAL  12          HG22      VAL  12  31.707  -5.002   8.106
   77   HG23  VAL  12          HG23      VAL  12  30.835  -5.859   6.834
   78    H    ASP  13           HN       ASP  13  28.097  -6.622  11.066
   79    HA   ASP  13           HA       ASP  13  26.164  -4.589  11.244
   80    HB2  ASP  13           HB2      ASP  13  25.667  -7.024  11.309
   81    HB3  ASP  13           HB1      ASP  13  26.361  -7.096  12.928
   82    H    ALA  14           HN       ALA  14  28.540  -5.783  13.582
   83    HA   ALA  14           HA       ALA  14  27.636  -4.372  15.840
   84    HB1  ALA  14           HB1      ALA  14  30.502  -5.047  15.138
   85    HB2  ALA  14           HB2      ALA  14  29.360  -6.179  15.862
   86    HB3  ALA  14           HB3      ALA  14  29.852  -4.736  16.749
   87    H    LEU  15           HN       LEU  15  29.882  -3.449  13.249
   88    HA   LEU  15           HA       LEU  15  30.680  -0.963  14.311
   89    HB2  LEU  15           HB2      LEU  15  30.460  -1.978  11.475
   90    HB3  LEU  15           HB1      LEU  15  31.121  -0.391  11.871
   91    HG   LEU  15           HG       LEU  15  32.148  -2.943  13.130
   92   HD11  LEU  15          HD11      LEU  15  32.397  -2.929  10.616
   93   HD12  LEU  15          HD12      LEU  15  33.925  -2.958  11.496
   94   HD13  LEU  15          HD13      LEU  15  33.349  -1.451  10.780
   95   HD21  LEU  15          HD21      LEU  15  33.180  -0.100  12.890
   96   HD22  LEU  15          HD22      LEU  15  34.150  -1.442  13.498
   97   HD23  LEU  15          HD23      LEU  15  32.707  -0.937  14.367
   98    H    GLN  16           HN       GLN  16  27.978  -1.822  12.168
   99    HA   GLN  16           HA       GLN  16  27.017   0.824  11.829
  100    HB2  GLN  16           HB2      GLN  16  26.412  -1.068  10.343
  101    HB3  GLN  16           HB1      GLN  16  25.480  -1.779  11.660
  102    HG2  GLN  16           HG2      GLN  16  24.003  -0.504  10.180
  103    HG3  GLN  16           HG1      GLN  16  24.090   0.268  11.761
  104   HE21  GLN  16          HE21      GLN  16  25.804   0.409   8.582
  105   HE22  GLN  16          HE22      GLN  16  26.008   2.095   8.610
  106    H    PHE  17           HN       PHE  17  26.332  -1.731  14.173
  107    HA   PHE  17           HA       PHE  17  24.108  -0.562  15.425
  108    HB2  PHE  17           HB2      PHE  17  24.588  -2.827  15.945
  109    HB3  PHE  17           HB1      PHE  17  26.243  -2.450  16.420
  110    HD1  PHE  17           HD1      PHE  17  22.677  -2.119  17.379
  111    HD2  PHE  17           HD2      PHE  17  26.763  -1.573  18.600
  112    HE1  PHE  17           HE1      PHE  17  21.929  -1.752  19.714
  113    HE2  PHE  17           HE2      PHE  17  26.012  -1.212  20.937
  114    HZ   PHE  17           HZ       PHE  17  23.596  -1.300  21.495
  115    H    VAL  18           HN       VAL  18  27.571  -0.347  16.239
  116    HA   VAL  18           HA       VAL  18  27.238   1.355  18.469
  117    HB   VAL  18           HB       VAL  18  29.606   0.917  16.639
  118   HG11  VAL  18          HG11      VAL  18  30.889   1.886  18.597
  119   HG12  VAL  18          HG12      VAL  18  29.341   2.423  19.250
  120   HG13  VAL  18          HG13      VAL  18  29.913   3.055  17.706
  121   HG21  VAL  18          HG21      VAL  18  29.100  -1.099  17.798
  122   HG22  VAL  18          HG22      VAL  18  28.694  -0.237  19.282
  123   HG23  VAL  18          HG23      VAL  18  30.372  -0.338  18.754
  124    H    CYS  19           HN       CYS  19  28.011   2.046  15.070
  125    HA   CYS  19           HA       CYS  19  28.221   4.861  15.396
  126    HB2  CYS  19           HB2      CYS  19  27.575   3.230  12.929
  127    HB3  CYS  19           HB1      CYS  19  28.036   4.928  12.937
  128    H    GLY  20           HN       GLY  20  25.543   2.723  14.588
  129    HA2  GLY  20           HA2      GLY  20  23.273   3.072  14.520
  130    HA3  GLY  20           HA1      GLY  20  23.561   4.443  15.586
  131    H    ASP  21           HN       ASP  21  22.524   6.144  14.745
  132    HA   ASP  21           HA       ASP  21  21.860   6.519  12.047
  133    HB2  ASP  21           HB2      ASP  21  22.144   8.475  14.333
  134    HB3  ASP  21           HB1      ASP  21  21.550   8.941  12.741
  135    H    ARG  22           HN       ARG  22  24.709   7.456  13.894
  136    HA   ARG  22           HA       ARG  22  25.826   9.267  12.043
  137    HB2  ARG  22           HB2      ARG  22  27.154   7.446  14.062
  138    HB3  ARG  22           HB1      ARG  22  27.983   8.728  13.185
  139    HG2  ARG  22           HG2      ARG  22  25.520   9.195  14.884
  140    HG3  ARG  22           HG1      ARG  22  27.168   9.399  15.481
  141    HD2  ARG  22           HD2      ARG  22  26.854  11.541  14.757
  142    HD3  ARG  22           HD1      ARG  22  27.335  10.849  13.211
  143    HE   ARG  22           HE       ARG  22  24.512  10.621  13.627
  144   HH11  ARG  22          HH11      ARG  22  27.070  12.800  12.773
  145   HH12  ARG  22          HH12      ARG  22  26.058  13.830  11.828
  146   HH21  ARG  22          HH21      ARG  22  23.181  11.977  12.382
  147   HH22  ARG  22          HH22      ARG  22  23.857  13.368  11.604
  148    H    GLY  23           HN       GLY  23  26.009   5.749  12.311
  149    HA2  GLY  23           HA2      GLY  23  26.710   4.145  10.820
  150    HA3  GLY  23           HA1      GLY  23  26.503   5.359   9.561
  151    H    PHE  24           HN       PHE  24  28.442   4.144   8.717
  152    HA   PHE  24           HA       PHE  24  30.832   5.654   9.401
  153    HB2  PHE  24           HB2      PHE  24  32.229   3.710   9.799
  154    HB3  PHE  24           HB1      PHE  24  30.886   3.697  10.945
  155    HD1  PHE  24           HD1      PHE  24  32.459   2.015   8.115
  156    HD2  PHE  24           HD2      PHE  24  28.937   2.183  10.568
  157    HE1  PHE  24           HE1      PHE  24  31.769  -0.213   7.280
  158    HE2  PHE  24           HE2      PHE  24  28.249  -0.048   9.735
  159    HZ   PHE  24           HZ       PHE  24  29.664  -1.245   8.092
  160    H    TYR  25           HN       TYR  25  32.559   5.337   7.827
  161    HA   TYR  25           HA       TYR  25  31.930   3.875   5.397
  162    HB2  TYR  25           HB2      TYR  25  31.945   5.778   3.925
  163    HB3  TYR  25           HB1      TYR  25  30.734   6.077   5.173
  164    HD1  TYR  25           HD1      TYR  25  34.045   7.021   3.881
  165    HD2  TYR  25           HD2      TYR  25  31.125   7.716   6.953
  166    HE1  TYR  25           HE1      TYR  25  35.226   9.100   4.533
  167    HE2  TYR  25           HE2      TYR  25  32.305   9.797   7.603
  168    HH   TYR  25           HH       TYR  25  34.565  11.301   5.695
  169    H    PHE  26           HN       PHE  26  33.724   4.151   3.764
  170    HA   PHE  26           HA       PHE  26  36.299   4.555   5.164
  171    HB2  PHE  26           HB2      PHE  26  35.605   2.613   2.945
  172    HB3  PHE  26           HB1      PHE  26  37.224   2.862   3.599
  173    HD1  PHE  26           HD1      PHE  26  33.885   1.474   4.235
  174    HD2  PHE  26           HD2      PHE  26  37.783   2.179   5.894
  175    HE1  PHE  26           HE1      PHE  26  33.386  -0.111   6.077
  176    HE2  PHE  26           HE2      PHE  26  37.286   0.595   7.735
  177    HZ   PHE  26           HZ       PHE  26  35.087  -0.550   7.828
  178    H    ASN  27           HN       ASN  27  37.778   5.871   4.245
  179    HA   ASN  27           HA       ASN  27  36.949   7.365   1.870
  180    HB2  ASN  27           HB2      ASN  27  37.738   8.592   3.870
  181    HB3  ASN  27           HB1      ASN  27  39.304   7.794   3.724
  182   HD21  ASN  27          HD21      ASN  27  40.800   9.135   2.724
  183   HD22  ASN  27          HD22      ASN  27  40.446  10.238   1.482
  184    H    LYS  28           HN       LYS  28  37.471   6.432  -0.011
  185    HA   LYS  28           HA       LYS  28  38.672   5.330  -1.637
  186    HB2  LYS  28           HB2      LYS  28  40.946   6.775  -0.255
  187    HB3  LYS  28           HB1      LYS  28  41.006   6.079  -1.875
  188    HG2  LYS  28           HG2      LYS  28  39.173   7.567  -2.589
  189    HG3  LYS  28           HG1      LYS  28  39.106   8.264  -0.970
  190    HD2  LYS  28           HD2      LYS  28  41.448   9.025  -1.206
  191    HD3  LYS  28           HD1      LYS  28  41.502   8.341  -2.830
  192    HE2  LYS  28           HE2      LYS  28  39.654   9.837  -3.516
  193    HE3  LYS  28           HE1      LYS  28  39.621  10.529  -1.896
  194    HZ1  LYS  28           HZ1      LYS  28  41.986  11.141  -2.228
  195    HZ2  LYS  28           HZ2      LYS  28  40.919  11.939  -3.281
  196    HZ3  LYS  28           HZ3      LYS  28  41.855  10.639  -3.843
  197    HA   PRO  29           HA       PRO  29  40.113   2.128   1.485
  198    HB2  PRO  29           HB2      PRO  29  38.265   0.224   0.796
  199    HB3  PRO  29           HB1      PRO  29  37.997   1.438   2.060
  200    HG2  PRO  29           HG2      PRO  29  37.029   1.388  -0.753
  201    HG3  PRO  29           HG1      PRO  29  36.197   1.913   0.721
  202    HD2  PRO  29           HD2      PRO  29  37.303   3.667  -1.057
  203    HD3  PRO  29           HD1      PRO  29  37.159   4.018   0.679
  204    H    THR  30           HN       THR  30  39.340   2.157  -1.914
  205    HA   THR  30           HA       THR  30  41.510   0.221  -2.397
  206    HB   THR  30           HB       THR  30  40.216  -0.839  -4.170
  207    HG1  THR  30           HG1      THR  30  38.889   0.729  -4.883
  208   HG21  THR  30          HG21      THR  30  38.612  -0.644  -1.606
  209   HG22  THR  30          HG22      THR  30  40.003  -1.701  -1.853
  210   HG23  THR  30          HG23      THR  30  38.529  -1.953  -2.788
  211    H    GLY  31           HN       GLY  31  42.391   0.360  -4.615
  212    HA2  GLY  31           HA2      GLY  31  41.786   2.373  -6.452
  213    HA3  GLY  31           HA1      GLY  31  42.979   3.031  -5.334
  214    H    TYR  32           HN       TYR  32  42.911   1.979  -8.276
  215    HA   TYR  32           HA       TYR  32  44.686  -0.206  -8.432
  216    HB2  TYR  32           HB2      TYR  32  44.905   0.337 -10.756
  217    HB3  TYR  32           HB1      TYR  32  43.243   0.716 -10.301
  218    HD1  TYR  32           HD1      TYR  32  46.490   2.086 -11.303
  219    HD2  TYR  32           HD2      TYR  32  42.522   3.057  -9.977
  220    HE1  TYR  32           HE1      TYR  32  46.829   4.438 -12.015
  221    HE2  TYR  32           HE2      TYR  32  42.861   5.409 -10.688
  222    HH   TYR  32           HH       TYR  32  45.794   6.740 -11.295
  223    H    GLY  33           HN       GLY  33  45.179   3.174  -7.839
  224    HA2  GLY  33           HA2      GLY  33  47.869   3.444  -8.629
  225    HA3  GLY  33           HA1      GLY  33  47.063   4.418  -7.401
  226    H    SER  34           HN       SER  34  46.397   2.303  -5.617
  227    HA   SER  34           HA       SER  34  49.051   1.843  -4.449
  228    HB2  SER  34           HB2      SER  34  47.864   1.405  -2.381
  229    HB3  SER  34           HB1      SER  34  47.260   2.905  -3.078
  230    HG   SER  34           HG       SER  34  45.392   1.951  -2.930
  231    H    SER  35           HN       SER  35  46.659   0.200  -6.215
  232    HA   SER  35           HA       SER  35  46.915  -2.401  -5.107
  233    HB2  SER  35           HB2      SER  35  45.638  -3.130  -6.934
  234    HB3  SER  35           HB1      SER  35  45.098  -1.468  -6.683
  235    HG   SER  35           HG       SER  35  46.585  -2.595  -8.739
  236    H    SER  36           HN       SER  36  49.100  -0.492  -6.801
  237    HA   SER  36           HA       SER  36  50.349  -2.318  -8.514
  238    HB2  SER  36           HB2      SER  36  52.278  -0.810  -8.408
  239    HB3  SER  36           HB1      SER  36  50.785   0.113  -8.545
  240    HG   SER  36           HG       SER  36  52.620   0.037  -6.537
  241    H    ARG  37           HN       ARG  37  50.867  -1.617  -5.103
  242    HA   ARG  37           HA       ARG  37  52.144  -4.216  -4.753
  243    HB2  ARG  37           HB2      ARG  37  53.560  -1.592  -4.272
  244    HB3  ARG  37           HB1      ARG  37  54.056  -3.093  -3.489
  245    HG2  ARG  37           HG2      ARG  37  54.299  -4.157  -5.719
  246    HG3  ARG  37           HG1      ARG  37  53.868  -2.625  -6.478
  247    HD2  ARG  37           HD2      ARG  37  56.181  -2.907  -4.558
  248    HD3  ARG  37           HD1      ARG  37  56.358  -3.079  -6.301
  249    HE   ARG  37           HE       ARG  37  55.057  -0.663  -5.912
  250   HH11  ARG  37          HH11      ARG  37  58.035  -2.162  -4.959
  251   HH12  ARG  37          HH12      ARG  37  58.912  -0.676  -4.881
  252   HH21  ARG  37          HH21      ARG  37  56.211   1.290  -5.808
  253   HH22  ARG  37          HH22      ARG  37  57.884   1.278  -5.361
  254    H    ARG  38           HN       ARG  38  49.850  -2.241  -3.816
  255    HA   ARG  38           HA       ARG  38  50.015  -3.086  -1.006
  256    HB2  ARG  38           HB2      ARG  38  49.304  -0.317  -1.992
  257    HB3  ARG  38           HB1      ARG  38  49.029  -0.880  -0.348
  258    HG2  ARG  38           HG2      ARG  38  51.412  -1.272  -0.038
  259    HG3  ARG  38           HG1      ARG  38  51.732  -0.865  -1.725
  260    HD2  ARG  38           HD2      ARG  38  52.250   1.076  -0.383
  261    HD3  ARG  38           HD1      ARG  38  50.775   1.415  -1.282
  262    HE   ARG  38           HE       ARG  38  50.102   0.324   1.242
  263   HH11  ARG  38          HH11      ARG  38  51.438   3.158  -0.245
  264   HH12  ARG  38          HH12      ARG  38  50.880   4.229   0.988
  265   HH21  ARG  38          HH21      ARG  38  49.371   1.736   2.863
  266   HH22  ARG  38          HH22      ARG  38  49.712   3.430   2.748
  267    H    ALA  39           HN       ALA  39  48.063  -3.626  -0.068
  268    HA   ALA  39           HA       ALA  39  45.639  -3.329  -1.708
  269    HB1  ALA  39           HB1      ALA  39  46.986  -5.704  -1.644
  270    HB2  ALA  39           HB2      ALA  39  45.252  -5.554  -1.915
  271    HB3  ALA  39           HB3      ALA  39  45.863  -5.913  -0.300
  272    HA   PRO  40           HA       PRO  40  43.713  -2.415   2.142
  273    HB2  PRO  40           HB2      PRO  40  41.179  -3.352   1.753
  274    HB3  PRO  40           HB1      PRO  40  41.813  -1.911   0.938
  275    HG2  PRO  40           HG2      PRO  40  41.440  -4.664  -0.103
  276    HG3  PRO  40           HG1      PRO  40  41.255  -3.107  -0.924
  277    HD2  PRO  40           HD2      PRO  40  43.465  -4.761  -1.188
  278    HD3  PRO  40           HD1      PRO  40  43.471  -3.016  -1.518
  279    H    GLN  41           HN       GLN  41  45.247  -4.274   2.959
  280    HA   GLN  41           HA       GLN  41  43.701  -6.591   3.898
  281    HB2  GLN  41           HB2      GLN  41  46.666  -6.011   3.826
  282    HB3  GLN  41           HB1      GLN  41  45.975  -7.429   4.617
  283    HG2  GLN  41           HG2      GLN  41  45.025  -8.209   2.539
  284    HG3  GLN  41           HG1      GLN  41  45.473  -6.716   1.716
  285   HE21  GLN  41          HE21      GLN  41  46.355  -9.494   1.047
  286   HE22  GLN  41          HE22      GLN  41  48.050  -9.475   1.156
  287    H    THR  42           HN       THR  42  43.908  -3.626   4.930
  288    HA   THR  42           HA       THR  42  43.864  -4.394   7.752
  289    HB   THR  42           HB       THR  42  46.185  -3.653   7.304
  290    HG1  THR  42           HG1      THR  42  45.558  -3.167   9.314
  291   HG21  THR  42          HG21      THR  42  45.436  -2.090   5.418
  292   HG22  THR  42          HG22      THR  42  46.675  -1.466   6.507
  293   HG23  THR  42          HG23      THR  42  44.999  -0.945   6.687
  294    H    GLY  43           HN       GLY  43  42.678  -2.952   9.073
  295    HA2  GLY  43           HA2      GLY  43  41.683  -0.465   8.490
  296    HA3  GLY  43           HA1      GLY  43  40.556  -1.581   7.723
  297    H    ILE  44           HN       ILE  44  39.144  -0.413   9.371
  298    HA   ILE  44           HA       ILE  44  39.388  -0.941  12.141
  299    HB   ILE  44           HB       ILE  44  37.094  -0.184  12.310
  300   HG12  ILE  44          HG12      ILE  44  37.027  -0.522   9.294
  301   HG13  ILE  44          HG11      ILE  44  36.158  -1.518  10.458
  302   HG21  ILE  44          HG21      ILE  44  38.464   1.310  10.055
  303   HG22  ILE  44          HG22      ILE  44  38.899   1.474  11.757
  304   HG23  ILE  44          HG23      ILE  44  37.302   1.969  11.203
  305   HD11  ILE  44          HD11      ILE  44  35.744   1.423   9.906
  306   HD12  ILE  44          HD12      ILE  44  35.033   0.587  11.286
  307   HD13  ILE  44          HD13      ILE  44  34.597   0.110   9.644
  308    H    VAL  45           HN       VAL  45  37.981  -2.735   9.475
  309    HA   VAL  45           HA       VAL  45  36.494  -4.595  11.021
  310    HB   VAL  45           HB       VAL  45  37.634  -4.702   8.227
  311   HG11  VAL  45          HG11      VAL  45  36.094  -6.704   7.981
  312   HG12  VAL  45          HG12      VAL  45  35.968  -6.729   9.736
  313   HG13  VAL  45          HG13      VAL  45  37.532  -6.995   8.963
  314   HG21  VAL  45          HG21      VAL  45  35.737  -3.133   8.760
  315   HG22  VAL  45          HG22      VAL  45  34.783  -4.532   9.249
  316   HG23  VAL  45          HG23      VAL  45  35.317  -4.371   7.577
  317    H    ASP  46           HN       ASP  46  39.760  -4.704   9.626
  318    HA   ASP  46           HA       ASP  46  40.379  -7.320  10.502
  319    HB2  ASP  46           HB2      ASP  46  42.109  -4.961   9.755
  320    HB3  ASP  46           HB1      ASP  46  42.777  -6.535  10.187
  321    H    GLU  47           HN       GLU  47  40.731  -4.143  11.996
  322    HA   GLU  47           HA       GLU  47  42.399  -4.881  14.135
  323    HB2  GLU  47           HB2      GLU  47  41.919  -2.538  13.543
  324    HB3  GLU  47           HB1      GLU  47  40.246  -2.749  14.055
  325    HG2  GLU  47           HG2      GLU  47  40.919  -3.162  16.335
  326    HG3  GLU  47           HG1      GLU  47  42.620  -3.207  15.876
  327    H    CYS  48           HN       CYS  48  38.839  -4.605  14.028
  328    HA   CYS  48           HA       CYS  48  38.472  -5.657  16.665
  329    HB2  CYS  48           HB2      CYS  48  36.559  -5.315  14.349
  330    HB3  CYS  48           HB1      CYS  48  36.083  -5.833  15.956
  331    H    CYS  49           HN       CYS  49  38.309  -7.036  13.404
  332    HA   CYS  49           HA       CYS  49  37.313  -9.564  14.108
  333    HB2  CYS  49           HB2      CYS  49  37.403  -8.784  11.785
  334    HB3  CYS  49           HB1      CYS  49  39.167  -8.811  11.836
  335    H    PHE  50           HN       PHE  50  40.665  -8.443  13.716
  336    HA   PHE  50           HA       PHE  50  41.697 -10.976  14.678
  337    HB2  PHE  50           HB2      PHE  50  42.991  -8.426  13.722
  338    HB3  PHE  50           HB1      PHE  50  43.931  -9.750  14.425
  339    HD1  PHE  50           HD1      PHE  50  41.556  -8.855  11.695
  340    HD2  PHE  50           HD2      PHE  50  44.407 -11.711  13.161
  341    HE1  PHE  50           HE1      PHE  50  41.490 -10.023   9.514
  342    HE2  PHE  50           HE2      PHE  50  44.347 -12.888  10.978
  343    HZ   PHE  50           HZ       PHE  50  42.892 -12.047   9.155
  344    H    ARG  51           HN       ARG  51  42.384  -7.600  15.625
  345    HA   ARG  51           HA       ARG  51  43.092  -8.409  18.307
  346    HB2  ARG  51           HB2      ARG  51  42.807  -5.679  17.031
  347    HB3  ARG  51           HB1      ARG  51  43.391  -5.958  18.668
  348    HG2  ARG  51           HG2      ARG  51  45.251  -7.289  17.818
  349    HG3  ARG  51           HG1      ARG  51  44.638  -7.142  16.171
  350    HD2  ARG  51           HD2      ARG  51  46.424  -5.520  16.504
  351    HD3  ARG  51           HD1      ARG  51  44.890  -4.671  16.333
  352    HE   ARG  51           HE       ARG  51  45.465  -5.202  19.080
  353   HH11  ARG  51          HH11      ARG  51  46.288  -3.190  16.378
  354   HH12  ARG  51          HH12      ARG  51  46.771  -1.850  17.354
  355   HH21  ARG  51          HH21      ARG  51  46.101  -3.439  20.361
  356   HH22  ARG  51          HH22      ARG  51  46.667  -1.986  19.607
  357    H    SER  52           HN       SER  52  42.088  -7.375  20.219
  358    HA   SER  52           HA       SER  52  39.171  -7.489  19.996
  359    HB2  SER  52           HB2      SER  52  41.014  -7.399  22.393
  360    HB3  SER  52           HB1      SER  52  39.256  -7.478  22.490
  361    HG   SER  52           HG       SER  52  39.309  -9.507  21.872
  362    H    CYS  53           HN       CYS  53  38.778  -5.480  18.978
  363    HA   CYS  53           HA       CYS  53  39.712  -3.012  20.127
  364    HB2  CYS  53           HB2      CYS  53  38.376  -1.937  18.441
  365    HB3  CYS  53           HB1      CYS  53  39.149  -3.334  17.696
  366    H    ASP  54           HN       ASP  54  38.382  -1.388  21.095
  367    HA   ASP  54           HA       ASP  54  36.175  -2.543  22.672
  368    HB2  ASP  54           HB2      ASP  54  38.014  -0.200  23.163
  369    HB3  ASP  54           HB1      ASP  54  36.575  -0.506  24.134
  370    H    LEU  55           HN       LEU  55  34.489  -0.845  23.322
  371    HA   LEU  55           HA       LEU  55  33.049  -0.033  21.089
  372    HB2  LEU  55           HB2      LEU  55  32.955   0.558  23.997
  373    HB3  LEU  55           HB1      LEU  55  32.105   1.686  22.940
  374    HG   LEU  55           HG       LEU  55  30.722  -0.286  23.765
  375   HD11  LEU  55          HD11      LEU  55  31.016  -0.254  20.756
  376   HD12  LEU  55          HD12      LEU  55  30.340   1.117  21.632
  377   HD13  LEU  55          HD13      LEU  55  29.548  -0.458  21.708
  378   HD21  LEU  55          HD21      LEU  55  31.136  -2.456  22.890
  379   HD22  LEU  55          HD22      LEU  55  32.721  -1.881  23.404
  380   HD23  LEU  55          HD23      LEU  55  32.281  -1.850  21.697
  381    H    ARG  56           HN       ARG  56  35.470   1.709  22.952
  382    HA   ARG  56           HA       ARG  56  35.063   4.286  21.924
  383    HB2  ARG  56           HB2      ARG  56  36.542   3.838  23.827
  384    HB3  ARG  56           HB1      ARG  56  37.655   2.967  22.769
  385    HG2  ARG  56           HG2      ARG  56  38.108   4.977  21.492
  386    HG3  ARG  56           HG1      ARG  56  36.872   5.869  22.378
  387    HD2  ARG  56           HD2      ARG  56  38.141   5.608  24.458
  388    HD3  ARG  56           HD1      ARG  56  39.352   4.646  23.622
  389    HE   ARG  56           HE       ARG  56  40.242   6.612  22.747
  390   HH11  ARG  56          HH11      ARG  56  37.098   7.153  24.111
  391   HH12  ARG  56          HH12      ARG  56  37.193   8.869  23.982
  392   HH21  ARG  56          HH21      ARG  56  40.361   8.874  22.577
  393   HH22  ARG  56          HH22      ARG  56  39.034   9.848  23.115
  394    H    ARG  57           HN       ARG  57  37.039   1.594  20.697
  395    HA   ARG  57           HA       ARG  57  38.211   2.969  18.540
  396    HB2  ARG  57           HB2      ARG  57  38.000   0.225  19.474
  397    HB3  ARG  57           HB1      ARG  57  37.921   0.329  17.725
  398    HG2  ARG  57           HG2      ARG  57  40.238   0.201  18.164
  399    HG3  ARG  57           HG1      ARG  57  39.951   1.925  17.926
  400    HD2  ARG  57           HD2      ARG  57  41.284   1.719  19.909
  401    HD3  ARG  57           HD1      ARG  57  39.652   2.120  20.431
  402    HE   ARG  57           HE       ARG  57  39.991  -0.703  20.356
  403   HH11  ARG  57          HH11      ARG  57  40.872   2.151  22.118
  404   HH12  ARG  57          HH12      ARG  57  41.055   1.325  23.624
  405   HH21  ARG  57          HH21      ARG  57  40.233  -1.788  22.337
  406   HH22  ARG  57          HH22      ARG  57  40.695  -0.903  23.752
  407    H    LEU  58           HN       LEU  58  35.218   1.071  18.794
  408    HA   LEU  58           HA       LEU  58  34.476   1.179  16.082
  409    HB2  LEU  58           HB2      LEU  58  32.965   0.809  18.643
  410    HB3  LEU  58           HB1      LEU  58  32.106   0.953  17.113
  411    HG   LEU  58           HG       LEU  58  34.071  -0.818  16.460
  412   HD11  LEU  58          HD11      LEU  58  33.341  -1.199  19.362
  413   HD12  LEU  58          HD12      LEU  58  34.950  -1.142  18.643
  414   HD13  LEU  58          HD13      LEU  58  33.909  -2.537  18.365
  415   HD21  LEU  58          HD21      LEU  58  32.319  -2.412  16.312
  416   HD22  LEU  58          HD22      LEU  58  31.493  -0.860  16.185
  417   HD23  LEU  58          HD23      LEU  58  31.480  -1.740  17.710
  418    H    ASP  59           HN       ASP  59  33.816   3.353  18.777
  419    HA   ASP  59           HA       ASP  59  32.073   5.122  17.428
  420    HB2  ASP  59           HB2      ASP  59  33.948   5.551  19.760
  421    HB3  ASP  59           HB1      ASP  59  32.821   6.778  19.182
  422    H    MET  60           HN       MET  60  35.593   4.983  17.659
  423    HA   MET  60           HA       MET  60  36.155   7.486  16.481
  424    HB2  MET  60           HB2      MET  60  37.737   4.916  16.612
  425    HB3  MET  60           HB1      MET  60  38.381   6.410  15.931
  426    HG2  MET  60           HG2      MET  60  38.071   7.570  18.041
  427    HG3  MET  60           HG1      MET  60  37.249   6.176  18.731
  428    HE1  MET  60           HE1      MET  60  40.465   6.409  16.402
  429    HE2  MET  60           HE2      MET  60  41.683   6.608  17.660
  430    HE3  MET  60           HE3      MET  60  40.399   7.803  17.490
  431    H    TYR  61           HN       TYR  61  35.571   4.290  15.106
  432    HA   TYR  61           HA       TYR  61  36.231   5.036  12.406
  433    HB2  TYR  61           HB2      TYR  61  34.431   2.750  13.209
  434    HB3  TYR  61           HB1      TYR  61  35.478   2.875  11.807
  435    HD1  TYR  61           HD1      TYR  61  35.332   0.827  14.306
  436    HD2  TYR  61           HD2      TYR  61  37.939   4.019  13.098
  437    HE1  TYR  61           HE1      TYR  61  37.190  -0.214  15.575
  438    HE2  TYR  61           HE2      TYR  61  39.799   2.982  14.367
  439    HH   TYR  61           HH       TYR  61  40.468   0.922  15.289
  440    H    CYS  62           HN       CYS  62  33.408   5.277  14.408
  441    HA   CYS  62           HA       CYS  62  31.427   5.450  12.409
  442    HB2  CYS  62           HB2      CYS  62  31.546   6.762  15.134
  443    HB3  CYS  62           HB1      CYS  62  30.103   6.645  14.131
  444    H    ALA  63           HN       ALA  63  30.333   7.356  11.611
  445    HA   ALA  63           HA       ALA  63  32.063   9.261  10.519
  446    HB1  ALA  63           HB1      ALA  63  30.039   8.821   9.357
  447    HB2  ALA  63           HB2      ALA  63  29.897  10.476   9.946
  448    HB3  ALA  63           HB3      ALA  63  29.061   9.167  10.783
  449    HA   PRO  64           HA       PRO  64  32.370  12.231  13.766
  450    HB2  PRO  64           HB2      PRO  64  32.904  14.478  12.311
  451    HB3  PRO  64           HB1      PRO  64  34.085  13.175  12.553
  452    HG2  PRO  64           HG2      PRO  64  32.385  13.778  10.190
  453    HG3  PRO  64           HG1      PRO  64  34.048  13.175  10.266
  454    HD2  PRO  64           HD2      PRO  64  31.856  11.569   9.768
  455    HD3  PRO  64           HD1      PRO  64  33.380  10.974  10.459
  456    H    LEU  65           HN       LEU  65  31.312  14.053  14.733
  457    HA   LEU  65           HA       LEU  65  28.880  15.020  13.383
  458    HB2  LEU  65           HB2      LEU  65  27.694  14.753  15.632
  459    HB3  LEU  65           HB1      LEU  65  27.988  13.275  14.717
  460    HG   LEU  65           HG       LEU  65  30.214  14.010  16.483
  461   HD11  LEU  65          HD11      LEU  65  29.130  13.518  18.571
  462   HD12  LEU  65          HD12      LEU  65  27.622  13.101  17.757
  463   HD13  LEU  65          HD13      LEU  65  28.176  14.777  17.787
  464   HD21  LEU  65          HD21      LEU  65  30.211  11.654  16.915
  465   HD22  LEU  65          HD22      LEU  65  29.798  11.832  15.210
  466   HD23  LEU  65          HD23      LEU  65  28.534  11.493  16.395
  467    H    LYS  66           HN       LYS  66  31.390  16.317  13.805
  468    HA   LYS  66           HA       LYS  66  31.271  18.007  16.092
  469    HB2  LYS  66           HB2      LYS  66  32.823  18.255  13.511
  470    HB3  LYS  66           HB1      LYS  66  33.051  19.302  14.908
  471    HG2  LYS  66           HG2      LYS  66  33.623  17.357  16.299
  472    HG3  LYS  66           HG1      LYS  66  33.369  16.288  14.919
  473    HD2  LYS  66           HD2      LYS  66  35.167  17.449  13.687
  474    HD3  LYS  66           HD1      LYS  66  35.429  18.510  15.072
  475    HE2  LYS  66           HE2      LYS  66  35.704  15.489  15.114
  476    HE3  LYS  66           HE1      LYS  66  37.048  16.629  15.039
  477    HZ1  LYS  66           HZ1      LYS  66  36.752  16.026  17.295
  478    HZ2  LYS  66           HZ2      LYS  66  35.079  16.306  17.231
  479    HZ3  LYS  66           HZ3      LYS  66  36.165  17.609  17.136
  480    HA   PRO  67           HA       PRO  67  28.530  21.235  14.966
  481    HB2  PRO  67           HB2      PRO  67  30.734  23.190  15.425
  482    HB3  PRO  67           HB1      PRO  67  29.129  23.100  16.175
  483    HG2  PRO  67           HG2      PRO  67  31.298  22.391  17.519
  484    HG3  PRO  67           HG1      PRO  67  29.778  21.494  17.694
  485    HD2  PRO  67           HD2      PRO  67  32.245  20.732  16.159
  486    HD3  PRO  67           HD1      PRO  67  31.136  19.707  17.097
  487    H    ALA  68           HN       ALA  68  27.896  22.302  13.133
  488    HA   ALA  68           HA       ALA  68  29.450  22.059  10.768
  489    HB1  ALA  68           HB1      ALA  68  26.946  22.105  10.850
  490    HB2  ALA  68           HB2      ALA  68  27.635  23.220   9.671
  491    HB3  ALA  68           HB3      ALA  68  27.035  23.828  11.214
  492    H    LYS  69           HN       LYS  69  30.631  23.541   9.626
  493    HA   LYS  69           HA       LYS  69  30.753  26.316  10.476
  494    HB2  LYS  69           HB2      LYS  69  33.153  26.300  10.922
  495    HB3  LYS  69           HB1      LYS  69  32.331  25.189  12.018
  496    HG2  LYS  69           HG2      LYS  69  32.907  23.303  10.513
  497    HG3  LYS  69           HG1      LYS  69  33.773  24.425   9.462
  498    HD2  LYS  69           HD2      LYS  69  35.276  25.017  11.329
  499    HD3  LYS  69           HD1      LYS  69  34.416  23.888  12.377
  500    HE2  LYS  69           HE2      LYS  69  35.023  22.028  10.865
  501    HE3  LYS  69           HE1      LYS  69  35.899  23.158   9.834
  502    HZ1  LYS  69           HZ1      LYS  69  37.396  23.648  11.606
  503    HZ2  LYS  69           HZ2      LYS  69  37.322  21.958  11.441
  504    HZ3  LYS  69           HZ3      LYS  69  36.493  22.728  12.708
  505    H    SER  70           HN       SER  70  32.145  27.611   9.037
  506    HA   SER  70           HA       SER  70  31.681  26.998   6.320
  507    HB2  SER  70           HB2      SER  70  33.514  29.021   7.616
  508    HB3  SER  70           HB1      SER  70  33.201  28.948   5.884
  509    HG   SER  70           HG       SER  70  31.554  30.159   6.396
  510    H    ALA  71           HN       ALA  71  34.567  26.736   8.356
  511    HA   ALA  71           HA       ALA  71  35.650  24.621   6.771
  512    HB1  ALA  71           HB1      ALA  71  37.387  27.059   6.694
  513    HB2  ALA  71           HB2      ALA  71  36.111  26.877   5.490
  514    HB3  ALA  71           HB3      ALA  71  37.376  25.656   5.624
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1  33.039 -17.248  25.025
    2    H2   GLY   1           HT2      GLY   1  33.686 -15.694  25.246
    3    H3   GLY   1           HT3      GLY   1  32.382 -15.931  24.183
    4    HA2  GLY   1           HA2      GLY   1  31.975 -16.771  26.942
    5    HA3  GLY   1           HA1      GLY   1  32.059 -15.033  26.643
    6    H    GLY   2           HN       GLY   2  30.385 -18.014  25.756
    7    HA2  GLY   2           HA2      GLY   2  28.134 -18.331  25.285
    8    HA3  GLY   2           HA1      GLY   2  27.886 -16.596  25.462
    9    HA   PRO   3           HA       PRO   3  27.679 -17.638  20.941
   10    HB2  PRO   3           HB2      PRO   3  25.244 -16.508  20.474
   11    HB3  PRO   3           HB1      PRO   3  25.433 -18.172  21.058
   12    HG2  PRO   3           HG2      PRO   3  24.709 -15.710  22.559
   13    HG3  PRO   3           HG1      PRO   3  24.110 -17.366  22.744
   14    HD2  PRO   3           HD2      PRO   3  26.007 -16.221  24.392
   15    HD3  PRO   3           HD1      PRO   3  25.833 -17.972  24.138
   16    H    GLU   4           HN       GLU   4  29.444 -15.865  21.382
   17    HA   GLU   4           HA       GLU   4  28.515 -13.366  20.125
   18    HB2  GLU   4           HB2      GLU   4  30.453 -13.677  22.429
   19    HB3  GLU   4           HB1      GLU   4  30.245 -12.183  21.514
   20    HG2  GLU   4           HG2      GLU   4  27.872 -12.109  22.125
   21    HG3  GLU   4           HG1      GLU   4  28.031 -13.637  22.989
   22    H    THR   5           HN       THR   5  29.454 -13.146  18.226
   23    HA   THR   5           HA       THR   5  32.268 -13.986  17.904
   24    HB   THR   5           HB       THR   5  31.772 -14.815  15.663
   25    HG1  THR   5           HG1      THR   5  29.995 -14.229  14.754
   26   HG21  THR   5          HG21      THR   5  29.798 -15.986  17.634
   27   HG22  THR   5          HG22      THR   5  31.531 -16.306  17.682
   28   HG23  THR   5          HG23      THR   5  30.580 -16.815  16.287
   29    H    LEU   6           HN       LEU   6  33.347 -12.925  16.064
   30    HA   LEU   6           HA       LEU   6  32.201 -10.271  15.450
   31    HB2  LEU   6           HB2      LEU   6  35.084 -10.890  16.126
   32    HB3  LEU   6           HB1      LEU   6  34.453  -9.314  15.647
   33    HG   LEU   6           HG       LEU   6  33.497 -10.872  18.067
   34   HD11  LEU   6          HD11      LEU   6  34.711  -9.016  19.308
   35   HD12  LEU   6          HD12      LEU   6  35.471  -8.591  17.774
   36   HD13  LEU   6          HD13      LEU   6  35.760 -10.176  18.493
   37   HD21  LEU   6          HD21      LEU   6  32.553  -8.564  18.633
   38   HD22  LEU   6          HD22      LEU   6  31.768  -9.392  17.288
   39   HD23  LEU   6          HD23      LEU   6  32.927  -8.099  16.974
   40    H    CYS   7           HN       CYS   7  33.637  -9.230  13.638
   41    HA   CYS   7           HA       CYS   7  34.423  -9.268  11.485
   42    HB2  CYS   7           HB2      CYS   7  35.746 -11.310  12.583
   43    HB3  CYS   7           HB1      CYS   7  34.743 -12.214  11.453
   44    H    GLY   8           HN       GLY   8  33.813 -10.094   9.306
   45    HA2  GLY   8           HA2      GLY   8  32.205 -10.605   7.745
   46    HA3  GLY   8           HA1      GLY   8  31.686 -11.868   8.857
   47    H    ALA   9           HN       ALA   9  29.558 -11.709   9.100
   48    HA   ALA   9           HA       ALA   9  28.008  -9.403   8.721
   49    HB1  ALA   9           HB1      ALA   9  26.959 -11.565   8.607
   50    HB2  ALA   9           HB2      ALA   9  26.228 -10.691   9.953
   51    HB3  ALA   9           HB3      ALA   9  27.433 -11.942  10.264
   52    H    GLU  10           HN       GLU  10  29.539 -10.749  11.597
   53    HA   GLU  10           HA       GLU  10  28.252  -9.133  13.523
   54    HB2  GLU  10           HB2      GLU  10  30.994 -10.413  13.512
   55    HB3  GLU  10           HB1      GLU  10  30.268  -9.637  14.920
   56    HG2  GLU  10           HG2      GLU  10  28.936 -11.882  13.386
   57    HG3  GLU  10           HG1      GLU  10  29.938 -12.144  14.812
   58    H    LEU  11           HN       LEU  11  31.065  -8.604  11.458
   59    HA   LEU  11           HA       LEU  11  31.978  -6.239  12.717
   60    HB2  LEU  11           HB2      LEU  11  32.991  -7.802  10.785
   61    HB3  LEU  11           HB1      LEU  11  32.299  -6.541   9.770
   62    HG   LEU  11           HG       LEU  11  34.577  -5.910  10.269
   63   HD11  LEU  11          HD11      LEU  11  32.855  -4.303  12.164
   64   HD12  LEU  11          HD12      LEU  11  32.701  -4.180  10.412
   65   HD13  LEU  11          HD13      LEU  11  34.220  -3.739  11.196
   66   HD21  LEU  11          HD21      LEU  11  34.565  -7.388  12.425
   67   HD22  LEU  11          HD22      LEU  11  33.971  -5.932  13.227
   68   HD23  LEU  11          HD23      LEU  11  35.538  -5.917  12.419
   69    H    VAL  12           HN       VAL  12  29.905  -6.727   9.863
   70    HA   VAL  12           HA       VAL  12  29.429  -3.994   9.397
   71    HB   VAL  12           HB       VAL  12  27.937  -6.502   8.665
   72   HG11  VAL  12          HG11      VAL  12  26.180  -4.847   8.838
   73   HG12  VAL  12          HG12      VAL  12  26.609  -4.935   7.129
   74   HG13  VAL  12          HG13      VAL  12  27.204  -3.603   8.118
   75   HG21  VAL  12          HG21      VAL  12  30.069  -5.983   7.532
   76   HG22  VAL  12          HG22      VAL  12  29.441  -4.397   7.082
   77   HG23  VAL  12          HG23      VAL  12  28.708  -5.858   6.417
   78    H    ASP  13           HN       ASP  13  27.590  -6.399  11.240
   79    HA   ASP  13           HA       ASP  13  25.455  -4.697  11.971
   80    HB2  ASP  13           HB2      ASP  13  25.443  -7.201  12.108
   81    HB3  ASP  13           HB1      ASP  13  26.495  -7.076  13.516
   82    H    ALA  14           HN       ALA  14  28.509  -5.512  13.592
   83    HA   ALA  14           HA       ALA  14  28.025  -4.166  16.002
   84    HB1  ALA  14           HB1      ALA  14  29.883  -5.745  15.682
   85    HB2  ALA  14           HB2      ALA  14  30.459  -4.192  16.286
   86    HB3  ALA  14           HB3      ALA  14  30.661  -4.606  14.583
   87    H    LEU  15           HN       LEU  15  29.487  -3.036  12.964
   88    HA   LEU  15           HA       LEU  15  30.187  -0.455  13.871
   89    HB2  LEU  15           HB2      LEU  15  29.559  -1.545  11.126
   90    HB3  LEU  15           HB1      LEU  15  30.100   0.110  11.399
   91    HG   LEU  15           HG       LEU  15  31.632  -2.281  12.437
   92   HD11  LEU  15          HD11      LEU  15  31.523  -2.475  10.003
   93   HD12  LEU  15          HD12      LEU  15  33.131  -1.930  10.478
   94   HD13  LEU  15          HD13      LEU  15  31.968  -0.777   9.823
   95   HD21  LEU  15          HD21      LEU  15  33.484  -0.523  12.337
   96   HD22  LEU  15          HD22      LEU  15  32.229  -0.231  13.540
   97   HD23  LEU  15          HD23      LEU  15  32.218   0.664  12.020
   98    H    GLN  16           HN       GLN  16  27.245  -1.713  12.336
   99    HA   GLN  16           HA       GLN  16  25.911   0.782  12.133
  100    HB2  GLN  16           HB2      GLN  16  25.250  -1.245  10.867
  101    HB3  GLN  16           HB1      GLN  16  24.705  -1.979  12.375
  102    HG2  GLN  16           HG2      GLN  16  23.078  -0.189  12.703
  103    HG3  GLN  16           HG1      GLN  16  23.667   0.640  11.262
  104   HE21  GLN  16          HE21      GLN  16  21.006   0.053  11.168
  105   HE22  GLN  16          HE22      GLN  16  20.703  -1.281  10.165
  106    H    PHE  17           HN       PHE  17  25.954  -1.736  14.621
  107    HA   PHE  17           HA       PHE  17  23.975  -0.610  16.296
  108    HB2  PHE  17           HB2      PHE  17  24.579  -2.859  16.700
  109    HB3  PHE  17           HB1      PHE  17  26.293  -2.465  16.818
  110    HD1  PHE  17           HD1      PHE  17  22.997  -2.156  18.511
  111    HD2  PHE  17           HD2      PHE  17  27.254  -1.598  18.838
  112    HE1  PHE  17           HE1      PHE  17  22.761  -1.787  20.955
  113    HE2  PHE  17           HE2      PHE  17  27.011  -1.236  21.283
  114    HZ   PHE  17           HZ       PHE  17  24.766  -1.330  22.339
  115    H    VAL  18           HN       VAL  18  27.529  -0.379  16.431
  116    HA   VAL  18           HA       VAL  18  27.611   1.351  18.661
  117    HB   VAL  18           HB       VAL  18  29.599   0.872  16.430
  118   HG11  VAL  18          HG11      VAL  18  31.212   1.852  18.160
  119   HG12  VAL  18          HG12      VAL  18  29.784   2.479  18.984
  120   HG13  VAL  18          HG13      VAL  18  30.157   3.004  17.341
  121   HG21  VAL  18          HG21      VAL  18  29.119  -1.087  17.835
  122   HG22  VAL  18          HG22      VAL  18  29.403  -0.128  19.290
  123   HG23  VAL  18          HG23      VAL  18  30.735  -0.470  18.185
  124    H    CYS  19           HN       CYS  19  27.875   2.036  15.176
  125    HA   CYS  19           HA       CYS  19  28.061   4.860  15.475
  126    HB2  CYS  19           HB2      CYS  19  27.190   3.166  13.118
  127    HB3  CYS  19           HB1      CYS  19  27.509   4.892  13.050
  128    H    GLY  20           HN       GLY  20  25.363   2.658  14.954
  129    HA2  GLY  20           HA2      GLY  20  23.092   2.942  15.169
  130    HA3  GLY  20           HA1      GLY  20  23.466   4.310  16.213
  131    H    ASP  21           HN       ASP  21  22.407   6.050  15.533
  132    HA   ASP  21           HA       ASP  21  21.329   6.438  12.976
  133    HB2  ASP  21           HB2      ASP  21  22.011   8.386  15.183
  134    HB3  ASP  21           HB1      ASP  21  21.190   8.869  13.700
  135    H    ARG  22           HN       ARG  22  24.452   7.322  14.333
  136    HA   ARG  22           HA       ARG  22  25.305   9.097  12.325
  137    HB2  ARG  22           HB2      ARG  22  26.850   7.226  14.129
  138    HB3  ARG  22           HB1      ARG  22  27.621   8.398  13.062
  139    HG2  ARG  22           HG2      ARG  22  26.190  10.178  14.165
  140    HG3  ARG  22           HG1      ARG  22  25.731   8.960  15.355
  141    HD2  ARG  22           HD2      ARG  22  28.587   9.754  14.735
  142    HD3  ARG  22           HD1      ARG  22  27.657  10.371  16.097
  143    HE   ARG  22           HE       ARG  22  28.805   7.713  15.837
  144   HH11  ARG  22          HH11      ARG  22  26.470   9.759  17.439
  145   HH12  ARG  22          HH12      ARG  22  26.375   8.749  18.844
  146   HH21  ARG  22          HH21      ARG  22  28.649   6.411  17.687
  147   HH22  ARG  22          HH22      ARG  22  27.593   6.870  18.981
  148    H    GLY  23           HN       GLY  23  25.447   5.562  12.556
  149    HA2  GLY  23           HA2      GLY  23  25.739   3.965  10.919
  150    HA3  GLY  23           HA1      GLY  23  25.521   5.241   9.725
  151    H    PHE  24           HN       PHE  24  27.257   3.718   8.751
  152    HA   PHE  24           HA       PHE  24  29.820   5.051   9.110
  153    HB2  PHE  24           HB2      PHE  24  31.075   2.986   9.438
  154    HB3  PHE  24           HB1      PHE  24  29.893   3.178  10.730
  155    HD1  PHE  24           HD1      PHE  24  30.915   1.194   7.852
  156    HD2  PHE  24           HD2      PHE  24  27.777   1.861  10.705
  157    HE1  PHE  24           HE1      PHE  24  29.904  -0.983   7.250
  158    HE2  PHE  24           HE2      PHE  24  26.771  -0.320  10.106
  159    HZ   PHE  24           HZ       PHE  24  27.833  -1.742   8.379
  160    H    TYR  25           HN       TYR  25  31.337   4.530   7.390
  161    HA   TYR  25           HA       TYR  25  30.036   3.375   5.000
  162    HB2  TYR  25           HB2      TYR  25  31.124   5.096   3.633
  163    HB3  TYR  25           HB1      TYR  25  30.070   5.834   4.840
  164    HD1  TYR  25           HD1      TYR  25  33.557   5.238   3.825
  165    HD2  TYR  25           HD2      TYR  25  30.992   7.011   6.779
  166    HE1  TYR  25           HE1      TYR  25  35.482   6.510   4.733
  167    HE2  TYR  25           HE2      TYR  25  32.917   8.284   7.686
  168    HH   TYR  25           HH       TYR  25  35.449   9.021   6.301
  169    H    PHE  26           HN       PHE  26  32.853   3.699   6.984
  170    HA   PHE  26           HA       PHE  26  34.834   2.773   5.214
  171    HB2  PHE  26           HB2      PHE  26  35.379   3.786   7.373
  172    HB3  PHE  26           HB1      PHE  26  34.624   2.433   8.216
  173    HD1  PHE  26           HD1      PHE  26  37.341   3.288   5.799
  174    HD2  PHE  26           HD2      PHE  26  35.833   0.449   8.647
  175    HE1  PHE  26           HE1      PHE  26  39.461   2.010   5.649
  176    HE2  PHE  26           HE2      PHE  26  37.953  -0.826   8.496
  177    HZ   PHE  26           HZ       PHE  26  39.765  -0.048   6.996
  178    H    ASN  27           HN       ASN  27  35.544   0.751   4.664
  179    HA   ASN  27           HA       ASN  27  35.453  -1.512   4.278
  180    HB2  ASN  27           HB2      ASN  27  35.717  -1.465   6.829
  181    HB3  ASN  27           HB1      ASN  27  33.982  -1.776   6.897
  182   HD21  ASN  27          HD21      ASN  27  34.112  -3.965   7.655
  183   HD22  ASN  27          HD22      ASN  27  34.801  -5.212   6.732
  184    H    LYS  28           HN       LYS  28  33.714  -0.407   2.757
  185    HA   LYS  28           HA       LYS  28  30.984  -0.906   3.243
  186    HB2  LYS  28           HB2      LYS  28  32.514  -0.538   0.661
  187    HB3  LYS  28           HB1      LYS  28  30.755  -0.650   0.745
  188    HG2  LYS  28           HG2      LYS  28  30.714   1.284   2.285
  189    HG3  LYS  28           HG1      LYS  28  32.470   1.396   2.173
  190    HD2  LYS  28           HD2      LYS  28  32.303   1.783  -0.252
  191    HD3  LYS  28           HD1      LYS  28  30.545   1.671  -0.151
  192    HE2  LYS  28           HE2      LYS  28  30.511   3.603   1.388
  193    HE3  LYS  28           HE1      LYS  28  32.267   3.718   1.278
  194    HZ1  LYS  28           HZ1      LYS  28  30.245   4.255  -0.796
  195    HZ2  LYS  28           HZ2      LYS  28  31.833   3.844  -1.234
  196    HZ3  LYS  28           HZ3      LYS  28  31.540   5.228  -0.292
  197    HA   PRO  29           HA       PRO  29  30.708  -5.235   2.382
  198    HB2  PRO  29           HB2      PRO  29  28.128  -5.436   1.524
  199    HB3  PRO  29           HB1      PRO  29  28.558  -5.099   3.212
  200    HG2  PRO  29           HG2      PRO  29  27.611  -3.244   1.096
  201    HG3  PRO  29           HG1      PRO  29  27.259  -3.260   2.830
  202    HD2  PRO  29           HD2      PRO  29  29.086  -1.570   1.627
  203    HD3  PRO  29           HD1      PRO  29  29.111  -2.018   3.344
  204    H    THR  30           HN       THR  30  32.232  -4.394   0.438
  205    HA   THR  30           HA       THR  30  30.952  -4.805  -2.158
  206    HB   THR  30           HB       THR  30  33.129  -4.177  -3.090
  207    HG1  THR  30           HG1      THR  30  34.633  -4.887  -1.743
  208   HG21  THR  30          HG21      THR  30  32.428  -2.327  -0.801
  209   HG22  THR  30          HG22      THR  30  31.470  -2.445  -2.276
  210   HG23  THR  30          HG23      THR  30  33.143  -1.889  -2.354
  211    H    GLY  31           HN       GLY  31  32.517  -6.649   0.232
  212    HA2  GLY  31           HA2      GLY  31  32.234  -9.120  -0.480
  213    HA3  GLY  31           HA1      GLY  31  33.435  -8.673  -1.691
  214    H    TYR  32           HN       TYR  32  33.105 -10.138   1.203
  215    HA   TYR  32           HA       TYR  32  35.280  -9.047   2.700
  216    HB2  TYR  32           HB2      TYR  32  33.511 -10.329   3.794
  217    HB3  TYR  32           HB1      TYR  32  33.944 -11.758   2.858
  218    HD1  TYR  32           HD1      TYR  32  35.240  -9.325   5.368
  219    HD2  TYR  32           HD2      TYR  32  35.721 -13.179   3.533
  220    HE1  TYR  32           HE1      TYR  32  36.959  -9.912   7.055
  221    HE2  TYR  32           HE2      TYR  32  37.441 -13.767   5.222
  222    HH   TYR  32           HH       TYR  32  37.818 -12.422   8.005
  223    H    GLY  33           HN       GLY  33  37.402  -9.388   2.495
  224    HA2  GLY  33           HA2      GLY  33  39.375 -10.570   2.051
  225    HA3  GLY  33           HA1      GLY  33  38.421 -11.834   1.283
  226    H    SER  34           HN       SER  34  37.128  -9.219  -0.081
  227    HA   SER  34           HA       SER  34  39.124  -9.138  -2.256
  228    HB2  SER  34           HB2      SER  34  36.106  -8.969  -2.368
  229    HB3  SER  34           HB1      SER  34  37.164  -8.670  -3.745
  230    HG   SER  34           HG       SER  34  37.660 -10.751  -3.830
  231    H    SER  35           HN       SER  35  37.219  -7.333   0.004
  232    HA   SER  35           HA       SER  35  37.124  -4.838  -1.280
  233    HB2  SER  35           HB2      SER  35  36.686  -3.943   0.917
  234    HB3  SER  35           HB1      SER  35  35.859  -5.489   0.771
  235    HG   SER  35           HG       SER  35  37.178  -5.057   2.739
  236    H    SER  36           HN       SER  36  39.611  -6.411   0.667
  237    HA   SER  36           HA       SER  36  41.299  -4.165   0.979
  238    HB2  SER  36           HB2      SER  36  43.041  -5.800   1.534
  239    HB3  SER  36           HB1      SER  36  41.524  -6.209   2.333
  240    HG   SER  36           HG       SER  36  41.241  -7.863   0.975
  241    H    ARG  37           HN       ARG  37  40.994  -6.582  -1.526
  242    HA   ARG  37           HA       ARG  37  43.331  -5.954  -2.985
  243    HB2  ARG  37           HB2      ARG  37  42.021  -8.008  -3.371
  244    HB3  ARG  37           HB1      ARG  37  40.701  -7.035  -4.025
  245    HG2  ARG  37           HG2      ARG  37  42.133  -6.226  -5.826
  246    HG3  ARG  37           HG1      ARG  37  43.522  -7.071  -5.139
  247    HD2  ARG  37           HD2      ARG  37  42.590  -8.390  -6.967
  248    HD3  ARG  37           HD1      ARG  37  42.331  -9.225  -5.438
  249    HE   ARG  37           HE       ARG  37  40.091  -7.582  -6.083
  250   HH11  ARG  37          HH11      ARG  37  41.704 -10.560  -6.908
  251   HH12  ARG  37          HH12      ARG  37  40.253 -11.336  -7.451
  252   HH21  ARG  37          HH21      ARG  37  38.206  -8.620  -6.798
  253   HH22  ARG  37          HH22      ARG  37  38.287 -10.246  -7.390
  254    H    ARG  38           HN       ARG  38  39.999  -4.757  -3.238
  255    HA   ARG  38           HA       ARG  38  40.419  -3.068  -5.466
  256    HB2  ARG  38           HB2      ARG  38  38.398  -2.970  -3.221
  257    HB3  ARG  38           HB1      ARG  38  38.358  -1.886  -4.613
  258    HG2  ARG  38           HG2      ARG  38  38.220  -3.818  -6.128
  259    HG3  ARG  38           HG1      ARG  38  38.280  -4.916  -4.747
  260    HD2  ARG  38           HD2      ARG  38  35.959  -4.625  -5.421
  261    HD3  ARG  38           HD1      ARG  38  36.206  -3.843  -3.860
  262    HE   ARG  38           HE       ARG  38  35.827  -1.784  -4.881
  263   HH11  ARG  38          HH11      ARG  38  36.321  -4.281  -7.272
  264   HH12  ARG  38          HH12      ARG  38  35.840  -3.271  -8.598
  265   HH21  ARG  38          HH21      ARG  38  35.212  -0.487  -6.639
  266   HH22  ARG  38          HH22      ARG  38  35.222  -1.143  -8.242
  267    H    ALA  39           HN       ALA  39  40.688  -2.520  -1.978
  268    HA   ALA  39           HA       ALA  39  42.459  -0.284  -2.460
  269    HB1  ALA  39           HB1      ALA  39  40.696   1.175  -2.463
  270    HB2  ALA  39           HB2      ALA  39  40.876   1.024  -0.714
  271    HB3  ALA  39           HB3      ALA  39  39.649   0.080  -1.561
  272    HA   PRO  40           HA       PRO  40  44.082  -1.652   1.403
  273    HB2  PRO  40           HB2      PRO  40  45.202   0.628   2.392
  274    HB3  PRO  40           HB1      PRO  40  45.868  -0.250   1.002
  275    HG2  PRO  40           HG2      PRO  40  44.239   2.232   1.070
  276    HG3  PRO  40           HG1      PRO  40  45.571   1.779  -0.006
  277    HD2  PRO  40           HD2      PRO  40  42.895   1.638  -0.699
  278    HD3  PRO  40           HD1      PRO  40  44.185   0.692  -1.473
  279    H    GLN  41           HN       GLN  41  41.687  -1.868   2.073
  280    HA   GLN  41           HA       GLN  41  40.889   0.105   4.087
  281    HB2  GLN  41           HB2      GLN  41  39.438  -2.236   2.845
  282    HB3  GLN  41           HB1      GLN  41  38.768  -1.255   4.150
  283    HG2  GLN  41           HG2      GLN  41  38.859   0.739   2.785
  284    HG3  GLN  41           HG1      GLN  41  39.737  -0.114   1.516
  285   HE21  GLN  41          HE21      GLN  41  37.075   1.222   1.289
  286   HE22  GLN  41          HE22      GLN  41  35.990   0.008   0.809
  287    H    THR  42           HN       THR  42  42.998  -2.239   4.183
  288    HA   THR  42           HA       THR  42  42.046  -3.890   6.333
  289    HB   THR  42           HB       THR  42  44.327  -4.783   6.353
  290    HG1  THR  42           HG1      THR  42  44.881  -2.789   4.419
  291   HG21  THR  42          HG21      THR  42  43.435  -4.278   3.504
  292   HG22  THR  42          HG22      THR  42  42.684  -5.463   4.572
  293   HG23  THR  42          HG23      THR  42  44.372  -5.648   4.100
  294    H    GLY  43           HN       GLY  43  43.279  -4.027   8.410
  295    HA2  GLY  43           HA2      GLY  43  44.736  -2.845   9.998
  296    HA3  GLY  43           HA1      GLY  43  44.088  -1.339   9.356
  297    H    ILE  44           HN       ILE  44  41.794  -0.861   9.760
  298    HA   ILE  44           HA       ILE  44  41.042  -1.292  12.431
  299    HB   ILE  44           HB       ILE  44  39.507  -0.323  10.018
  300   HG12  ILE  44          HG12      ILE  44  40.472   1.179  12.461
  301   HG13  ILE  44          HG11      ILE  44  41.439   1.025  10.994
  302   HG21  ILE  44          HG21      ILE  44  38.677  -0.501  12.915
  303   HG22  ILE  44          HG22      ILE  44  37.880  -1.240  11.524
  304   HG23  ILE  44          HG23      ILE  44  37.866   0.510  11.720
  305   HD11  ILE  44          HD11      ILE  44  40.206   3.116  10.889
  306   HD12  ILE  44          HD12      ILE  44  38.690   2.281  11.228
  307   HD13  ILE  44          HD13      ILE  44  39.526   2.006   9.699
  308    H    VAL  45           HN       VAL  45  39.844  -2.729   9.404
  309    HA   VAL  45           HA       VAL  45  37.877  -4.378  10.571
  310    HB   VAL  45           HB       VAL  45  39.443  -4.613   8.000
  311   HG11  VAL  45          HG11      VAL  45  37.636  -6.282   7.386
  312   HG12  VAL  45          HG12      VAL  45  37.191  -6.326   9.090
  313   HG13  VAL  45          HG13      VAL  45  38.793  -6.868   8.582
  314   HG21  VAL  45          HG21      VAL  45  37.742  -2.739   8.400
  315   HG22  VAL  45          HG22      VAL  45  36.513  -4.002   8.464
  316   HG23  VAL  45          HG23      VAL  45  37.450  -3.757   6.990
  317    H    ASP  46           HN       ASP  46  41.263  -5.015   9.716
  318    HA   ASP  46           HA       ASP  46  41.288  -7.721  10.517
  319    HB2  ASP  46           HB2      ASP  46  43.475  -5.661  10.258
  320    HB3  ASP  46           HB1      ASP  46  43.792  -7.337  10.702
  321    H    GLU  47           HN       GLU  47  41.934  -4.718  12.285
  322    HA   GLU  47           HA       GLU  47  42.963  -5.889  14.625
  323    HB2  GLU  47           HB2      GLU  47  43.119  -3.487  14.142
  324    HB3  GLU  47           HB1      GLU  47  41.369  -3.331  14.303
  325    HG2  GLU  47           HG2      GLU  47  42.471  -2.647  16.379
  326    HG3  GLU  47           HG1      GLU  47  41.531  -4.111  16.653
  327    H    CYS  48           HN       CYS  48  39.632  -4.833  13.885
  328    HA   CYS  48           HA       CYS  48  38.541  -5.841  16.331
  329    HB2  CYS  48           HB2      CYS  48  37.220  -5.071  13.721
  330    HB3  CYS  48           HB1      CYS  48  36.362  -5.497  15.198
  331    H    CYS  49           HN       CYS  49  38.752  -7.085  13.023
  332    HA   CYS  49           HA       CYS  49  37.137  -9.356  13.340
  333    HB2  CYS  49           HB2      CYS  49  37.866  -8.516  11.142
  334    HB3  CYS  49           HB1      CYS  49  39.524  -8.987  11.512
  335    H    PHE  50           HN       PHE  50  40.671  -8.985  13.651
  336    HA   PHE  50           HA       PHE  50  40.917 -11.708  14.604
  337    HB2  PHE  50           HB2      PHE  50  42.873  -9.485  14.047
  338    HB3  PHE  50           HB1      PHE  50  43.383 -10.980  14.841
  339    HD1  PHE  50           HD1      PHE  50  41.746  -9.577  11.810
  340    HD2  PHE  50           HD2      PHE  50  43.706 -12.974  13.564
  341    HE1  PHE  50           HE1      PHE  50  41.851 -10.656   9.579
  342    HE2  PHE  50           HE2      PHE  50  43.812 -14.058  11.335
  343    HZ   PHE  50           HZ       PHE  50  42.887 -12.904   9.343
  344    H    ARG  51           HN       ARG  51  42.122  -8.597  15.880
  345    HA   ARG  51           HA       ARG  51  42.118  -9.605  18.588
  346    HB2  ARG  51           HB2      ARG  51  43.118  -7.213  17.187
  347    HB3  ARG  51           HB1      ARG  51  42.581  -6.933  18.843
  348    HG2  ARG  51           HG2      ARG  51  44.928  -7.545  18.903
  349    HG3  ARG  51           HG1      ARG  51  43.993  -8.888  19.559
  350    HD2  ARG  51           HD2      ARG  51  44.161 -10.114  17.505
  351    HD3  ARG  51           HD1      ARG  51  44.834  -8.723  16.661
  352    HE   ARG  51           HE       ARG  51  46.558  -9.289  18.776
  353   HH11  ARG  51          HH11      ARG  51  45.340 -10.837  15.900
  354   HH12  ARG  51          HH12      ARG  51  46.771 -11.780  15.657
  355   HH21  ARG  51          HH21      ARG  51  48.421 -10.538  18.437
  356   HH22  ARG  51          HH22      ARG  51  48.503 -11.615  17.082
  357    H    SER  52           HN       SER  52  41.077  -8.303  20.351
  358    HA   SER  52           HA       SER  52  38.295  -7.748  19.606
  359    HB2  SER  52           HB2      SER  52  39.641  -8.119  22.290
  360    HB3  SER  52           HB1      SER  52  37.931  -7.754  22.082
  361    HG   SER  52           HG       SER  52  38.319 -10.003  22.249
  362    H    CYS  53           HN       CYS  53  38.677  -5.698  18.597
  363    HA   CYS  53           HA       CYS  53  39.958  -3.538  19.939
  364    HB2  CYS  53           HB2      CYS  53  39.006  -2.154  18.171
  365    HB3  CYS  53           HB1      CYS  53  39.634  -3.648  17.479
  366    H    ASP  54           HN       ASP  54  39.062  -1.760  21.002
  367    HA   ASP  54           HA       ASP  54  36.826  -2.325  22.669
  368    HB2  ASP  54           HB2      ASP  54  38.419   0.194  22.173
  369    HB3  ASP  54           HB1      ASP  54  37.112   0.097  23.352
  370    H    LEU  55           HN       LEU  55  34.743  -1.587  22.614
  371    HA   LEU  55           HA       LEU  55  33.582  -1.000  20.101
  372    HB2  LEU  55           HB2      LEU  55  32.527  -0.765  22.926
  373    HB3  LEU  55           HB1      LEU  55  31.536  -0.471  21.498
  374    HG   LEU  55           HG       LEU  55  33.080  -3.038  21.932
  375   HD11  LEU  55          HD11      LEU  55  30.884  -4.013  22.577
  376   HD12  LEU  55          HD12      LEU  55  30.178  -2.398  22.551
  377   HD13  LEU  55          HD13      LEU  55  31.429  -2.797  23.729
  378   HD21  LEU  55          HD21      LEU  55  30.929  -2.107  20.012
  379   HD22  LEU  55          HD22      LEU  55  31.294  -3.816  20.256
  380   HD23  LEU  55          HD23      LEU  55  32.532  -2.731  19.623
  381    H    ARG  56           HN       ARG  56  34.480   1.042  22.853
  382    HA   ARG  56           HA       ARG  56  33.319   3.440  21.970
  383    HB2  ARG  56           HB2      ARG  56  34.228   3.150  24.233
  384    HB3  ARG  56           HB1      ARG  56  35.858   3.033  23.570
  385    HG2  ARG  56           HG2      ARG  56  35.734   5.304  22.719
  386    HG3  ARG  56           HG1      ARG  56  34.042   5.431  23.206
  387    HD2  ARG  56           HD2      ARG  56  34.654   5.216  25.554
  388    HD3  ARG  56           HD1      ARG  56  36.343   4.952  25.122
  389    HE   ARG  56           HE       ARG  56  36.564   7.243  24.782
  390   HH11  ARG  56          HH11      ARG  56  33.198   6.353  24.995
  391   HH12  ARG  56          HH12      ARG  56  32.646   7.994  25.056
  392   HH21  ARG  56          HH21      ARG  56  35.812   9.379  24.857
  393   HH22  ARG  56          HH22      ARG  56  34.113   9.693  24.976
  394    H    ARG  57           HN       ARG  57  36.607   2.128  21.401
  395    HA   ARG  57           HA       ARG  57  37.557   4.275  19.865
  396    HB2  ARG  57           HB2      ARG  57  38.878   2.369  20.921
  397    HB3  ARG  57           HB1      ARG  57  38.383   1.400  19.529
  398    HG2  ARG  57           HG2      ARG  57  39.473   2.851  17.999
  399    HG3  ARG  57           HG1      ARG  57  39.673   4.106  19.222
  400    HD2  ARG  57           HD2      ARG  57  41.806   2.982  18.949
  401    HD3  ARG  57           HD1      ARG  57  41.129   2.541  20.515
  402    HE   ARG  57           HE       ARG  57  40.811   0.372  19.739
  403   HH11  ARG  57          HH11      ARG  57  41.703   2.509  17.123
  404   HH12  ARG  57          HH12      ARG  57  41.992   1.213  16.008
  405   HH21  ARG  57          HH21      ARG  57  41.217  -1.300  18.248
  406   HH22  ARG  57          HH22      ARG  57  41.710  -0.911  16.634
  407    H    LEU  58           HN       LEU  58  35.785   1.337  19.025
  408    HA   LEU  58           HA       LEU  58  36.005   1.489  16.237
  409    HB2  LEU  58           HB2      LEU  58  35.073  -0.440  17.584
  410    HB3  LEU  58           HB1      LEU  58  33.582   0.489  17.740
  411    HG   LEU  58           HG       LEU  58  33.653   0.687  15.169
  412   HD11  LEU  58          HD11      LEU  58  34.973  -0.858  13.950
  413   HD12  LEU  58          HD12      LEU  58  35.349  -1.804  15.388
  414   HD13  LEU  58          HD13      LEU  58  36.085  -0.219  15.158
  415   HD21  LEU  58          HD21      LEU  58  31.967  -0.675  16.163
  416   HD22  LEU  58          HD22      LEU  58  33.138  -1.898  16.655
  417   HD23  LEU  58          HD23      LEU  58  32.735  -1.699  14.950
  418    H    ASP  59           HN       ASP  59  33.831   3.097  18.479
  419    HA   ASP  59           HA       ASP  59  31.907   4.081  16.732
  420    HB2  ASP  59           HB2      ASP  59  31.962   4.291  19.264
  421    HB3  ASP  59           HB1      ASP  59  33.056   5.654  19.040
  422    H    MET  60           HN       MET  60  35.236   4.966  17.073
  423    HA   MET  60           HA       MET  60  35.223   7.579  16.057
  424    HB2  MET  60           HB2      MET  60  37.280   5.381  15.882
  425    HB3  MET  60           HB1      MET  60  37.569   7.026  15.320
  426    HG2  MET  60           HG2      MET  60  36.633   6.399  18.127
  427    HG3  MET  60           HG1      MET  60  38.338   6.554  17.695
  428    HE1  MET  60           HE1      MET  60  39.412   8.244  16.709
  429    HE2  MET  60           HE2      MET  60  39.134   9.961  16.994
  430    HE3  MET  60           HE3      MET  60  38.445   9.189  15.569
  431    H    TYR  61           HN       TYR  61  35.187   4.450  14.432
  432    HA   TYR  61           HA       TYR  61  35.489   5.609  11.800
  433    HB2  TYR  61           HB2      TYR  61  34.493   2.821  12.308
  434    HB3  TYR  61           HB1      TYR  61  35.503   3.426  10.992
  435    HD1  TYR  61           HD1      TYR  61  35.771   1.228  13.472
  436    HD2  TYR  61           HD2      TYR  61  37.572   4.968  12.355
  437    HE1  TYR  61           HE1      TYR  61  37.812   0.626  14.751
  438    HE2  TYR  61           HE2      TYR  61  39.606   4.373  13.640
  439    HH   TYR  61           HH       TYR  61  40.661   1.897  14.366
  440    H    CYS  62           HN       CYS  62  33.168   6.496  13.476
  441    HA   CYS  62           HA       CYS  62  30.910   5.514  11.894
  442    HB2  CYS  62           HB2      CYS  62  31.067   7.164  14.428
  443    HB3  CYS  62           HB1      CYS  62  29.562   6.789  13.587
  444    H    ALA  63           HN       ALA  63  29.644   6.912  10.678
  445    HA   ALA  63           HA       ALA  63  30.962   9.089   9.485
  446    HB1  ALA  63           HB1      ALA  63  29.065   7.541   8.569
  447    HB2  ALA  63           HB2      ALA  63  29.114   9.230   8.066
  448    HB3  ALA  63           HB3      ALA  63  27.988   8.716   9.321
  449    HA   PRO  64           HA       PRO  64  29.741  12.399  12.153
  450    HB2  PRO  64           HB2      PRO  64  29.724  14.488  10.406
  451    HB3  PRO  64           HB1      PRO  64  31.219  13.704  10.956
  452    HG2  PRO  64           HG2      PRO  64  29.749  13.395   8.391
  453    HG3  PRO  64           HG1      PRO  64  31.493  13.411   8.703
  454    HD2  PRO  64           HD2      PRO  64  30.019  11.107   8.294
  455    HD3  PRO  64           HD1      PRO  64  31.556  11.156   9.183
  456    H    LEU  65           HN       LEU  65  28.034  13.922  12.636
  457    HA   LEU  65           HA       LEU  65  25.451  13.031  11.780
  458    HB2  LEU  65           HB2      LEU  65  26.296  15.406  13.456
  459    HB3  LEU  65           HB1      LEU  65  24.626  14.893  13.219
  460    HG   LEU  65           HG       LEU  65  26.797  13.106  14.351
  461   HD11  LEU  65          HD11      LEU  65  24.644  14.732  15.731
  462   HD12  LEU  65          HD12      LEU  65  26.388  14.925  15.913
  463   HD13  LEU  65          HD13      LEU  65  25.592  13.470  16.516
  464   HD21  LEU  65          HD21      LEU  65  23.804  12.862  13.968
  465   HD22  LEU  65          HD22      LEU  65  24.675  11.860  15.131
  466   HD23  LEU  65          HD23      LEU  65  25.068  11.764  13.415
  467    H    LYS  66           HN       LYS  66  23.936  14.076  10.520
  468    HA   LYS  66           HA       LYS  66  24.964  15.629   8.383
  469    HB2  LYS  66           HB2      LYS  66  22.137  14.945   9.203
  470    HB3  LYS  66           HB1      LYS  66  22.534  15.839   7.734
  471    HG2  LYS  66           HG2      LYS  66  23.943  13.971   6.967
  472    HG3  LYS  66           HG1      LYS  66  23.563  13.077   8.440
  473    HD2  LYS  66           HD2      LYS  66  21.171  13.095   7.842
  474    HD3  LYS  66           HD1      LYS  66  21.546  13.989   6.368
  475    HE2  LYS  66           HE2      LYS  66  22.958  12.129   5.587
  476    HE3  LYS  66           HE1      LYS  66  22.605  11.234   7.066
  477    HZ1  LYS  66           HZ1      LYS  66  21.088  10.412   5.535
  478    HZ2  LYS  66           HZ2      LYS  66  20.779  11.939   4.855
  479    HZ3  LYS  66           HZ3      LYS  66  20.179  11.555   6.398
  480    HA   PRO  67           HA       PRO  67  24.481  19.718   9.987
  481    HB2  PRO  67           HB2      PRO  67  23.917  21.118   7.705
  482    HB3  PRO  67           HB1      PRO  67  25.529  20.478   8.081
  483    HG2  PRO  67           HG2      PRO  67  23.437  19.399   6.263
  484    HG3  PRO  67           HG1      PRO  67  25.196  19.450   6.059
  485    HD2  PRO  67           HD2      PRO  67  23.842  17.200   6.827
  486    HD3  PRO  67           HD1      PRO  67  25.528  17.526   7.279
  487    H    ALA  68           HN       ALA  68  22.944  21.338  10.518
  488    HA   ALA  68           HA       ALA  68  20.283  20.466  10.811
  489    HB1  ALA  68           HB1      ALA  68  19.826  22.649  11.701
  490    HB2  ALA  68           HB2      ALA  68  21.237  23.333  10.895
  491    HB3  ALA  68           HB3      ALA  68  21.447  22.195  12.225
  492    H    LYS  69           HN       LYS  69  21.829  22.552   8.427
  493    HA   LYS  69           HA       LYS  69  19.543  23.548   7.152
  494    HB2  LYS  69           HB2      LYS  69  21.819  24.369   6.710
  495    HB3  LYS  69           HB1      LYS  69  22.216  22.842   5.923
  496    HG2  LYS  69           HG2      LYS  69  20.458  23.227   4.246
  497    HG3  LYS  69           HG1      LYS  69  20.022  24.741   5.038
  498    HD2  LYS  69           HD2      LYS  69  22.810  24.193   3.995
  499    HD3  LYS  69           HD1      LYS  69  21.561  24.958   3.012
  500    HE2  LYS  69           HE2      LYS  69  22.536  25.990   5.698
  501    HE3  LYS  69           HE1      LYS  69  23.003  26.641   4.128
  502    HZ1  LYS  69           HZ1      LYS  69  20.386  26.741   5.470
  503    HZ2  LYS  69           HZ2      LYS  69  20.469  26.823   3.775
  504    HZ3  LYS  69           HZ3      LYS  69  21.258  27.991   4.725
  505    H    SER  70           HN       SER  70  21.421  20.594   6.502
  506    HA   SER  70           HA       SER  70  19.879  19.698   4.312
  507    HB2  SER  70           HB2      SER  70  22.083  18.768   4.810
  508    HB3  SER  70           HB1      SER  70  21.482  18.105   6.327
  509    HG   SER  70           HG       SER  70  20.693  17.445   3.681
  510    H    ALA  71           HN       ALA  71  19.644  19.048   7.794
  511    HA   ALA  71           HA       ALA  71  17.381  17.295   7.514
  512    HB1  ALA  71           HB1      ALA  71  18.606  18.665   9.917
  513    HB2  ALA  71           HB2      ALA  71  18.834  16.990   9.415
  514    HB3  ALA  71           HB3      ALA  71  17.263  17.526  10.013
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1  27.679 -23.018  19.560
    2    H2   GLY   1           HT2      GLY   1  28.092 -22.313  21.050
    3    H3   GLY   1           HT3      GLY   1  29.139 -22.170  19.720
    4    HA2  GLY   1           HA2      GLY   1  27.651 -20.752  18.567
    5    HA3  GLY   1           HA1      GLY   1  26.393 -21.051  19.768
    6    H    GLY   2           HN       GLY   2  27.303 -18.461  19.120
    7    HA2  GLY   2           HA2      GLY   2  27.756 -16.511  20.277
    8    HA3  GLY   2           HA1      GLY   2  27.945 -17.479  21.738
    9    HA   PRO   3           HA       PRO   3  32.220 -17.602  19.371
   10    HB2  PRO   3           HB2      PRO   3  31.918 -15.209  17.641
   11    HB3  PRO   3           HB1      PRO   3  32.603 -16.800  17.256
   12    HG2  PRO   3           HG2      PRO   3  30.245 -16.064  16.298
   13    HG3  PRO   3           HG1      PRO   3  30.538 -17.732  16.825
   14    HD2  PRO   3           HD2      PRO   3  29.111 -15.527  18.293
   15    HD3  PRO   3           HD1      PRO   3  28.647 -17.239  18.126
   16    H    GLU   4           HN       GLU   4  34.031 -16.512  20.090
   17    HA   GLU   4           HA       GLU   4  33.527 -14.317  21.932
   18    HB2  GLU   4           HB2      GLU   4  35.964 -16.032  21.442
   19    HB3  GLU   4           HB1      GLU   4  35.908 -14.720  22.618
   20    HG2  GLU   4           HG2      GLU   4  34.102 -15.810  23.825
   21    HG3  GLU   4           HG1      GLU   4  34.001 -17.077  22.600
   22    H    THR   5           HN       THR   5  34.172 -14.480  18.740
   23    HA   THR   5           HA       THR   5  35.663 -11.935  18.777
   24    HB   THR   5           HB       THR   5  36.800 -12.642  16.708
   25    HG1  THR   5           HG1      THR   5  35.691 -15.189  17.230
   26   HG21  THR   5          HG21      THR   5  38.281 -14.328  17.730
   27   HG22  THR   5          HG22      THR   5  37.078 -14.619  18.989
   28   HG23  THR   5          HG23      THR   5  37.884 -13.053  18.882
   29    H    LEU   6           HN       LEU   6  35.283 -10.583  16.883
   30    HA   LEU   6           HA       LEU   6  32.608 -11.057  15.707
   31    HB2  LEU   6           HB2      LEU   6  33.956  -8.425  16.350
   32    HB3  LEU   6           HB1      LEU   6  32.354  -8.616  15.637
   33    HG   LEU   6           HG       LEU   6  33.167  -9.724  18.341
   34   HD11  LEU   6          HD11      LEU   6  33.076  -7.190  18.148
   35   HD12  LEU   6          HD12      LEU   6  31.961  -7.894  19.322
   36   HD13  LEU   6          HD13      LEU   6  31.367  -7.364  17.749
   37   HD21  LEU   6          HD21      LEU   6  31.368 -11.016  17.388
   38   HD22  LEU   6          HD22      LEU   6  30.542  -9.560  16.832
   39   HD23  LEU   6          HD23      LEU   6  30.641  -9.914  18.557
   40    H    CYS   7           HN       CYS   7  33.066 -11.868  13.717
   41    HA   CYS   7           HA       CYS   7  34.656 -10.157  11.928
   42    HB2  CYS   7           HB2      CYS   7  34.887 -13.173  12.124
   43    HB3  CYS   7           HB1      CYS   7  35.684 -12.157  10.925
   44    H    GLY   8           HN       GLY   8  34.184 -10.537   9.635
   45    HA2  GLY   8           HA2      GLY   8  32.796 -11.002   7.845
   46    HA3  GLY   8           HA1      GLY   8  31.942 -12.154   8.868
   47    H    ALA   9           HN       ALA   9  29.908 -11.506   8.195
   48    HA   ALA   9           HA       ALA   9  28.964  -8.865   8.058
   49    HB1  ALA   9           HB1      ALA   9  27.665 -10.545   6.994
   50    HB2  ALA   9           HB2      ALA   9  26.683  -9.966   8.340
   51    HB3  ALA   9           HB3      ALA   9  27.547 -11.496   8.475
   52    H    GLU  10           HN       GLU  10  29.180 -11.126  10.753
   53    HA   GLU  10           HA       GLU  10  27.509  -9.855  12.590
   54    HB2  GLU  10           HB2      GLU  10  28.522 -12.048  13.000
   55    HB3  GLU  10           HB1      GLU  10  30.121 -11.308  13.081
   56    HG2  GLU  10           HG2      GLU  10  29.239 -11.684  15.338
   57    HG3  GLU  10           HG1      GLU  10  29.389  -9.959  15.023
   58    H    LEU  11           HN       LEU  11  30.974  -9.318  11.943
   59    HA   LEU  11           HA       LEU  11  31.310  -7.285  13.878
   60    HB2  LEU  11           HB2      LEU  11  33.214  -8.459  12.870
   61    HB3  LEU  11           HB1      LEU  11  32.830  -7.749  11.304
   62    HG   LEU  11           HG       LEU  11  33.170  -5.486  12.260
   63   HD11  LEU  11          HD11      LEU  11  33.831  -7.085  14.741
   64   HD12  LEU  11          HD12      LEU  11  32.638  -5.797  14.572
   65   HD13  LEU  11          HD13      LEU  11  34.360  -5.418  14.518
   66   HD21  LEU  11          HD21      LEU  11  35.404  -7.508  12.530
   67   HD22  LEU  11          HD22      LEU  11  35.670  -5.771  12.680
   68   HD23  LEU  11          HD23      LEU  11  35.062  -6.441  11.170
   69    H    VAL  12           HN       VAL  12  30.431  -7.214  10.455
   70    HA   VAL  12           HA       VAL  12  30.512  -4.448  10.080
   71    HB   VAL  12           HB       VAL  12  28.922  -6.636   8.756
   72   HG11  VAL  12          HG11      VAL  12  27.541  -4.662   8.486
   73   HG12  VAL  12          HG12      VAL  12  28.462  -4.836   6.993
   74   HG13  VAL  12          HG13      VAL  12  28.956  -3.648   8.198
   75   HG21  VAL  12          HG21      VAL  12  31.161  -4.843   7.787
   76   HG22  VAL  12          HG22      VAL  12  30.484  -6.237   6.944
   77   HG23  VAL  12          HG23      VAL  12  31.393  -6.465   8.439
   78    H    ASP  13           HN       ASP  13  27.884  -6.558  11.170
   79    HA   ASP  13           HA       ASP  13  25.852  -4.619  11.325
   80    HB2  ASP  13           HB2      ASP  13  25.485  -7.077  11.465
   81    HB3  ASP  13           HB1      ASP  13  26.215  -7.067  13.070
   82    H    ALA  14           HN       ALA  14  28.281  -5.677  13.685
   83    HA   ALA  14           HA       ALA  14  27.341  -4.191  15.882
   84    HB1  ALA  14           HB1      ALA  14  30.244  -4.782  15.304
   85    HB2  ALA  14           HB2      ALA  14  29.120  -6.000  15.906
   86    HB3  ALA  14           HB3      ALA  14  29.474  -4.569  16.875
   87    H    LEU  15           HN       LEU  15  29.570  -3.336  13.255
   88    HA   LEU  15           HA       LEU  15  30.373  -0.824  14.258
   89    HB2  LEU  15           HB2      LEU  15  30.153  -1.902  11.444
   90    HB3  LEU  15           HB1      LEU  15  30.823  -0.314  11.811
   91    HG   LEU  15           HG       LEU  15  31.841  -2.853  13.107
   92   HD11  LEU  15          HD11      LEU  15  32.063  -2.789  10.551
   93   HD12  LEU  15          HD12      LEU  15  33.564  -2.969  11.458
   94   HD13  LEU  15          HD13      LEU  15  33.126  -1.400  10.780
   95   HD21  LEU  15          HD21      LEU  15  32.455  -0.895  14.344
   96   HD22  LEU  15          HD22      LEU  15  32.819   0.006  12.873
   97   HD23  LEU  15          HD23      LEU  15  33.871  -1.313  13.382
   98    H    GLN  16           HN       GLN  16  27.671  -1.766  12.158
   99    HA   GLN  16           HA       GLN  16  26.714   0.866  11.712
  100    HB2  GLN  16           HB2      GLN  16  26.072  -1.111  10.335
  101    HB3  GLN  16           HB1      GLN  16  25.125  -1.709  11.696
  102    HG2  GLN  16           HG2      GLN  16  23.737   0.299  11.662
  103    HG3  GLN  16           HG1      GLN  16  24.726   0.987  10.374
  104   HE21  GLN  16          HE21      GLN  16  22.067   0.747   9.750
  105   HE22  GLN  16          HE22      GLN  16  21.805  -0.560   8.701
  106    H    PHE  17           HN       PHE  17  25.975  -1.598  14.142
  107    HA   PHE  17           HA       PHE  17  23.836  -0.289  15.414
  108    HB2  PHE  17           HB2      PHE  17  24.243  -2.586  15.924
  109    HB3  PHE  17           HB1      PHE  17  25.897  -2.249  16.437
  110    HD1  PHE  17           HD1      PHE  17  22.313  -1.813  17.316
  111    HD2  PHE  17           HD2      PHE  17  26.389  -1.349  18.613
  112    HE1  PHE  17           HE1      PHE  17  21.530  -1.392  19.633
  113    HE2  PHE  17           HE2      PHE  17  25.599  -0.934  20.927
  114    HZ   PHE  17           HZ       PHE  17  23.174  -0.955  21.439
  115    H    VAL  18           HN       VAL  18  27.317  -0.279  16.205
  116    HA   VAL  18           HA       VAL  18  27.126   1.424  18.435
  117    HB   VAL  18           HB       VAL  18  29.407   0.918  16.518
  118   HG11  VAL  18          HG11      VAL  18  30.809   1.798  18.411
  119   HG12  VAL  18          HG12      VAL  18  29.323   2.336  19.189
  120   HG13  VAL  18          HG13      VAL  18  29.807   3.026  17.640
  121   HG21  VAL  18          HG21      VAL  18  28.932  -0.122  19.326
  122   HG22  VAL  18          HG22      VAL  18  30.174  -0.644  18.187
  123   HG23  VAL  18          HG23      VAL  18  28.478  -1.014  17.872
  124    H    CYS  19           HN       CYS  19  27.907   2.143  15.041
  125    HA   CYS  19           HA       CYS  19  28.169   4.962  15.414
  126    HB2  CYS  19           HB2      CYS  19  27.582   3.330  12.926
  127    HB3  CYS  19           HB1      CYS  19  27.944   5.046  12.937
  128    H    GLY  20           HN       GLY  20  25.498   2.860  14.555
  129    HA2  GLY  20           HA2      GLY  20  23.228   3.220  14.492
  130    HA3  GLY  20           HA1      GLY  20  23.522   4.634  15.499
  131    H    ASP  21           HN       ASP  21  22.545   6.318  14.577
  132    HA   ASP  21           HA       ASP  21  21.903   6.583  11.862
  133    HB2  ASP  21           HB2      ASP  21  22.210   8.638  14.057
  134    HB3  ASP  21           HB1      ASP  21  21.638   9.041  12.439
  135    H    ARG  22           HN       ARG  22  24.793   7.458  13.653
  136    HA   ARG  22           HA       ARG  22  25.960   9.207  11.775
  137    HB2  ARG  22           HB2      ARG  22  27.202   7.322  13.787
  138    HB3  ARG  22           HB1      ARG  22  28.116   8.510  12.865
  139    HG2  ARG  22           HG2      ARG  22  26.578  10.289  13.766
  140    HG3  ARG  22           HG1      ARG  22  25.869   9.063  14.818
  141    HD2  ARG  22           HD2      ARG  22  28.807   9.792  14.762
  142    HD3  ARG  22           HD1      ARG  22  27.654  10.375  15.957
  143    HE   ARG  22           HE       ARG  22  28.796   7.716  15.804
  144   HH11  ARG  22          HH11      ARG  22  26.195   9.702  17.018
  145   HH12  ARG  22          HH12      ARG  22  25.834   8.629  18.323
  146   HH21  ARG  22          HH21      ARG  22  28.297   6.342  17.518
  147   HH22  ARG  22          HH22      ARG  22  27.011   6.740  18.606
  148    H    GLY  23           HN       GLY  23  26.030   5.673  12.066
  149    HA2  GLY  23           HA2      GLY  23  26.523   4.049  10.497
  150    HA3  GLY  23           HA1      GLY  23  26.550   5.319   9.277
  151    H    PHE  24           HN       PHE  24  28.392   3.796   8.579
  152    HA   PHE  24           HA       PHE  24  30.885   5.048   9.395
  153    HB2  PHE  24           HB2      PHE  24  32.029   2.984   9.950
  154    HB3  PHE  24           HB1      PHE  24  30.614   3.142  10.985
  155    HD1  PHE  24           HD1      PHE  24  32.235   1.202   8.384
  156    HD2  PHE  24           HD2      PHE  24  28.526   1.865  10.441
  157    HE1  PHE  24           HE1      PHE  24  31.376  -0.960   7.533
  158    HE2  PHE  24           HE2      PHE  24  27.668  -0.299   9.594
  159    HZ   PHE  24           HZ       PHE  24  29.091  -1.711   8.141
  160    H    TYR  25           HN       TYR  25  32.688   4.420   7.964
  161    HA   TYR  25           HA       TYR  25  31.928   3.096   5.468
  162    HB2  TYR  25           HB2      TYR  25  32.547   4.933   4.054
  163    HB3  TYR  25           HB1      TYR  25  31.372   5.547   5.217
  164    HD1  TYR  25           HD1      TYR  25  34.889   5.566   4.168
  165    HD2  TYR  25           HD2      TYR  25  32.071   7.012   7.070
  166    HE1  TYR  25           HE1      TYR  25  36.544   7.235   4.937
  167    HE2  TYR  25           HE2      TYR  25  33.730   8.690   7.840
  168    HH   TYR  25           HH       TYR  25  36.146   9.744   6.252
  169    H    PHE  26           HN       PHE  26  33.859   2.907   3.995
  170    HA   PHE  26           HA       PHE  26  36.301   2.559   5.625
  171    HB2  PHE  26           HB2      PHE  26  35.363   1.036   3.179
  172    HB3  PHE  26           HB1      PHE  26  36.912   0.790   3.987
  173    HD1  PHE  26           HD1      PHE  26  33.286   0.284   4.180
  174    HD2  PHE  26           HD2      PHE  26  37.015  -0.151   6.266
  175    HE1  PHE  26           HE1      PHE  26  32.199  -1.239   5.807
  176    HE2  PHE  26           HE2      PHE  26  35.927  -1.675   7.893
  177    HZ   PHE  26           HZ       PHE  26  33.520  -2.218   7.665
  178    H    ASN  27           HN       ASN  27  38.235   3.311   4.875
  179    HA   ASN  27           HA       ASN  27  38.183   5.468   3.004
  180    HB2  ASN  27           HB2      ASN  27  40.439   4.021   4.399
  181    HB3  ASN  27           HB1      ASN  27  40.695   5.396   3.327
  182   HD21  ASN  27          HD21      ASN  27  41.286   5.413   6.190
  183   HD22  ASN  27          HD22      ASN  27  40.270   6.573   6.899
  184    H    LYS  28           HN       LYS  28  39.145   5.619   0.970
  185    HA   LYS  28           HA       LYS  28  39.518   4.874  -1.177
  186    HB2  LYS  28           HB2      LYS  28  41.167   2.835   0.330
  187    HB3  LYS  28           HB1      LYS  28  41.317   3.212  -1.387
  188    HG2  LYS  28           HG2      LYS  28  41.819   5.581  -0.782
  189    HG3  LYS  28           HG1      LYS  28  41.784   5.124   0.921
  190    HD2  LYS  28           HD2      LYS  28  43.606   3.817  -1.115
  191    HD3  LYS  28           HD1      LYS  28  44.097   5.179  -0.106
  192    HE2  LYS  28           HE2      LYS  28  43.532   3.841   1.919
  193    HE3  LYS  28           HE1      LYS  28  43.150   2.470   0.877
  194    HZ1  LYS  28           HZ1      LYS  28  45.769   3.779   1.289
  195    HZ2  LYS  28           HZ2      LYS  28  45.469   2.765  -0.041
  196    HZ3  LYS  28           HZ3      LYS  28  45.356   2.155   1.541
  197    HA   PRO  29           HA       PRO  29  36.424   1.381  -0.551
  198    HB2  PRO  29           HB2      PRO  29  34.389   2.612  -1.933
  199    HB3  PRO  29           HB1      PRO  29  34.621   2.758  -0.181
  200    HG2  PRO  29           HG2      PRO  29  35.371   4.644  -2.359
  201    HG3  PRO  29           HG1      PRO  29  34.705   4.980  -0.750
  202    HD2  PRO  29           HD2      PRO  29  37.344   5.288  -1.323
  203    HD3  PRO  29           HD1      PRO  29  36.773   4.815   0.291
  204    H    THR  30           HN       THR  30  37.555   3.300  -3.234
  205    HA   THR  30           HA       THR  30  36.558   1.661  -5.334
  206    HB   THR  30           HB       THR  30  38.169   2.874  -6.750
  207    HG1  THR  30           HG1      THR  30  39.847   2.947  -5.188
  208   HG21  THR  30          HG21      THR  30  37.370   5.191  -6.183
  209   HG22  THR  30          HG22      THR  30  36.676   4.531  -4.703
  210   HG23  THR  30          HG23      THR  30  36.080   3.992  -6.272
  211    H    GLY  31           HN       GLY  31  39.349   1.529  -3.289
  212    HA2  GLY  31           HA2      GLY  31  40.331  -0.824  -4.790
  213    HA3  GLY  31           HA1      GLY  31  41.380   0.263  -3.884
  214    H    TYR  32           HN       TYR  32  38.556  -0.066  -2.153
  215    HA   TYR  32           HA       TYR  32  39.779  -1.490  -0.055
  216    HB2  TYR  32           HB2      TYR  32  37.947   0.097   0.316
  217    HB3  TYR  32           HB1      TYR  32  36.843  -0.959  -0.564
  218    HD1  TYR  32           HD1      TYR  32  39.239  -1.003   2.316
  219    HD2  TYR  32           HD2      TYR  32  35.628  -2.581   0.608
  220    HE1  TYR  32           HE1      TYR  32  38.813  -2.281   4.397
  221    HE2  TYR  32           HE2      TYR  32  35.202  -3.859   2.690
  222    HH   TYR  32           HH       TYR  32  36.389  -3.259   5.490
  223    H    GLY  33           HN       GLY  33  39.917  -3.619   0.378
  224    HA2  GLY  33           HA2      GLY  33  39.191  -5.542  -1.599
  225    HA3  GLY  33           HA1      GLY  33  39.837  -5.895   0.000
  226    H    SER  34           HN       SER  34  37.738  -7.336  -1.345
  227    HA   SER  34           HA       SER  34  35.387  -6.643   0.303
  228    HB2  SER  34           HB2      SER  34  34.089  -7.993  -1.265
  229    HB3  SER  34           HB1      SER  34  34.997  -6.758  -2.132
  230    HG   SER  34           HG       SER  34  35.031  -9.147  -2.805
  231    H    SER  35           HN       SER  35  37.927  -8.909  -0.076
  232    HA   SER  35           HA       SER  35  36.702 -11.237   0.939
  233    HB2  SER  35           HB2      SER  35  38.928 -12.059   1.193
  234    HB3  SER  35           HB1      SER  35  38.935 -11.037  -0.240
  235    HG   SER  35           HG       SER  35  40.398 -10.804   1.958
  236    H    SER  36           HN       SER  36  38.203  -8.448   2.475
  237    HA   SER  36           HA       SER  36  38.372  -7.790   4.667
  238    HB2  SER  36           HB2      SER  36  35.848  -9.448   4.896
  239    HB3  SER  36           HB1      SER  36  36.402  -8.249   6.061
  240    HG   SER  36           HG       SER  36  34.839  -7.703   4.193
  241    H    ARG  37           HN       ARG  37  39.627 -10.358   3.809
  242    HA   ARG  37           HA       ARG  37  40.078 -11.420   6.513
  243    HB2  ARG  37           HB2      ARG  37  39.440 -13.067   4.060
  244    HB3  ARG  37           HB1      ARG  37  40.142 -13.737   5.533
  245    HG2  ARG  37           HG2      ARG  37  38.211 -12.921   6.832
  246    HG3  ARG  37           HG1      ARG  37  37.507 -12.245   5.364
  247    HD2  ARG  37           HD2      ARG  37  37.437 -14.497   4.357
  248    HD3  ARG  37           HD1      ARG  37  38.133 -15.174   5.826
  249    HE   ARG  37           HE       ARG  37  35.804 -13.732   6.504
  250   HH11  ARG  37          HH11      ARG  37  36.802 -16.612   4.813
  251   HH12  ARG  37          HH12      ARG  37  35.330 -17.458   5.139
  252   HH21  ARG  37          HH21      ARG  37  33.890 -14.861   6.914
  253   HH22  ARG  37          HH22      ARG  37  33.691 -16.476   6.321
  254    H    ARG  38           HN       ARG  38  42.149 -12.228   6.877
  255    HA   ARG  38           HA       ARG  38  44.435 -12.253   6.642
  256    HB2  ARG  38           HB2      ARG  38  43.671 -12.925   3.791
  257    HB3  ARG  38           HB1      ARG  38  45.271 -13.149   4.499
  258    HG2  ARG  38           HG2      ARG  38  44.423 -14.745   6.094
  259    HG3  ARG  38           HG1      ARG  38  42.758 -14.398   5.632
  260    HD2  ARG  38           HD2      ARG  38  44.846 -15.557   3.768
  261    HD3  ARG  38           HD1      ARG  38  43.632 -16.509   4.616
  262    HE   ARG  38           HE       ARG  38  42.302 -14.477   3.208
  263   HH11  ARG  38          HH11      ARG  38  44.233 -17.314   2.588
  264   HH12  ARG  38          HH12      ARG  38  43.476 -17.642   1.069
  265   HH21  ARG  38          HH21      ARG  38  41.332 -14.932   1.217
  266   HH22  ARG  38          HH22      ARG  38  41.845 -16.305   0.295
  267    H    ALA  39           HN       ALA  39  43.229  -9.705   6.474
  268    HA   ALA  39           HA       ALA  39  44.262  -8.240   4.248
  269    HB1  ALA  39           HB1      ALA  39  43.667  -6.821   6.795
  270    HB2  ALA  39           HB2      ALA  39  42.339  -7.703   6.041
  271    HB3  ALA  39           HB3      ALA  39  43.177  -6.437   5.144
  272    HA   PRO  40           HA       PRO  40  48.355  -7.463   5.710
  273    HB2  PRO  40           HB2      PRO  40  48.893  -5.030   4.616
  274    HB3  PRO  40           HB1      PRO  40  48.731  -6.501   3.641
  275    HG2  PRO  40           HG2      PRO  40  46.787  -4.295   4.073
  276    HG3  PRO  40           HG1      PRO  40  47.131  -5.231   2.610
  277    HD2  PRO  40           HD2      PRO  40  44.961  -5.695   4.274
  278    HD3  PRO  40           HD1      PRO  40  45.666  -6.910   3.187
  279    H    GLN  41           HN       GLN  41  46.822  -7.125   7.863
  280    HA   GLN  41           HA       GLN  41  46.499  -5.981   9.835
  281    HB2  GLN  41           HB2      GLN  41  49.248  -5.026   9.018
  282    HB3  GLN  41           HB1      GLN  41  48.532  -4.699  10.598
  283    HG2  GLN  41           HG2      GLN  41  48.354  -7.065  11.078
  284    HG3  GLN  41           HG1      GLN  41  48.867  -7.480   9.443
  285   HE21  GLN  41          HE21      GLN  41  50.248  -8.296  11.910
  286   HE22  GLN  41          HE22      GLN  41  51.798  -7.605  11.850
  287    H    THR  42           HN       THR  42  45.065  -4.803   7.860
  288    HA   THR  42           HA       THR  42  45.155  -1.988   8.663
  289    HB   THR  42           HB       THR  42  46.463  -2.177   6.541
  290    HG1  THR  42           HG1      THR  42  45.625  -0.339   5.955
  291   HG21  THR  42          HG21      THR  42  45.317  -2.783   4.488
  292   HG22  THR  42          HG22      THR  42  43.800  -3.006   5.359
  293   HG23  THR  42          HG23      THR  42  45.148  -4.107   5.640
  294    H    GLY  43           HN       GLY  43  43.166  -0.878   8.327
  295    HA2  GLY  43           HA2      GLY  43  40.875  -0.726   7.768
  296    HA3  GLY  43           HA1      GLY  43  40.856  -2.459   7.459
  297    H    ILE  44           HN       ILE  44  39.034  -0.862   9.114
  298    HA   ILE  44           HA       ILE  44  39.603  -1.337  11.871
  299    HB   ILE  44           HB       ILE  44  37.281  -0.684  12.247
  300   HG12  ILE  44          HG12      ILE  44  37.012  -0.778   9.223
  301   HG13  ILE  44          HG11      ILE  44  36.309  -1.958  10.327
  302   HG21  ILE  44          HG21      ILE  44  37.365   1.521  11.162
  303   HG22  ILE  44          HG22      ILE  44  38.570   0.923  10.022
  304   HG23  ILE  44          HG23      ILE  44  38.968   1.058  11.734
  305   HD11  ILE  44          HD11      ILE  44  35.681   1.000  10.247
  306   HD12  ILE  44          HD12      ILE  44  35.050  -0.129  11.445
  307   HD13  ILE  44          HD13      ILE  44  34.614  -0.310   9.745
  308    H    VAL  45           HN       VAL  45  38.024  -3.147   9.321
  309    HA   VAL  45           HA       VAL  45  36.718  -5.067  10.915
  310    HB   VAL  45           HB       VAL  45  37.760  -5.166   8.085
  311   HG11  VAL  45          HG11      VAL  45  37.758  -7.454   8.787
  312   HG12  VAL  45          HG12      VAL  45  36.221  -7.217   7.953
  313   HG13  VAL  45          HG13      VAL  45  36.272  -7.243   9.712
  314   HG21  VAL  45          HG21      VAL  45  35.264  -5.120   7.652
  315   HG22  VAL  45          HG22      VAL  45  35.895  -3.657   8.410
  316   HG23  VAL  45          HG23      VAL  45  35.034  -4.852   9.379
  317    H    ASP  46           HN       ASP  46  39.905  -5.115   9.363
  318    HA   ASP  46           HA       ASP  46  40.641  -7.683  10.264
  319    HB2  ASP  46           HB2      ASP  46  41.772  -6.454   8.421
  320    HB3  ASP  46           HB1      ASP  46  42.455  -5.349   9.614
  321    H    GLU  47           HN       GLU  47  41.173  -4.444  11.647
  322    HA   GLU  47           HA       GLU  47  42.857  -5.237  13.746
  323    HB2  GLU  47           HB2      GLU  47  42.509  -2.890  13.093
  324    HB3  GLU  47           HB1      GLU  47  40.841  -2.974  13.659
  325    HG2  GLU  47           HG2      GLU  47  42.271  -1.941  15.366
  326    HG3  GLU  47           HG1      GLU  47  41.649  -3.484  15.944
  327    H    CYS  48           HN       CYS  48  39.304  -4.756  13.773
  328    HA   CYS  48           HA       CYS  48  38.998  -5.658  16.469
  329    HB2  CYS  48           HB2      CYS  48  36.984  -5.375  14.232
  330    HB3  CYS  48           HB1      CYS  48  36.586  -5.775  15.890
  331    H    CYS  49           HN       CYS  49  38.632  -7.227  13.319
  332    HA   CYS  49           HA       CYS  49  37.541  -9.641  14.227
  333    HB2  CYS  49           HB2      CYS  49  37.551  -8.986  11.857
  334    HB3  CYS  49           HB1      CYS  49  39.306  -9.162  11.814
  335    H    PHE  50           HN       PHE  50  40.921  -8.719  13.633
  336    HA   PHE  50           HA       PHE  50  41.855 -11.256  14.676
  337    HB2  PHE  50           HB2      PHE  50  43.180  -8.832  13.498
  338    HB3  PHE  50           HB1      PHE  50  44.134 -10.102  14.276
  339    HD1  PHE  50           HD1      PHE  50  41.664  -9.379  11.599
  340    HD2  PHE  50           HD2      PHE  50  44.511 -12.193  13.151
  341    HE1  PHE  50           HE1      PHE  50  41.479 -10.702   9.516
  342    HE2  PHE  50           HE2      PHE  50  44.330 -13.526  11.064
  343    HZ   PHE  50           HZ       PHE  50  42.815 -12.780   9.247
  344    H    ARG  51           HN       ARG  51  42.814  -7.906  15.418
  345    HA   ARG  51           HA       ARG  51  43.555  -8.610  18.119
  346    HB2  ARG  51           HB2      ARG  51  43.476  -5.966  16.653
  347    HB3  ARG  51           HB1      ARG  51  44.050  -6.158  18.311
  348    HG2  ARG  51           HG2      ARG  51  45.756  -7.758  17.548
  349    HG3  ARG  51           HG1      ARG  51  45.173  -7.601  15.891
  350    HD2  ARG  51           HD2      ARG  51  45.725  -5.193  15.929
  351    HD3  ARG  51           HD1      ARG  51  46.316  -5.361  17.581
  352    HE   ARG  51           HE       ARG  51  48.249  -6.339  16.742
  353   HH11  ARG  51          HH11      ARG  51  45.775  -6.242  14.289
  354   HH12  ARG  51          HH12      ARG  51  46.846  -6.733  13.022
  355   HH21  ARG  51          HH21      ARG  51  49.626  -6.971  15.066
  356   HH22  ARG  51          HH22      ARG  51  49.010  -7.142  13.457
  357    H    SER  52           HN       SER  52  42.721  -7.359  19.995
  358    HA   SER  52           HA       SER  52  39.803  -7.288  19.887
  359    HB2  SER  52           HB2      SER  52  40.785  -8.459  21.761
  360    HB3  SER  52           HB1      SER  52  41.774  -7.061  22.172
  361    HG   SER  52           HG       SER  52  40.126  -6.559  23.379
  362    H    CYS  53           HN       CYS  53  38.858  -5.442  19.288
  363    HA   CYS  53           HA       CYS  53  40.161  -2.891  20.008
  364    HB2  CYS  53           HB2      CYS  53  38.976  -1.888  18.175
  365    HB3  CYS  53           HB1      CYS  53  39.711  -3.368  17.571
  366    H    ASP  54           HN       ASP  54  39.141  -1.452  21.293
  367    HA   ASP  54           HA       ASP  54  36.838  -2.324  22.771
  368    HB2  ASP  54           HB2      ASP  54  38.833  -0.906  23.611
  369    HB3  ASP  54           HB1      ASP  54  37.987   0.453  22.871
  370    H    LEU  55           HN       LEU  55  34.817  -1.279  22.899
  371    HA   LEU  55           HA       LEU  55  33.714  -0.498  20.414
  372    HB2  LEU  55           HB2      LEU  55  32.668  -0.287  23.242
  373    HB3  LEU  55           HB1      LEU  55  31.713   0.132  21.818
  374    HG   LEU  55           HG       LEU  55  33.053  -2.560  22.178
  375   HD11  LEU  55          HD11      LEU  55  31.324  -2.051  23.947
  376   HD12  LEU  55          HD12      LEU  55  30.922  -3.425  22.915
  377   HD13  LEU  55          HD13      LEU  55  30.142  -1.865  22.652
  378   HD21  LEU  55          HD21      LEU  55  31.244  -3.154  20.460
  379   HD22  LEU  55          HD22      LEU  55  32.555  -2.135  19.873
  380   HD23  LEU  55          HD23      LEU  55  30.992  -1.418  20.271
  381    H    ARG  56           HN       ARG  56  34.908   1.329  23.185
  382    HA   ARG  56           HA       ARG  56  33.892   3.854  22.559
  383    HB2  ARG  56           HB2      ARG  56  35.039   3.338  24.671
  384    HB3  ARG  56           HB1      ARG  56  36.565   3.158  23.801
  385    HG2  ARG  56           HG2      ARG  56  36.508   5.484  23.109
  386    HG3  ARG  56           HG1      ARG  56  34.901   5.689  23.808
  387    HD2  ARG  56           HD2      ARG  56  36.580   6.586  25.342
  388    HD3  ARG  56           HD1      ARG  56  35.828   5.160  26.049
  389    HE   ARG  56           HE       ARG  56  38.191   4.462  24.602
  390   HH11  ARG  56          HH11      ARG  56  37.047   5.882  27.574
  391   HH12  ARG  56          HH12      ARG  56  38.455   5.434  28.468
  392   HH21  ARG  56          HH21      ARG  56  40.025   3.893  25.800
  393   HH22  ARG  56          HH22      ARG  56  40.131   4.316  27.475
  394    H    ARG  57           HN       ARG  57  36.991   2.382  21.582
  395    HA   ARG  57           HA       ARG  57  37.686   4.603  19.893
  396    HB2  ARG  57           HB2      ARG  57  39.562   3.203  19.181
  397    HB3  ARG  57           HB1      ARG  57  39.408   3.173  20.938
  398    HG2  ARG  57           HG2      ARG  57  38.279   1.030  20.858
  399    HG3  ARG  57           HG1      ARG  57  38.244   1.063  19.095
  400    HD2  ARG  57           HD2      ARG  57  40.779   1.092  20.746
  401    HD3  ARG  57           HD1      ARG  57  40.084  -0.357  20.029
  402    HE   ARG  57           HE       ARG  57  40.371   1.532  17.985
  403   HH11  ARG  57          HH11      ARG  57  42.355  -0.291  20.196
  404   HH12  ARG  57          HH12      ARG  57  43.707  -0.352  19.120
  405   HH21  ARG  57          HH21      ARG  57  42.151   1.431  16.597
  406   HH22  ARG  57          HH22      ARG  57  43.596   0.616  17.095
  407    H    LEU  58           HN       LEU  58  35.839   1.704  19.543
  408    HA   LEU  58           HA       LEU  58  36.076   1.342  16.756
  409    HB2  LEU  58           HB2      LEU  58  35.100  -0.287  18.451
  410    HB3  LEU  58           HB1      LEU  58  33.629   0.684  18.391
  411    HG   LEU  58           HG       LEU  58  33.708   0.389  15.851
  412   HD11  LEU  58          HD11      LEU  58  35.814  -1.595  16.727
  413   HD12  LEU  58          HD12      LEU  58  35.964  -0.330  15.517
  414   HD13  LEU  58          HD13      LEU  58  34.966  -1.741  15.191
  415   HD21  LEU  58          HD21      LEU  58  33.281  -1.923  17.753
  416   HD22  LEU  58          HD22      LEU  58  32.889  -2.035  16.037
  417   HD23  LEU  58          HD23      LEU  58  32.066  -0.851  17.054
  418    H    ASP  59           HN       ASP  59  33.908   3.283  18.745
  419    HA   ASP  59           HA       ASP  59  32.120   4.107  16.739
  420    HB2  ASP  59           HB2      ASP  59  31.815   4.388  19.225
  421    HB3  ASP  59           HB1      ASP  59  32.955   5.731  19.146
  422    H    MET  60           HN       MET  60  35.392   5.017  17.366
  423    HA   MET  60           HA       MET  60  35.387   7.623  16.267
  424    HB2  MET  60           HB2      MET  60  37.590   5.552  16.437
  425    HB3  MET  60           HB1      MET  60  37.839   7.220  15.939
  426    HG2  MET  60           HG2      MET  60  37.061   8.054  18.070
  427    HG3  MET  60           HG1      MET  60  36.569   6.438  18.573
  428    HE1  MET  60           HE1      MET  60  40.047   7.594  16.721
  429    HE2  MET  60           HE2      MET  60  40.705   8.264  18.213
  430    HE3  MET  60           HE3      MET  60  39.155   8.840  17.605
  431    H    TYR  61           HN       TYR  61  35.411   4.441  14.830
  432    HA   TYR  61           HA       TYR  61  36.203   5.333  12.191
  433    HB2  TYR  61           HB2      TYR  61  34.779   2.750  12.833
  434    HB3  TYR  61           HB1      TYR  61  35.869   3.105  11.507
  435    HD1  TYR  61           HD1      TYR  61  35.869   1.143  14.227
  436    HD2  TYR  61           HD2      TYR  61  38.098   4.473  12.675
  437    HE1  TYR  61           HE1      TYR  61  37.850   0.436  15.547
  438    HE2  TYR  61           HE2      TYR  61  40.074   3.768  13.993
  439    HH   TYR  61           HH       TYR  61  40.983   1.916  15.098
  440    H    CYS  62           HN       CYS  62  33.452   5.913  13.909
  441    HA   CYS  62           HA       CYS  62  31.429   5.358  11.985
  442    HB2  CYS  62           HB2      CYS  62  31.536   7.327  14.280
  443    HB3  CYS  62           HB1      CYS  62  30.088   6.981  13.337
  444    H    ALA  63           HN       ALA  63  30.388   6.815  10.569
  445    HA   ALA  63           HA       ALA  63  32.103   8.621   9.230
  446    HB1  ALA  63           HB1      ALA  63  30.491   8.643   7.590
  447    HB2  ALA  63           HB2      ALA  63  29.162   8.682   8.749
  448    HB3  ALA  63           HB3      ALA  63  30.008   7.170   8.428
  449    HA   PRO  64           HA       PRO  64  31.351  12.570  11.005
  450    HB2  PRO  64           HB2      PRO  64  30.112  13.474   8.446
  451    HB3  PRO  64           HB1      PRO  64  31.484  14.159   9.339
  452    HG2  PRO  64           HG2      PRO  64  31.843  12.770   7.101
  453    HG3  PRO  64           HG1      PRO  64  32.983  12.665   8.454
  454    HD2  PRO  64           HD2      PRO  64  30.931  10.672   7.572
  455    HD3  PRO  64           HD1      PRO  64  32.523  10.416   8.312
  456    H    LEU  65           HN       LEU  65  29.721  13.868  11.932
  457    HA   LEU  65           HA       LEU  65  27.222  12.630  12.360
  458    HB2  LEU  65           HB2      LEU  65  28.044  15.506  12.847
  459    HB3  LEU  65           HB1      LEU  65  26.631  14.712  13.540
  460    HG   LEU  65           HG       LEU  65  29.495  13.798  13.946
  461   HD11  LEU  65          HD11      LEU  65  28.997  14.573  16.331
  462   HD12  LEU  65          HD12      LEU  65  27.605  15.425  15.661
  463   HD13  LEU  65          HD13      LEU  65  29.235  15.853  15.140
  464   HD21  LEU  65          HD21      LEU  65  28.337  12.472  15.808
  465   HD22  LEU  65          HD22      LEU  65  28.033  11.923  14.161
  466   HD23  LEU  65          HD23      LEU  65  26.815  12.875  15.009
  467    H    LYS  66           HN       LYS  66  25.192  13.041  11.581
  468    HA   LYS  66           HA       LYS  66  25.016  13.956   8.901
  469    HB2  LYS  66           HB2      LYS  66  22.629  13.506   9.111
  470    HB3  LYS  66           HB1      LYS  66  23.541  12.212   9.883
  471    HG2  LYS  66           HG2      LYS  66  23.185  13.266  12.083
  472    HG3  LYS  66           HG1      LYS  66  22.280  14.569  11.316
  473    HD2  LYS  66           HD2      LYS  66  20.628  12.944  10.482
  474    HD3  LYS  66           HD1      LYS  66  21.528  11.634  11.244
  475    HE2  LYS  66           HE2      LYS  66  21.185  12.671  13.452
  476    HE3  LYS  66           HE1      LYS  66  20.293  13.991  12.696
  477    HZ1  LYS  66           HZ1      LYS  66  19.530  11.156  12.960
  478    HZ2  LYS  66           HZ2      LYS  66  18.850  12.122  11.740
  479    HZ3  LYS  66           HZ3      LYS  66  18.643  12.541  13.374
  480    HA   PRO  67           HA       PRO  67  24.205  18.263   9.516
  481    HB2  PRO  67           HB2      PRO  67  22.572  18.831   7.410
  482    HB3  PRO  67           HB1      PRO  67  24.306  18.498   7.227
  483    HG2  PRO  67           HG2      PRO  67  21.974  16.703   6.764
  484    HG3  PRO  67           HG1      PRO  67  23.466  16.882   5.826
  485    HD2  PRO  67           HD2      PRO  67  23.066  14.831   7.593
  486    HD3  PRO  67           HD1      PRO  67  24.675  15.482   7.216
  487    H    ALA  68           HN       ALA  68  22.590  19.815  10.129
  488    HA   ALA  68           HA       ALA  68  20.529  18.806  11.753
  489    HB1  ALA  68           HB1      ALA  68  20.471  21.595  10.640
  490    HB2  ALA  68           HB2      ALA  68  21.718  21.121  11.794
  491    HB3  ALA  68           HB3      ALA  68  20.016  21.033  12.249
  492    H    LYS  69           HN       LYS  69  20.523  20.048   8.454
  493    HA   LYS  69           HA       LYS  69  17.752  20.223   8.060
  494    HB2  LYS  69           HB2      LYS  69  19.388  21.139   6.474
  495    HB3  LYS  69           HB1      LYS  69  19.905  19.505   6.055
  496    HG2  LYS  69           HG2      LYS  69  17.742  18.971   5.139
  497    HG3  LYS  69           HG1      LYS  69  17.052  20.475   5.751
  498    HD2  LYS  69           HD2      LYS  69  17.505  20.804   3.407
  499    HD3  LYS  69           HD1      LYS  69  18.716  21.716   4.307
  500    HE2  LYS  69           HE2      LYS  69  20.329  19.876   4.023
  501    HE3  LYS  69           HE1      LYS  69  19.117  18.945   3.142
  502    HZ1  LYS  69           HZ1      LYS  69  20.377  21.502   2.335
  503    HZ2  LYS  69           HZ2      LYS  69  18.993  20.876   1.573
  504    HZ3  LYS  69           HZ3      LYS  69  20.454  20.008   1.537
  505    H    SER  70           HN       SER  70  19.981  17.501   7.490
  506    HA   SER  70           HA       SER  70  18.013  15.710   6.519
  507    HB2  SER  70           HB2      SER  70  19.683  13.965   6.961
  508    HB3  SER  70           HB1      SER  70  20.423  15.358   6.177
  509    HG   SER  70           HG       SER  70  20.581  14.490   8.850
  510    H    ALA  71           HN       ALA  71  19.207  16.449   9.752
  511    HA   ALA  71           HA       ALA  71  18.054  14.336  11.173
  512    HB1  ALA  71           HB1      ALA  71  19.659  16.079  12.062
  513    HB2  ALA  71           HB2      ALA  71  18.308  15.694  13.129
  514    HB3  ALA  71           HB3      ALA  71  18.285  17.178  12.176
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1  30.326 -16.466  20.705
    2    H2   GLY   1           HT2      GLY   1  29.886 -16.428  22.345
    3    H3   GLY   1           HT3      GLY   1  28.720 -16.770  21.157
    4    HA2  GLY   1           HA2      GLY   1  29.328 -18.809  22.231
    5    HA3  GLY   1           HA1      GLY   1  29.939 -18.813  20.575
    6    H    GLY   2           HN       GLY   2  31.810 -19.940  20.693
    7    HA2  GLY   2           HA2      GLY   2  33.578 -20.017  22.882
    8    HA3  GLY   2           HA1      GLY   2  33.986 -20.461  21.230
    9    HA   PRO   3           HA       PRO   3  36.210 -16.660  20.809
   10    HB2  PRO   3           HB2      PRO   3  35.498 -15.654  18.378
   11    HB3  PRO   3           HB1      PRO   3  36.451 -17.136  18.566
   12    HG2  PRO   3           HG2      PRO   3  33.616 -16.797  17.831
   13    HG3  PRO   3           HG1      PRO   3  34.753 -18.090  17.412
   14    HD2  PRO   3           HD2      PRO   3  32.760 -18.192  19.411
   15    HD3  PRO   3           HD1      PRO   3  34.062 -19.369  19.159
   16    H    GLU   4           HN       GLU   4  35.953 -14.854  21.950
   17    HA   GLU   4           HA       GLU   4  33.388 -13.483  22.035
   18    HB2  GLU   4           HB2      GLU   4  35.975 -13.051  23.539
   19    HB3  GLU   4           HB1      GLU   4  34.531 -12.063  23.763
   20    HG2  GLU   4           HG2      GLU   4  33.244 -14.035  24.421
   21    HG3  GLU   4           HG1      GLU   4  34.640 -15.069  24.120
   22    H    THR   5           HN       THR   5  35.970 -13.370  20.013
   23    HA   THR   5           HA       THR   5  36.248 -10.514  19.732
   24    HB   THR   5           HB       THR   5  37.663 -11.073  17.813
   25    HG1  THR   5           HG1      THR   5  36.316 -12.882  17.174
   26   HG21  THR   5          HG21      THR   5  38.189 -13.027  20.063
   27   HG22  THR   5          HG22      THR   5  38.504 -11.297  20.188
   28   HG23  THR   5          HG23      THR   5  39.377 -12.270  19.003
   29    H    LEU   6           HN       LEU   6  35.804  -9.427  17.648
   30    HA   LEU   6           HA       LEU   6  33.247 -10.384  16.508
   31    HB2  LEU   6           HB2      LEU   6  34.356  -7.567  16.645
   32    HB3  LEU   6           HB1      LEU   6  32.791  -8.031  15.978
   33    HG   LEU   6           HG       LEU   6  33.639  -8.551  18.841
   34   HD11  LEU   6          HD11      LEU   6  32.298  -6.670  19.476
   35   HD12  LEU   6          HD12      LEU   6  31.667  -6.484  17.838
   36   HD13  LEU   6          HD13      LEU   6  33.355  -6.104  18.181
   37   HD21  LEU   6          HD21      LEU   6  31.965 -10.128  18.142
   38   HD22  LEU   6          HD22      LEU   6  31.050  -8.875  17.302
   39   HD23  LEU   6          HD23      LEU   6  31.122  -8.884  19.065
   40    H    CYS   7           HN       CYS   7  33.279 -11.038  14.459
   41    HA   CYS   7           HA       CYS   7  34.858  -9.708  12.453
   42    HB2  CYS   7           HB2      CYS   7  36.511 -11.251  13.578
   43    HB3  CYS   7           HB1      CYS   7  35.524 -12.601  13.022
   44    H    GLY   8           HN       GLY   8  33.889  -9.909  10.508
   45    HA2  GLY   8           HA2      GLY   8  32.777 -11.200   8.806
   46    HA3  GLY   8           HA1      GLY   8  32.037 -12.167  10.080
   47    H    ALA   9           HN       ALA   9  29.927 -11.828   9.412
   48    HA   ALA   9           HA       ALA   9  28.789  -9.339   8.753
   49    HB1  ALA   9           HB1      ALA   9  27.720 -12.000   9.582
   50    HB2  ALA   9           HB2      ALA   9  27.420 -11.077   8.110
   51    HB3  ALA   9           HB3      ALA   9  26.628 -10.614   9.617
   52    H    GLU  10           HN       GLU  10  29.177 -11.015  11.841
   53    HA   GLU  10           HA       GLU  10  27.530  -9.373  13.415
   54    HB2  GLU  10           HB2      GLU  10  30.029 -10.936  14.080
   55    HB3  GLU  10           HB1      GLU  10  29.050 -10.120  15.298
   56    HG2  GLU  10           HG2      GLU  10  27.110 -11.448  14.714
   57    HG3  GLU  10           HG1      GLU  10  27.961 -12.163  13.346
   58    H    LEU  11           HN       LEU  11  30.979  -9.082  12.587
   59    HA   LEU  11           HA       LEU  11  31.498  -6.803  14.166
   60    HB2  LEU  11           HB2      LEU  11  33.297  -8.177  13.228
   61    HB3  LEU  11           HB1      LEU  11  32.817  -7.716  11.595
   62    HG   LEU  11           HG       LEU  11  33.291  -5.343  12.136
   63   HD11  LEU  11          HD11      LEU  11  32.892  -5.245  14.488
   64   HD12  LEU  11          HD12      LEU  11  34.623  -4.962  14.292
   65   HD13  LEU  11          HD13      LEU  11  34.041  -6.544  14.809
   66   HD21  LEU  11          HD21      LEU  11  35.815  -5.660  12.495
   67   HD22  LEU  11          HD22      LEU  11  35.104  -6.486  11.111
   68   HD23  LEU  11          HD23      LEU  11  35.474  -7.388  12.580
   69    H    VAL  12           HN       VAL  12  30.585  -7.125  10.741
   70    HA   VAL  12           HA       VAL  12  30.606  -4.386  10.135
   71    HB   VAL  12           HB       VAL  12  29.174  -6.751   8.933
   72   HG11  VAL  12          HG11      VAL  12  28.678  -5.116   7.020
   73   HG12  VAL  12          HG12      VAL  12  29.055  -3.815   8.151
   74   HG13  VAL  12          HG13      VAL  12  27.696  -4.893   8.470
   75   HG21  VAL  12          HG21      VAL  12  30.778  -6.413   7.147
   76   HG22  VAL  12          HG22      VAL  12  31.653  -6.453   8.677
   77   HG23  VAL  12          HG23      VAL  12  31.342  -4.911   7.879
   78    H    ASP  13           HN       ASP  13  28.020  -6.518  11.277
   79    HA   ASP  13           HA       ASP  13  25.915  -4.654  11.207
   80    HB2  ASP  13           HB2      ASP  13  26.377  -7.141  12.860
   81    HB3  ASP  13           HB1      ASP  13  24.896  -6.192  12.964
   82    H    ALA  14           HN       ALA  14  28.313  -5.442  13.689
   83    HA   ALA  14           HA       ALA  14  27.233  -3.912  15.787
   84    HB1  ALA  14           HB1      ALA  14  29.556  -3.913  16.684
   85    HB2  ALA  14           HB2      ALA  14  30.110  -4.606  15.158
   86    HB3  ALA  14           HB3      ALA  14  29.007  -5.516  16.193
   87    H    LEU  15           HN       LEU  15  29.416  -3.053  13.133
   88    HA   LEU  15           HA       LEU  15  30.043  -0.440  13.999
   89    HB2  LEU  15           HB2      LEU  15  29.944  -1.711  11.261
   90    HB3  LEU  15           HB1      LEU  15  30.476  -0.049  11.519
   91    HG   LEU  15           HG       LEU  15  31.673  -2.390  13.016
   92   HD11  LEU  15          HD11      LEU  15  33.474  -2.410  11.404
   93   HD12  LEU  15          HD12      LEU  15  32.793  -1.025  10.552
   94   HD13  LEU  15          HD13      LEU  15  31.963  -2.581  10.509
   95   HD21  LEU  15          HD21      LEU  15  32.396   0.521  12.579
   96   HD22  LEU  15          HD22      LEU  15  33.569  -0.656  13.168
   97   HD23  LEU  15          HD23      LEU  15  32.120  -0.310  14.110
   98    H    GLN  16           HN       GLN  16  27.412  -1.688  11.976
   99    HA   GLN  16           HA       GLN  16  26.286   0.825  11.310
  100    HB2  GLN  16           HB2      GLN  16  25.091  -1.943  11.472
  101    HB3  GLN  16           HB1      GLN  16  24.203  -0.539  10.883
  102    HG2  GLN  16           HG2      GLN  16  25.804  -0.194   9.101
  103    HG3  GLN  16           HG1      GLN  16  26.858  -1.451   9.748
  104   HE21  GLN  16          HE21      GLN  16  25.574  -1.396   7.061
  105   HE22  GLN  16          HE22      GLN  16  24.608  -2.790   6.981
  106    H    PHE  17           HN       PHE  17  25.747  -1.416  13.988
  107    HA   PHE  17           HA       PHE  17  23.562  -0.014  15.144
  108    HB2  PHE  17           HB2      PHE  17  23.861  -2.274  15.789
  109    HB3  PHE  17           HB1      PHE  17  25.541  -2.001  16.254
  110    HD1  PHE  17           HD1      PHE  17  22.003  -1.329  17.166
  111    HD2  PHE  17           HD2      PHE  17  26.120  -1.030  18.375
  112    HE1  PHE  17           HE1      PHE  17  21.284  -0.753  19.472
  113    HE2  PHE  17           HE2      PHE  17  25.402  -0.464  20.680
  114    HZ   PHE  17           HZ       PHE  17  22.983  -0.323  21.229
  115    H    VAL  18           HN       VAL  18  27.031  -0.061  15.951
  116    HA   VAL  18           HA       VAL  18  26.866   1.797  18.063
  117    HB   VAL  18           HB       VAL  18  29.185   1.077  16.253
  118   HG11  VAL  18          HG11      VAL  18  29.074   2.617  18.857
  119   HG12  VAL  18          HG12      VAL  18  29.626   3.220  17.294
  120   HG13  VAL  18          HG13      VAL  18  30.559   1.989  18.147
  121   HG21  VAL  18          HG21      VAL  18  29.808  -0.471  17.965
  122   HG22  VAL  18          HG22      VAL  18  28.084  -0.727  17.693
  123   HG23  VAL  18          HG23      VAL  18  28.628   0.195  19.095
  124    H    CYS  19           HN       CYS  19  27.815   2.243  14.653
  125    HA   CYS  19           HA       CYS  19  28.123   5.077  14.886
  126    HB2  CYS  19           HB2      CYS  19  27.744   3.307  12.457
  127    HB3  CYS  19           HB1      CYS  19  28.184   5.008  12.406
  128    H    GLY  20           HN       GLY  20  25.527   2.974  13.725
  129    HA2  GLY  20           HA2      GLY  20  23.289   3.375  13.376
  130    HA3  GLY  20           HA1      GLY  20  23.467   4.756  14.454
  131    H    ASP  21           HN       ASP  21  22.599   6.468  13.461
  132    HA   ASP  21           HA       ASP  21  22.320   6.806  10.688
  133    HB2  ASP  21           HB2      ASP  21  22.265   8.777  12.974
  134    HB3  ASP  21           HB1      ASP  21  21.931   9.242  11.307
  135    H    ARG  22           HN       ARG  22  24.941   7.587  12.859
  136    HA   ARG  22           HA       ARG  22  26.310   9.463  11.274
  137    HB2  ARG  22           HB2      ARG  22  27.320   7.446  13.286
  138    HB3  ARG  22           HB1      ARG  22  28.336   8.686  12.553
  139    HG2  ARG  22           HG2      ARG  22  26.646  10.397  13.366
  140    HG3  ARG  22           HG1      ARG  22  25.898   9.097  14.296
  141    HD2  ARG  22           HD2      ARG  22  28.815   9.878  14.521
  142    HD3  ARG  22           HD1      ARG  22  27.556  10.441  15.617
  143    HE   ARG  22           HE       ARG  22  28.714   7.778  15.524
  144   HH11  ARG  22          HH11      ARG  22  26.040   9.779  16.532
  145   HH12  ARG  22          HH12      ARG  22  25.552   8.699  17.795
  146   HH21  ARG  22          HH21      ARG  22  28.045   6.379  17.181
  147   HH22  ARG  22          HH22      ARG  22  26.674   6.788  18.158
  148    H    GLY  23           HN       GLY  23  26.366   5.922  11.307
  149    HA2  GLY  23           HA2      GLY  23  27.003   4.439   9.652
  150    HA3  GLY  23           HA1      GLY  23  27.260   5.814   8.582
  151    H    PHE  24           HN       PHE  24  29.120   4.241   8.046
  152    HA   PHE  24           HA       PHE  24  31.517   5.299   9.300
  153    HB2  PHE  24           HB2      PHE  24  32.455   3.081   9.813
  154    HB3  PHE  24           HB1      PHE  24  30.999   3.394  10.756
  155    HD1  PHE  24           HD1      PHE  24  32.505   1.393   8.090
  156    HD2  PHE  24           HD2      PHE  24  28.860   2.301  10.171
  157    HE1  PHE  24           HE1      PHE  24  31.456  -0.642   7.144
  158    HE2  PHE  24           HE2      PHE  24  27.815   0.266   9.227
  159    HZ   PHE  24           HZ       PHE  24  29.110  -1.206   7.714
  160    H    TYR  25           HN       TYR  25  33.496   4.539   8.157
  161    HA   TYR  25           HA       TYR  25  32.995   3.527   5.444
  162    HB2  TYR  25           HB2      TYR  25  34.194   5.325   4.391
  163    HB3  TYR  25           HB1      TYR  25  32.942   6.047   5.401
  164    HD1  TYR  25           HD1      TYR  25  36.549   5.469   5.001
  165    HD2  TYR  25           HD2      TYR  25  33.507   7.192   7.497
  166    HE1  TYR  25           HE1      TYR  25  38.284   6.714   6.247
  167    HE2  TYR  25           HE2      TYR  25  35.245   8.449   8.744
  168    HH   TYR  25           HH       TYR  25  37.909   7.989   9.151
  169    H    PHE  26           HN       PHE  26  35.065   3.018   4.313
  170    HA   PHE  26           HA       PHE  26  37.091   2.109   6.267
  171    HB2  PHE  26           HB2      PHE  26  36.320   0.918   3.589
  172    HB3  PHE  26           HB1      PHE  26  37.614   0.321   4.628
  173    HD1  PHE  26           HD1      PHE  26  34.078   0.260   3.944
  174    HD2  PHE  26           HD2      PHE  26  37.010  -0.404   7.012
  175    HE1  PHE  26           HE1      PHE  26  32.426  -1.064   5.236
  176    HE2  PHE  26           HE2      PHE  26  35.357  -1.724   8.304
  177    HZ   PHE  26           HZ       PHE  26  33.068  -2.058   7.417
  178    H    ASN  27           HN       ASN  27  39.249   2.415   5.827
  179    HA   ASN  27           HA       ASN  27  39.898   4.651   4.153
  180    HB2  ASN  27           HB2      ASN  27  41.593   2.752   5.779
  181    HB3  ASN  27           HB1      ASN  27  42.259   4.102   4.863
  182   HD21  ASN  27          HD21      ASN  27  42.462   3.986   7.723
  183   HD22  ASN  27          HD22      ASN  27  41.516   5.237   8.370
  184    H    LYS  28           HN       LYS  28  41.883   4.464   2.671
  185    HA   LYS  28           HA       LYS  28  41.643   2.027   1.010
  186    HB2  LYS  28           HB2      LYS  28  42.067   4.858   0.032
  187    HB3  LYS  28           HB1      LYS  28  41.902   3.415  -0.967
  188    HG2  LYS  28           HG2      LYS  28  39.769   4.402   0.948
  189    HG3  LYS  28           HG1      LYS  28  39.781   4.747  -0.780
  190    HD2  LYS  28           HD2      LYS  28  39.737   2.321  -1.262
  191    HD3  LYS  28           HD1      LYS  28  39.697   1.983   0.468
  192    HE2  LYS  28           HE2      LYS  28  37.586   3.214   0.675
  193    HE3  LYS  28           HE1      LYS  28  37.615   3.571  -1.051
  194    HZ1  LYS  28           HZ1      LYS  28  36.250   1.588  -0.324
  195    HZ2  LYS  28           HZ2      LYS  28  37.724   0.802  -0.012
  196    HZ3  LYS  28           HZ3      LYS  28  37.351   1.320  -1.586
  197    HA   PRO  29           HA       PRO  29  46.055   2.703   2.352
  198    HB2  PRO  29           HB2      PRO  29  46.488   0.038   2.878
  199    HB3  PRO  29           HB1      PRO  29  45.897   1.199   4.081
  200    HG2  PRO  29           HG2      PRO  29  44.386  -0.782   2.455
  201    HG3  PRO  29           HG1      PRO  29  44.183  -0.327   4.156
  202    HD2  PRO  29           HD2      PRO  29  42.547   0.607   2.213
  203    HD3  PRO  29           HD1      PRO  29  42.965   1.582   3.639
  204    H    THR  30           HN       THR  30  44.384   0.723   0.060
  205    HA   THR  30           HA       THR  30  46.651  -0.366  -1.286
  206    HB   THR  30           HB       THR  30  45.057  -0.907  -3.071
  207    HG1  THR  30           HG1      THR  30  43.720   0.772  -3.224
  208   HG21  THR  30          HG21      THR  30  45.113  -2.298  -1.020
  209   HG22  THR  30          HG22      THR  30  43.503  -2.254  -1.737
  210   HG23  THR  30          HG23      THR  30  43.859  -1.279  -0.313
  211    H    GLY  31           HN       GLY  31  45.321   2.776  -1.154
  212    HA2  GLY  31           HA2      GLY  31  46.818   3.536  -3.586
  213    HA3  GLY  31           HA1      GLY  31  45.297   4.298  -3.127
  214    H    TYR  32           HN       TYR  32  45.618   4.643  -0.420
  215    HA   TYR  32           HA       TYR  32  48.141   6.010   0.049
  216    HB2  TYR  32           HB2      TYR  32  47.130   8.171   0.521
  217    HB3  TYR  32           HB1      TYR  32  46.744   7.695  -1.132
  218    HD1  TYR  32           HD1      TYR  32  45.423   8.190   2.264
  219    HD2  TYR  32           HD2      TYR  32  44.487   6.951  -1.742
  220    HE1  TYR  32           HE1      TYR  32  43.002   8.340   2.782
  221    HE2  TYR  32           HE2      TYR  32  42.068   7.102  -1.223
  222    HH   TYR  32           HH       TYR  32  40.687   8.606   0.679
  223    H    GLY  33           HN       GLY  33  48.327   6.800   2.287
  224    HA2  GLY  33           HA2      GLY  33  47.743   6.796   4.566
  225    HA3  GLY  33           HA1      GLY  33  46.350   5.788   4.186
  226    H    SER  34           HN       SER  34  48.713   4.324   2.517
  227    HA   SER  34           HA       SER  34  49.317   2.479   4.727
  228    HB2  SER  34           HB2      SER  34  49.736   0.820   2.994
  229    HB3  SER  34           HB1      SER  34  48.155   1.551   2.742
  230    HG   SER  34           HG       SER  34  50.567   2.347   1.469
  231    H    SER  35           HN       SER  35  50.706   5.035   3.126
  232    HA   SER  35           HA       SER  35  53.313   4.087   2.584
  233    HB2  SER  35           HB2      SER  35  53.884   6.366   2.306
  234    HB3  SER  35           HB1      SER  35  52.201   6.246   1.796
  235    HG   SER  35           HG       SER  35  51.701   6.848   4.036
  236    H    SER  36           HN       SER  36  51.656   4.849   5.514
  237    HA   SER  36           HA       SER  36  54.103   5.288   7.031
  238    HB2  SER  36           HB2      SER  36  52.135   6.582   7.648
  239    HB3  SER  36           HB1      SER  36  51.197   5.107   7.867
  240    HG   SER  36           HG       SER  36  53.261   6.192   9.426
  241    H    ARG  37           HN       ARG  37  55.284   3.462   7.215
  242    HA   ARG  37           HA       ARG  37  54.210   0.843   7.450
  243    HB2  ARG  37           HB2      ARG  37  56.483   1.259   6.627
  244    HB3  ARG  37           HB1      ARG  37  56.952   1.871   8.215
  245    HG2  ARG  37           HG2      ARG  37  56.448  -0.302   9.231
  246    HG3  ARG  37           HG1      ARG  37  55.904  -0.924   7.672
  247    HD2  ARG  37           HD2      ARG  37  58.146  -0.574   6.736
  248    HD3  ARG  37           HD1      ARG  37  58.697   0.086   8.272
  249    HE   ARG  37           HE       ARG  37  57.635  -2.479   8.738
  250   HH11  ARG  37          HH11      ARG  37  60.291  -0.914   7.118
  251   HH12  ARG  37          HH12      ARG  37  61.362  -2.261   7.307
  252   HH21  ARG  37          HH21      ARG  37  59.053  -4.234   8.976
  253   HH22  ARG  37          HH22      ARG  37  60.666  -4.130   8.352
  254    H    ARG  38           HN       ARG  38  55.329   3.220   9.808
  255    HA   ARG  38           HA       ARG  38  55.242   1.574  12.093
  256    HB2  ARG  38           HB2      ARG  38  54.905   4.560  11.763
  257    HB3  ARG  38           HB1      ARG  38  55.006   3.758  13.331
  258    HG2  ARG  38           HG2      ARG  38  57.212   2.911  12.835
  259    HG3  ARG  38           HG1      ARG  38  57.109   3.480  11.168
  260    HD2  ARG  38           HD2      ARG  38  56.983   5.292  13.589
  261    HD3  ARG  38           HD1      ARG  38  58.450   4.982  12.666
  262    HE   ARG  38           HE       ARG  38  56.514   5.813  10.840
  263   HH11  ARG  38          HH11      ARG  38  58.167   7.045  13.648
  264   HH12  ARG  38          HH12      ARG  38  58.087   8.693  13.124
  265   HH21  ARG  38          HH21      ARG  38  56.418   7.979  10.173
  266   HH22  ARG  38          HH22      ARG  38  57.103   9.219  11.169
  267    H    ALA  39           HN       ALA  39  52.747   3.182  10.278
  268    HA   ALA  39           HA       ALA  39  50.756   2.206  12.236
  269    HB1  ALA  39           HB1      ALA  39  50.568   4.517  12.451
  270    HB2  ALA  39           HB2      ALA  39  49.340   4.146  11.242
  271    HB3  ALA  39           HB3      ALA  39  50.898   4.803  10.742
  272    HA   PRO  40           HA       PRO  40  49.906   0.297   8.105
  273    HB2  PRO  40           HB2      PRO  40  49.668  -2.265   9.005
  274    HB3  PRO  40           HB1      PRO  40  51.226  -1.539   8.573
  275    HG2  PRO  40           HG2      PRO  40  50.038  -2.022  11.249
  276    HG3  PRO  40           HG1      PRO  40  51.729  -2.107  10.725
  277    HD2  PRO  40           HD2      PRO  40  50.618   0.026  12.114
  278    HD3  PRO  40           HD1      PRO  40  52.091   0.120  11.126
  279    H    GLN  41           HN       GLN  41  47.924   1.678   8.735
  280    HA   GLN  41           HA       GLN  41  45.763   0.324  10.085
  281    HB2  GLN  41           HB2      GLN  41  45.847   2.900   8.497
  282    HB3  GLN  41           HB1      GLN  41  44.445   2.322   9.401
  283    HG2  GLN  41           HG2      GLN  41  45.790   2.324  11.476
  284    HG3  GLN  41           HG1      GLN  41  47.175   2.933  10.571
  285   HE21  GLN  41          HE21      GLN  41  47.405   5.133  10.971
  286   HE22  GLN  41          HE22      GLN  41  46.123   6.241  11.079
  287    H    THR  42           HN       THR  42  45.910  -1.584   8.616
  288    HA   THR  42           HA       THR  42  45.247  -1.486   5.887
  289    HB   THR  42           HB       THR  42  44.680  -3.675   7.899
  290    HG1  THR  42           HG1      THR  42  46.853  -3.252   7.790
  291   HG21  THR  42          HG21      THR  42  43.368  -4.090   5.942
  292   HG22  THR  42          HG22      THR  42  44.806  -5.103   5.797
  293   HG23  THR  42          HG23      THR  42  44.688  -3.603   4.876
  294    H    GLY  43           HN       GLY  43  43.190  -1.915   8.743
  295    HA2  GLY  43           HA2      GLY  43  41.018  -0.450   7.789
  296    HA3  GLY  43           HA1      GLY  43  40.734  -2.127   7.336
  297    H    ILE  44           HN       ILE  44  39.079  -0.696   9.115
  298    HA   ILE  44           HA       ILE  44  39.719  -1.251  11.840
  299    HB   ILE  44           HB       ILE  44  37.432  -0.598  12.310
  300   HG12  ILE  44          HG12      ILE  44  37.006  -0.731   9.303
  301   HG13  ILE  44          HG11      ILE  44  36.369  -1.895  10.464
  302   HG21  ILE  44          HG21      ILE  44  37.440   1.607  11.286
  303   HG22  ILE  44          HG22      ILE  44  38.501   1.044   9.996
  304   HG23  ILE  44          HG23      ILE  44  39.104   1.150  11.650
  305   HD11  ILE  44          HD11      ILE  44  35.723   1.061  10.363
  306   HD12  ILE  44          HD12      ILE  44  35.158  -0.055  11.607
  307   HD13  ILE  44          HD13      ILE  44  34.644  -0.266   9.933
  308    H    VAL  45           HN       VAL  45  38.147  -3.015   9.269
  309    HA   VAL  45           HA       VAL  45  36.844  -4.976  10.828
  310    HB   VAL  45           HB       VAL  45  37.890  -5.011   7.999
  311   HG11  VAL  45          HG11      VAL  45  37.886  -7.313   8.701
  312   HG12  VAL  45          HG12      VAL  45  36.394  -7.058   7.795
  313   HG13  VAL  45          HG13      VAL  45  36.356  -7.109   9.556
  314   HG21  VAL  45          HG21      VAL  45  35.055  -4.998   9.068
  315   HG22  VAL  45          HG22      VAL  45  35.580  -4.692   7.413
  316   HG23  VAL  45          HG23      VAL  45  35.940  -3.523   8.683
  317    H    ASP  46           HN       ASP  46  40.033  -4.963   9.267
  318    HA   ASP  46           HA       ASP  46  40.794  -7.544  10.136
  319    HB2  ASP  46           HB2      ASP  46  42.403  -5.134   9.284
  320    HB3  ASP  46           HB1      ASP  46  43.135  -6.690   9.679
  321    H    GLU  47           HN       GLU  47  41.201  -4.321  11.565
  322    HA   GLU  47           HA       GLU  47  42.958  -5.059  13.631
  323    HB2  GLU  47           HB2      GLU  47  42.493  -2.727  13.032
  324    HB3  GLU  47           HB1      GLU  47  40.834  -2.906  13.603
  325    HG2  GLU  47           HG2      GLU  47  41.638  -3.380  15.871
  326    HG3  GLU  47           HG1      GLU  47  43.308  -3.261  15.317
  327    H    CYS  48           HN       CYS  48  39.401  -4.727  13.698
  328    HA   CYS  48           HA       CYS  48  39.139  -5.713  16.374
  329    HB2  CYS  48           HB2      CYS  48  37.121  -5.415  14.139
  330    HB3  CYS  48           HB1      CYS  48  36.731  -5.893  15.788
  331    H    CYS  49           HN       CYS  49  38.823  -7.179  13.162
  332    HA   CYS  49           HA       CYS  49  37.828  -9.676  13.972
  333    HB2  CYS  49           HB2      CYS  49  37.816  -8.926  11.629
  334    HB3  CYS  49           HB1      CYS  49  39.576  -9.023  11.587
  335    H    PHE  50           HN       PHE  50  41.175  -8.601  13.405
  336    HA   PHE  50           HA       PHE  50  42.207 -11.139  14.345
  337    HB2  PHE  50           HB2      PHE  50  43.462  -8.611  13.289
  338    HB3  PHE  50           HB1      PHE  50  44.446  -9.899  13.995
  339    HD1  PHE  50           HD1      PHE  50  41.940  -9.118  11.357
  340    HD2  PHE  50           HD2      PHE  50  44.908 -11.889  12.760
  341    HE1  PHE  50           HE1      PHE  50  41.801 -10.339   9.207
  342    HE2  PHE  50           HE2      PHE  50  44.772 -13.116  10.608
  343    HZ   PHE  50           HZ       PHE  50  43.221 -12.344   8.832
  344    H    ARG  51           HN       ARG  51  43.080  -7.794  15.225
  345    HA   ARG  51           HA       ARG  51  43.804  -8.599  17.903
  346    HB2  ARG  51           HB2      ARG  51  43.668  -5.860  16.622
  347    HB3  ARG  51           HB1      ARG  51  44.355  -6.213  18.207
  348    HG2  ARG  51           HG2      ARG  51  46.065  -7.606  17.248
  349    HG3  ARG  51           HG1      ARG  51  45.301  -7.546  15.658
  350    HD2  ARG  51           HD2      ARG  51  46.403  -5.141  17.132
  351    HD3  ARG  51           HD1      ARG  51  47.252  -6.004  15.854
  352    HE   ARG  51           HE       ARG  51  44.737  -5.280  14.856
  353   HH11  ARG  51          HH11      ARG  51  47.663  -3.790  16.015
  354   HH12  ARG  51          HH12      ARG  51  47.490  -2.386  15.016
  355   HH21  ARG  51          HH21      ARG  51  44.528  -3.432  13.557
  356   HH22  ARG  51          HH22      ARG  51  45.726  -2.183  13.633
  357    H    SER  52           HN       SER  52  42.944  -7.369  19.808
  358    HA   SER  52           HA       SER  52  40.026  -7.372  19.695
  359    HB2  SER  52           HB2      SER  52  41.025  -8.549  21.553
  360    HB3  SER  52           HB1      SER  52  41.988  -7.139  21.986
  361    HG   SER  52           HG       SER  52  39.577  -7.752  22.817
  362    H    CYS  53           HN       CYS  53  38.934  -5.559  19.307
  363    HA   CYS  53           HA       CYS  53  40.192  -2.978  20.018
  364    HB2  CYS  53           HB2      CYS  53  38.941  -1.978  18.213
  365    HB3  CYS  53           HB1      CYS  53  39.765  -3.398  17.576
  366    H    ASP  54           HN       ASP  54  39.149  -1.642  21.379
  367    HA   ASP  54           HA       ASP  54  36.902  -2.617  22.860
  368    HB2  ASP  54           HB2      ASP  54  38.381   0.014  22.861
  369    HB3  ASP  54           HB1      ASP  54  37.015  -0.320  23.927
  370    H    LEU  55           HN       LEU  55  34.839  -1.595  23.073
  371    HA   LEU  55           HA       LEU  55  33.582  -0.999  20.616
  372    HB2  LEU  55           HB2      LEU  55  32.710  -0.582  23.483
  373    HB3  LEU  55           HB1      LEU  55  31.663  -0.271  22.097
  374    HG   LEU  55           HG       LEU  55  33.052  -2.924  22.543
  375   HD11  LEU  55          HD11      LEU  55  31.531  -2.485  24.425
  376   HD12  LEU  55          HD12      LEU  55  30.856  -3.727  23.371
  377   HD13  LEU  55          HD13      LEU  55  30.236  -2.078  23.298
  378   HD21  LEU  55          HD21      LEU  55  31.098  -3.626  21.013
  379   HD22  LEU  55          HD22      LEU  55  32.383  -2.678  20.265
  380   HD23  LEU  55          HD23      LEU  55  30.863  -1.901  20.713
  381    H    ARG  56           HN       ARG  56  34.793   1.067  23.227
  382    HA   ARG  56           HA       ARG  56  33.761   3.517  22.312
  383    HB2  ARG  56           HB2      ARG  56  34.760   3.234  24.539
  384    HB3  ARG  56           HB1      ARG  56  36.342   2.984  23.801
  385    HG2  ARG  56           HG2      ARG  56  36.266   5.234  22.821
  386    HG3  ARG  56           HG1      ARG  56  34.660   5.489  23.506
  387    HD2  ARG  56           HD2      ARG  56  35.553   5.264  25.768
  388    HD3  ARG  56           HD1      ARG  56  37.153   4.913  25.124
  389    HE   ARG  56           HE       ARG  56  36.306   7.392  24.093
  390   HH11  ARG  56          HH11      ARG  56  37.197   5.886  27.104
  391   HH12  ARG  56          HH12      ARG  56  37.798   7.352  27.801
  392   HH21  ARG  56          HH21      ARG  56  37.101   9.302  25.024
  393   HH22  ARG  56          HH22      ARG  56  37.745   9.274  26.631
  394    H    ARG  57           HN       ARG  57  36.881   1.918  21.622
  395    HA   ARG  57           HA       ARG  57  37.905   3.937  19.943
  396    HB2  ARG  57           HB2      ARG  57  39.295   2.144  20.961
  397    HB3  ARG  57           HB1      ARG  57  38.517   0.970  19.902
  398    HG2  ARG  57           HG2      ARG  57  39.359   2.045  17.950
  399    HG3  ARG  57           HG1      ARG  57  39.964   3.403  18.897
  400    HD2  ARG  57           HD2      ARG  57  41.642   2.087  19.928
  401    HD3  ARG  57           HD1      ARG  57  40.885   0.579  19.420
  402    HE   ARG  57           HE       ARG  57  41.452   1.821  17.080
  403   HH11  ARG  57          HH11      ARG  57  43.278   1.018  19.935
  404   HH12  ARG  57          HH12      ARG  57  44.774   0.818  19.084
  405   HH21  ARG  57          HH21      ARG  57  43.454   1.548  15.969
  406   HH22  ARG  57          HH22      ARG  57  44.873   1.114  16.863
  407    H    LEU  58           HN       LEU  58  35.919   1.082  19.342
  408    HA   LEU  58           HA       LEU  58  36.020   1.085  16.549
  409    HB2  LEU  58           HB2      LEU  58  35.046  -0.708  18.058
  410    HB3  LEU  58           HB1      LEU  58  33.598   0.297  18.161
  411    HG   LEU  58           HG       LEU  58  33.721   0.324  15.555
  412   HD11  LEU  58          HD11      LEU  58  36.039  -0.823  15.684
  413   HD12  LEU  58          HD12      LEU  58  34.891  -1.459  14.511
  414   HD13  LEU  58          HD13      LEU  58  35.145  -2.299  16.038
  415   HD21  LEU  58          HD21      LEU  58  31.918  -0.777  16.729
  416   HD22  LEU  58          HD22      LEU  58  32.971  -2.118  17.182
  417   HD23  LEU  58          HD23      LEU  58  32.512  -1.890  15.495
  418    H    ASP  59           HN       ASP  59  34.029   2.907  18.795
  419    HA   ASP  59           HA       ASP  59  32.116   3.916  17.012
  420    HB2  ASP  59           HB2      ASP  59  32.089   4.112  19.526
  421    HB3  ASP  59           HB1      ASP  59  33.277   5.405  19.368
  422    H    MET  60           HN       MET  60  35.407   4.973  17.727
  423    HA   MET  60           HA       MET  60  35.308   7.485  16.464
  424    HB2  MET  60           HB2      MET  60  37.569   5.555  16.946
  425    HB3  MET  60           HB1      MET  60  37.815   7.132  16.193
  426    HG2  MET  60           HG2      MET  60  36.606   8.135  18.204
  427    HG3  MET  60           HG1      MET  60  36.742   6.548  18.961
  428    HE1  MET  60           HE1      MET  60  40.455   5.812  18.947
  429    HE2  MET  60           HE2      MET  60  38.846   5.216  18.546
  430    HE3  MET  60           HE3      MET  60  39.202   5.730  20.191
  431    H    TYR  61           HN       TYR  61  35.274   4.318  15.135
  432    HA   TYR  61           HA       TYR  61  36.351   5.002  12.549
  433    HB2  TYR  61           HB2      TYR  61  34.640   2.653  13.400
  434    HB3  TYR  61           HB1      TYR  61  35.550   2.781  11.899
  435    HD1  TYR  61           HD1      TYR  61  35.908   0.584  13.979
  436    HD2  TYR  61           HD2      TYR  61  37.887   4.360  13.444
  437    HE1  TYR  61           HE1      TYR  61  37.915  -0.301  15.127
  438    HE2  TYR  61           HE2      TYR  61  39.887   3.480  14.584
  439    HH   TYR  61           HH       TYR  61  40.871   1.019  14.920
  440    H    CYS  62           HN       CYS  62  33.407   5.626  14.101
  441    HA   CYS  62           HA       CYS  62  31.628   5.428  11.899
  442    HB2  CYS  62           HB2      CYS  62  31.496   7.191  14.358
  443    HB3  CYS  62           HB1      CYS  62  30.156   6.850  13.265
  444    H    ALA  63           HN       ALA  63  30.887   7.034  10.490
  445    HA   ALA  63           HA       ALA  63  32.805   8.913   9.624
  446    HB1  ALA  63           HB1      ALA  63  29.950   9.179   8.791
  447    HB2  ALA  63           HB2      ALA  63  30.792   7.686   8.374
  448    HB3  ALA  63           HB3      ALA  63  31.417   9.235   7.815
  449    HA   PRO  64           HA       PRO  64  31.660  12.437  12.012
  450    HB2  PRO  64           HB2      PRO  64  32.287  14.470  10.318
  451    HB3  PRO  64           HB1      PRO  64  33.516  13.456  11.100
  452    HG2  PRO  64           HG2      PRO  64  32.466  13.356   8.320
  453    HG3  PRO  64           HG1      PRO  64  34.112  13.092   8.920
  454    HD2  PRO  64           HD2      PRO  64  32.363  11.053   8.244
  455    HD3  PRO  64           HD1      PRO  64  33.725  10.859   9.367
  456    H    LEU  65           HN       LEU  65  30.079  14.074  12.301
  457    HA   LEU  65           HA       LEU  65  27.899  14.026  10.301
  458    HB2  LEU  65           HB2      LEU  65  26.444  14.654  12.300
  459    HB3  LEU  65           HB1      LEU  65  27.074  13.007  12.285
  460    HG   LEU  65           HG       LEU  65  28.880  14.946  13.559
  461   HD11  LEU  65          HD11      LEU  65  26.552  15.785  14.172
  462   HD12  LEU  65          HD12      LEU  65  27.578  15.330  15.533
  463   HD13  LEU  65          HD13      LEU  65  26.305  14.239  14.983
  464   HD21  LEU  65          HD21      LEU  65  27.627  12.402  14.621
  465   HD22  LEU  65          HD22      LEU  65  29.137  13.152  15.138
  466   HD23  LEU  65          HD23      LEU  65  29.024  12.405  13.544
  467    H    LYS  66           HN       LYS  66  30.236  15.808  10.384
  468    HA   LYS  66           HA       LYS  66  29.425  18.336  11.411
  469    HB2  LYS  66           HB2      LYS  66  31.552  17.565   9.403
  470    HB3  LYS  66           HB1      LYS  66  31.319  19.208  10.008
  471    HG2  LYS  66           HG2      LYS  66  31.683  18.441  12.306
  472    HG3  LYS  66           HG1      LYS  66  31.862  16.779  11.738
  473    HD2  LYS  66           HD2      LYS  66  33.821  17.435  10.401
  474    HD3  LYS  66           HD1      LYS  66  33.645  19.103  10.948
  475    HE2  LYS  66           HE2      LYS  66  33.994  18.394  13.275
  476    HE3  LYS  66           HE1      LYS  66  34.136  16.715  12.753
  477    HZ1  LYS  66           HZ1      LYS  66  35.901  18.906  11.808
  478    HZ2  LYS  66           HZ2      LYS  66  36.079  17.242  11.505
  479    HZ3  LYS  66           HZ3      LYS  66  36.293  17.850  13.077
  480    HA   PRO  67           HA       PRO  67  26.797  20.027   8.310
  481    HB2  PRO  67           HB2      PRO  67  28.677  22.335   8.072
  482    HB3  PRO  67           HB1      PRO  67  26.943  22.326   8.451
  483    HG2  PRO  67           HG2      PRO  67  28.737  22.784  10.341
  484    HG3  PRO  67           HG1      PRO  67  27.294  21.810  10.672
  485    HD2  PRO  67           HD2      PRO  67  30.116  20.909  10.233
  486    HD3  PRO  67           HD1      PRO  67  28.885  20.280  11.349
  487    H    ALA  68           HN       ALA  68  26.570  19.940   6.105
  488    HA   ALA  68           HA       ALA  68  28.638  18.834   4.524
  489    HB1  ALA  68           HB1      ALA  68  26.017  18.834   4.228
  490    HB2  ALA  68           HB2      ALA  68  27.074  18.741   2.821
  491    HB3  ALA  68           HB3      ALA  68  26.337  20.279   3.269
  492    H    LYS  69           HN       LYS  69  29.985  19.714   2.999
  493    HA   LYS  69           HA       LYS  69  30.899  22.344   3.400
  494    HB2  LYS  69           HB2      LYS  69  32.315  20.573   2.454
  495    HB3  LYS  69           HB1      LYS  69  31.310  20.531   1.006
  496    HG2  LYS  69           HG2      LYS  69  33.276  21.891   0.551
  497    HG3  LYS  69           HG1      LYS  69  31.866  22.947   0.615
  498    HD2  LYS  69           HD2      LYS  69  32.403  23.623   2.885
  499    HD3  LYS  69           HD1      LYS  69  33.721  22.454   2.961
  500    HE2  LYS  69           HE2      LYS  69  34.889  23.639   1.153
  501    HE3  LYS  69           HE1      LYS  69  33.563  24.796   1.045
  502    HZ1  LYS  69           HZ1      LYS  69  33.996  25.227   3.484
  503    HZ2  LYS  69           HZ2      LYS  69  35.164  25.806   2.394
  504    HZ3  LYS  69           HZ3      LYS  69  35.456  24.387   3.281
  505    H    SER  70           HN       SER  70  28.799  20.948   0.907
  506    HA   SER  70           HA       SER  70  27.627  23.570   0.423
  507    HB2  SER  70           HB2      SER  70  28.037  23.540  -1.976
  508    HB3  SER  70           HB1      SER  70  29.575  23.486  -1.118
  509    HG   SER  70           HG       SER  70  28.799  21.838  -2.933
  510    H    ALA  71           HN       ALA  71  25.726  23.427  -1.008
  511    HA   ALA  71           HA       ALA  71  24.637  20.879  -1.726
  512    HB1  ALA  71           HB1      ALA  71  23.212  22.251   0.553
  513    HB2  ALA  71           HB2      ALA  71  24.393  20.968   0.824
  514    HB3  ALA  71           HB3      ALA  71  22.929  20.638  -0.104
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1  42.015 -16.436  13.226
    2    H2   GLY   1           HT2      GLY   1  43.463 -16.578  14.103
    3    H3   GLY   1           HT3      GLY   1  43.201 -15.230  13.103
    4    HA2  GLY   1           HA2      GLY   1  42.870 -14.562  15.363
    5    HA3  GLY   1           HA1      GLY   1  41.317 -14.572  14.527
    6    H    GLY   2           HN       GLY   2  39.718 -15.534  15.603
    7    HA2  GLY   2           HA2      GLY   2  39.840 -18.110  16.735
    8    HA3  GLY   2           HA1      GLY   2  40.042 -16.926  18.022
    9    HA   PRO   3           HA       PRO   3  35.497 -17.427  17.095
   10    HB2  PRO   3           HB2      PRO   3  34.737 -18.712  19.361
   11    HB3  PRO   3           HB1      PRO   3  35.353 -19.576  17.938
   12    HG2  PRO   3           HG2      PRO   3  36.699 -18.942  20.499
   13    HG3  PRO   3           HG1      PRO   3  36.880 -20.346  19.436
   14    HD2  PRO   3           HD2      PRO   3  38.625 -18.160  19.551
   15    HD3  PRO   3           HD1      PRO   3  38.565 -19.358  18.242
   16    H    GLU   4           HN       GLU   4  33.662 -16.625  18.476
   17    HA   GLU   4           HA       GLU   4  32.680 -14.927  19.669
   18    HB2  GLU   4           HB2      GLU   4  35.151 -15.187  21.402
   19    HB3  GLU   4           HB1      GLU   4  33.643 -14.392  21.852
   20    HG2  GLU   4           HG2      GLU   4  33.864 -17.311  21.069
   21    HG3  GLU   4           HG1      GLU   4  33.826 -16.730  22.733
   22    H    THR   5           HN       THR   5  34.054 -14.140  17.409
   23    HA   THR   5           HA       THR   5  35.123 -11.513  18.241
   24    HB   THR   5           HB       THR   5  36.695 -11.607  16.351
   25    HG1  THR   5           HG1      THR   5  35.520 -13.025  15.038
   26   HG21  THR   5          HG21      THR   5  37.225 -12.548  18.686
   27   HG22  THR   5          HG22      THR   5  38.270 -13.062  17.363
   28   HG23  THR   5          HG23      THR   5  37.010 -14.140  17.959
   29    H    LEU   6           HN       LEU   6  34.937  -9.846  16.546
   30    HA   LEU   6           HA       LEU   6  32.389 -10.165  15.106
   31    HB2  LEU   6           HB2      LEU   6  33.984  -7.656  15.683
   32    HB3  LEU   6           HB1      LEU   6  32.351  -7.732  15.023
   33    HG   LEU   6           HG       LEU   6  33.167  -8.796  17.743
   34   HD11  LEU   6          HD11      LEU   6  32.135  -6.866  18.690
   35   HD12  LEU   6          HD12      LEU   6  31.440  -6.384  17.142
   36   HD13  LEU   6          HD13      LEU   6  33.180  -6.253  17.408
   37   HD21  LEU   6          HD21      LEU   6  30.512  -8.561  16.298
   38   HD22  LEU   6          HD22      LEU   6  30.643  -8.858  18.031
   39   HD23  LEU   6          HD23      LEU   6  31.285 -10.034  16.886
   40    H    CYS   7           HN       CYS   7  32.935 -11.174  13.205
   41    HA   CYS   7           HA       CYS   7  34.710  -9.643  11.408
   42    HB2  CYS   7           HB2      CYS   7  34.562 -12.657  11.649
   43    HB3  CYS   7           HB1      CYS   7  35.516 -11.766  10.465
   44    H    GLY   8           HN       GLY   8  34.157  -9.715   9.191
   45    HA2  GLY   8           HA2      GLY   8  32.709  -9.739   7.401
   46    HA3  GLY   8           HA1      GLY   8  32.094 -11.250   8.061
   47    H    ALA   9           HN       ALA   9  29.969 -11.172   8.252
   48    HA   ALA   9           HA       ALA   9  28.405  -8.839   8.300
   49    HB1  ALA   9           HB1      ALA   9  27.856 -11.715   8.971
   50    HB2  ALA   9           HB2      ALA   9  27.260 -10.757   7.614
   51    HB3  ALA   9           HB3      ALA   9  26.626 -10.481   9.235
   52    H    GLU  10           HN       GLU  10  29.723 -10.825  10.910
   53    HA   GLU  10           HA       GLU  10  28.244  -9.752  13.045
   54    HB2  GLU  10           HB2      GLU  10  31.042 -10.891  12.902
   55    HB3  GLU  10           HB1      GLU  10  30.263 -10.444  14.420
   56    HG2  GLU  10           HG2      GLU  10  28.479 -12.028  14.051
   57    HG3  GLU  10           HG1      GLU  10  29.047 -12.360  12.415
   58    H    LEU  11           HN       LEU  11  31.315  -8.703  11.582
   59    HA   LEU  11           HA       LEU  11  31.769  -6.560  13.388
   60    HB2  LEU  11           HB2      LEU  11  33.571  -7.475  12.005
   61    HB3  LEU  11           HB1      LEU  11  32.740  -6.939  10.545
   62    HG   LEU  11           HG       LEU  11  32.904  -4.594  11.325
   63   HD11  LEU  11          HD11      LEU  11  32.933  -4.818  13.702
   64   HD12  LEU  11          HD12      LEU  11  34.521  -4.192  13.263
   65   HD13  LEU  11          HD13      LEU  11  34.324  -5.900  13.653
   66   HD21  LEU  11          HD21      LEU  11  34.693  -5.659   9.920
   67   HD22  LEU  11          HD22      LEU  11  35.590  -5.990  11.402
   68   HD23  LEU  11          HD23      LEU  11  35.275  -4.323  10.914
   69    H    VAL  12           HN       VAL  12  30.175  -6.771  10.238
   70    HA   VAL  12           HA       VAL  12  29.729  -4.040   9.845
   71    HB   VAL  12           HB       VAL  12  28.274  -6.502   8.899
   72   HG11  VAL  12          HG11      VAL  12  27.145  -4.870   7.281
   73   HG12  VAL  12          HG12      VAL  12  27.677  -3.574   8.353
   74   HG13  VAL  12          HG13      VAL  12  26.554  -4.800   8.941
   75   HG21  VAL  12          HG21      VAL  12  29.282  -5.829   6.760
   76   HG22  VAL  12          HG22      VAL  12  30.521  -6.014   8.002
   77   HG23  VAL  12          HG23      VAL  12  29.977  -4.404   7.529
   78    H    ASP  13           HN       ASP  13  27.732  -6.498  11.453
   79    HA   ASP  13           HA       ASP  13  25.518  -4.856  12.030
   80    HB2  ASP  13           HB2      ASP  13  25.547  -7.342  12.219
   81    HB3  ASP  13           HB1      ASP  13  26.564  -7.189  13.650
   82    H    ALA  14           HN       ALA  14  28.435  -5.609  13.934
   83    HA   ALA  14           HA       ALA  14  27.725  -4.121  16.220
   84    HB1  ALA  14           HB1      ALA  14  29.686  -5.818  15.798
   85    HB2  ALA  14           HB2      ALA  14  29.883  -4.511  16.969
   86    HB3  ALA  14           HB3      ALA  14  30.581  -4.364  15.355
   87    H    LEU  15           HN       LEU  15  29.498  -3.223  13.280
   88    HA   LEU  15           HA       LEU  15  30.204  -0.611  14.096
   89    HB2  LEU  15           HB2      LEU  15  29.795  -1.842  11.364
   90    HB3  LEU  15           HB1      LEU  15  30.383  -0.196  11.603
   91    HG   LEU  15           HG       LEU  15  31.701  -2.596  12.893
   92   HD11  LEU  15          HD11      LEU  15  32.440  -1.185  10.307
   93   HD12  LEU  15          HD12      LEU  15  31.761  -2.808  10.417
   94   HD13  LEU  15          HD13      LEU  15  33.360  -2.475  11.080
   95   HD21  LEU  15          HD21      LEU  15  32.456   0.302  12.422
   96   HD22  LEU  15          HD22      LEU  15  33.628  -0.921  12.913
   97   HD23  LEU  15          HD23      LEU  15  32.275  -0.523  13.970
   98    H    GLN  16           HN       GLN  16  27.385  -1.883  12.357
   99    HA   GLN  16           HA       GLN  16  26.154   0.631  11.884
  100    HB2  GLN  16           HB2      GLN  16  25.027  -2.171  12.054
  101    HB3  GLN  16           HB1      GLN  16  24.071  -0.762  11.594
  102    HG2  GLN  16           HG2      GLN  16  26.636  -1.550  10.194
  103    HG3  GLN  16           HG1      GLN  16  25.040  -2.065   9.649
  104   HE21  GLN  16          HE21      GLN  16  26.718  -0.386   8.021
  105   HE22  GLN  16          HE22      GLN  16  25.976   1.137   7.898
  106    H    PHE  17           HN       PHE  17  25.919  -1.728  14.512
  107    HA   PHE  17           HA       PHE  17  23.825  -0.487  15.941
  108    HB2  PHE  17           HB2      PHE  17  24.391  -2.716  16.522
  109    HB3  PHE  17           HB1      PHE  17  26.083  -2.291  16.793
  110    HD1  PHE  17           HD1      PHE  17  22.620  -1.842  18.096
  111    HD2  PHE  17           HD2      PHE  17  26.826  -1.356  18.860
  112    HE1  PHE  17           HE1      PHE  17  22.131  -1.329  20.474
  113    HE2  PHE  17           HE2      PHE  17  26.332  -0.852  21.237
  114    HZ   PHE  17           HZ       PHE  17  23.988  -0.838  22.045
  115    H    VAL  18           HN       VAL  18  27.359  -0.257  16.365
  116    HA   VAL  18           HA       VAL  18  27.254   1.607  18.491
  117    HB   VAL  18           HB       VAL  18  29.441   1.004  16.494
  118   HG11  VAL  18          HG11      VAL  18  29.914   3.159  17.408
  119   HG12  VAL  18          HG12      VAL  18  30.886   2.016  18.334
  120   HG13  VAL  18          HG13      VAL  18  29.396   2.663  19.021
  121   HG21  VAL  18          HG21      VAL  18  29.137   0.144  19.384
  122   HG22  VAL  18          HG22      VAL  18  30.327  -0.428  18.215
  123   HG23  VAL  18          HG23      VAL  18  28.625  -0.850  18.020
  124    H    CYS  19           HN       CYS  19  27.840   2.060  15.006
  125    HA   CYS  19           HA       CYS  19  28.070   4.899  15.132
  126    HB2  CYS  19           HB2      CYS  19  27.339   3.075  12.824
  127    HB3  CYS  19           HB1      CYS  19  27.767   4.770  12.672
  128    H    GLY  20           HN       GLY  20  25.386   2.705  14.519
  129    HA2  GLY  20           HA2      GLY  20  23.109   3.031  14.501
  130    HA3  GLY  20           HA1      GLY  20  23.415   4.462  15.482
  131    H    ASP  21           HN       ASP  21  22.298   6.071  14.575
  132    HA   ASP  21           HA       ASP  21  21.591   6.309  11.877
  133    HB2  ASP  21           HB2      ASP  21  20.557   7.558  13.800
  134    HB3  ASP  21           HB1      ASP  21  21.980   8.600  13.812
  135    H    ARG  22           HN       ARG  22  24.466   7.362  13.617
  136    HA   ARG  22           HA       ARG  22  25.495   9.121  11.664
  137    HB2  ARG  22           HB2      ARG  22  26.873   7.413  13.741
  138    HB3  ARG  22           HB1      ARG  22  27.710   8.600  12.749
  139    HG2  ARG  22           HG2      ARG  22  26.063  10.327  13.575
  140    HG3  ARG  22           HG1      ARG  22  25.460   9.116  14.707
  141    HD2  ARG  22           HD2      ARG  22  28.346  10.020  14.550
  142    HD3  ARG  22           HD1      ARG  22  27.178  10.626  15.719
  143    HE   ARG  22           HE       ARG  22  28.460   8.019  15.731
  144   HH11  ARG  22          HH11      ARG  22  25.784   9.958  16.860
  145   HH12  ARG  22          HH12      ARG  22  25.500   8.970  18.248
  146   HH21  ARG  22          HH21      ARG  22  28.055   6.745  17.553
  147   HH22  ARG  22          HH22      ARG  22  26.770   7.163  18.637
  148    H    GLY  23           HN       GLY  23  25.781   5.617  12.084
  149    HA2  GLY  23           HA2      GLY  23  26.441   3.964  10.625
  150    HA3  GLY  23           HA1      GLY  23  26.206   5.129   9.326
  151    H    PHE  24           HN       PHE  24  28.145   3.918   8.487
  152    HA   PHE  24           HA       PHE  24  30.524   5.477   9.056
  153    HB2  PHE  24           HB2      PHE  24  31.956   3.527   9.497
  154    HB3  PHE  24           HB1      PHE  24  30.704   3.681  10.730
  155    HD1  PHE  24           HD1      PHE  24  32.045   1.634   8.039
  156    HD2  PHE  24           HD2      PHE  24  28.667   2.234  10.618
  157    HE1  PHE  24           HE1      PHE  24  31.223  -0.637   7.491
  158    HE2  PHE  24           HE2      PHE  24  27.849  -0.039  10.077
  159    HZ   PHE  24           HZ       PHE  24  29.125  -1.475   8.513
  160    H    TYR  25           HN       TYR  25  32.241   5.075   7.482
  161    HA   TYR  25           HA       TYR  25  31.565   3.480   5.145
  162    HB2  TYR  25           HB2      TYR  25  31.616   5.313   3.575
  163    HB3  TYR  25           HB1      TYR  25  30.393   5.666   4.795
  164    HD1  TYR  25           HD1      TYR  25  33.710   6.549   3.488
  165    HD2  TYR  25           HD2      TYR  25  30.774   7.393   6.510
  166    HE1  TYR  25           HE1      TYR  25  34.891   8.656   4.047
  167    HE2  TYR  25           HE2      TYR  25  31.957   9.498   7.068
  168    HH   TYR  25           HH       TYR  25  33.679  11.110   5.497
  169    H    PHE  26           HN       PHE  26  33.340   3.510   3.531
  170    HA   PHE  26           HA       PHE  26  35.938   4.195   4.771
  171    HB2  PHE  26           HB2      PHE  26  35.255   1.728   3.152
  172    HB3  PHE  26           HB1      PHE  26  36.868   2.157   3.720
  173    HD1  PHE  26           HD1      PHE  26  33.546   0.931   4.682
  174    HD2  PHE  26           HD2      PHE  26  37.417   2.114   6.120
  175    HE1  PHE  26           HE1      PHE  26  33.056  -0.125   6.872
  176    HE2  PHE  26           HE2      PHE  26  36.926   1.058   8.311
  177    HZ   PHE  26           HZ       PHE  26  34.744  -0.060   8.686
  178    H    ASN  27           HN       ASN  27  37.499   5.027   3.426
  179    HA   ASN  27           HA       ASN  27  36.553   6.109   0.903
  180    HB2  ASN  27           HB2      ASN  27  38.698   7.312   0.889
  181    HB3  ASN  27           HB1      ASN  27  37.860   7.520   2.426
  182   HD21  ASN  27          HD21      ASN  27  40.347   8.031   2.935
  183   HD22  ASN  27          HD22      ASN  27  41.242   6.706   3.506
  184    H    LYS  28           HN       LYS  28  38.384   6.141  -0.879
  185    HA   LYS  28           HA       LYS  28  39.531   3.444  -1.173
  186    HB2  LYS  28           HB2      LYS  28  38.787   3.548  -3.610
  187    HB3  LYS  28           HB1      LYS  28  37.522   3.248  -2.419
  188    HG2  LYS  28           HG2      LYS  28  36.902   5.623  -2.446
  189    HG3  LYS  28           HG1      LYS  28  38.192   5.962  -3.597
  190    HD2  LYS  28           HD2      LYS  28  37.138   4.448  -5.232
  191    HD3  LYS  28           HD1      LYS  28  35.846   4.105  -4.081
  192    HE2  LYS  28           HE2      LYS  28  35.217   6.489  -4.065
  193    HE3  LYS  28           HE1      LYS  28  36.513   6.840  -5.209
  194    HZ1  LYS  28           HZ1      LYS  28  34.730   6.577  -6.599
  195    HZ2  LYS  28           HZ2      LYS  28  33.999   5.381  -5.636
  196    HZ3  LYS  28           HZ3      LYS  28  35.350   4.999  -6.592
  197    HA   PRO  29           HA       PRO  29  42.467   6.884  -2.304
  198    HB2  PRO  29           HB2      PRO  29  44.550   5.928  -0.803
  199    HB3  PRO  29           HB1      PRO  29  43.322   7.044  -0.177
  200    HG2  PRO  29           HG2      PRO  29  43.560   4.096   0.163
  201    HG3  PRO  29           HG1      PRO  29  43.059   5.334   1.330
  202    HD2  PRO  29           HD2      PRO  29  41.280   3.730   0.012
  203    HD3  PRO  29           HD1      PRO  29  40.879   5.371   0.555
  204    H    THR  30           HN       THR  30  42.604   3.404  -2.282
  205    HA   THR  30           HA       THR  30  44.448   3.488  -4.589
  206    HB   THR  30           HB       THR  30  45.437   1.373  -3.806
  207    HG1  THR  30           HG1      THR  30  43.932   0.443  -2.568
  208   HG21  THR  30          HG21      THR  30  46.791   2.313  -2.074
  209   HG22  THR  30          HG22      THR  30  45.502   3.410  -1.573
  210   HG23  THR  30          HG23      THR  30  46.321   3.660  -3.115
  211    H    GLY  31           HN       GLY  31  44.213   1.686  -6.080
  212    HA2  GLY  31           HA2      GLY  31  41.463   0.594  -6.067
  213    HA3  GLY  31           HA1      GLY  31  42.362   0.998  -7.527
  214    H    TYR  32           HN       TYR  32  44.455  -0.341  -5.273
  215    HA   TYR  32           HA       TYR  32  44.911  -2.654  -6.819
  216    HB2  TYR  32           HB2      TYR  32  45.812  -1.810  -4.070
  217    HB3  TYR  32           HB1      TYR  32  46.308  -3.341  -4.792
  218    HD1  TYR  32           HD1      TYR  32  46.481   0.343  -5.094
  219    HD2  TYR  32           HD2      TYR  32  47.840  -3.418  -6.662
  220    HE1  TYR  32           HE1      TYR  32  48.230   1.520  -6.400
  221    HE2  TYR  32           HE2      TYR  32  49.589  -2.240  -7.969
  222    HH   TYR  32           HH       TYR  32  49.580   1.100  -8.462
  223    H    GLY  33           HN       GLY  33  43.070  -2.046  -3.887
  224    HA2  GLY  33           HA2      GLY  33  41.189  -3.279  -3.184
  225    HA3  GLY  33           HA1      GLY  33  41.689  -4.603  -4.232
  226    H    SER  34           HN       SER  34  44.500  -3.884  -2.850
  227    HA   SER  34           HA       SER  34  44.119  -4.956  -0.199
  228    HB2  SER  34           HB2      SER  34  45.603  -6.950  -0.660
  229    HB3  SER  34           HB1      SER  34  43.987  -7.047  -1.354
  230    HG   SER  34           HG       SER  34  46.163  -7.368  -2.647
  231    H    SER  35           HN       SER  35  46.867  -5.378  -2.380
  232    HA   SER  35           HA       SER  35  49.056  -4.692  -2.183
  233    HB2  SER  35           HB2      SER  35  47.897  -2.649  -3.066
  234    HB3  SER  35           HB1      SER  35  47.760  -2.068  -1.410
  235    HG   SER  35           HG       SER  35  49.632  -1.243  -2.339
  236    H    SER  36           HN       SER  36  47.861  -5.856   0.197
  237    HA   SER  36           HA       SER  36  48.526  -4.415   2.527
  238    HB2  SER  36           HB2      SER  36  48.387  -6.579   3.673
  239    HB3  SER  36           HB1      SER  36  47.048  -6.379   2.549
  240    HG   SER  36           HG       SER  36  47.943  -8.406   2.246
  241    H    ARG  37           HN       ARG  37  50.375  -6.508   0.439
  242    HA   ARG  37           HA       ARG  37  52.628  -6.889   2.083
  243    HB2  ARG  37           HB2      ARG  37  52.251  -8.188   0.031
  244    HB3  ARG  37           HB1      ARG  37  52.496  -6.734  -0.938
  245    HG2  ARG  37           HG2      ARG  37  54.784  -6.529  -0.161
  246    HG3  ARG  37           HG1      ARG  37  54.561  -7.864   0.971
  247    HD2  ARG  37           HD2      ARG  37  54.235  -8.144  -2.024
  248    HD3  ARG  37           HD1      ARG  37  55.740  -8.490  -1.177
  249    HE   ARG  37           HE       ARG  37  53.702  -9.942   0.086
  250   HH11  ARG  37          HH11      ARG  37  55.301  -9.766  -3.008
  251   HH12  ARG  37          HH12      ARG  37  55.067 -11.441  -3.361
  252   HH21  ARG  37          HH21      ARG  37  53.415 -12.136  -0.401
  253   HH22  ARG  37          HH22      ARG  37  54.006 -12.776  -1.897
  254    H    ARG  38           HN       ARG  38  51.896  -4.385  -0.330
  255    HA   ARG  38           HA       ARG  38  54.344  -2.992  -0.122
  256    HB2  ARG  38           HB2      ARG  38  52.745  -2.660  -1.972
  257    HB3  ARG  38           HB1      ARG  38  51.610  -1.915  -0.845
  258    HG2  ARG  38           HG2      ARG  38  53.248  -0.157  -0.332
  259    HG3  ARG  38           HG1      ARG  38  54.406  -0.903  -1.433
  260    HD2  ARG  38           HD2      ARG  38  52.844  -0.566  -3.307
  261    HD3  ARG  38           HD1      ARG  38  51.683   0.178  -2.211
  262    HE   ARG  38           HE       ARG  38  54.086   1.394  -3.276
  263   HH11  ARG  38          HH11      ARG  38  51.712   1.418  -0.717
  264   HH12  ARG  38          HH12      ARG  38  51.979   3.080  -0.324
  265   HH21  ARG  38          HH21      ARG  38  54.414   3.563  -2.733
  266   HH22  ARG  38          HH22      ARG  38  53.497   4.286  -1.454
  267    H    ALA  39           HN       ALA  39  51.238  -2.579   1.545
  268    HA   ALA  39           HA       ALA  39  52.637  -0.962   3.588
  269    HB1  ALA  39           HB1      ALA  39  51.367   0.662   2.458
  270    HB2  ALA  39           HB2      ALA  39  50.360   0.221   3.837
  271    HB3  ALA  39           HB3      ALA  39  50.000  -0.429   2.237
  272    HA   PRO  40           HA       PRO  40  50.423  -4.542   5.521
  273    HB2  PRO  40           HB2      PRO  40  52.503  -5.372   7.078
  274    HB3  PRO  40           HB1      PRO  40  52.295  -5.878   5.392
  275    HG2  PRO  40           HG2      PRO  40  54.116  -3.835   6.544
  276    HG3  PRO  40           HG1      PRO  40  54.385  -4.971   5.211
  277    HD2  PRO  40           HD2      PRO  40  53.769  -2.296   4.866
  278    HD3  PRO  40           HD1      PRO  40  53.465  -3.555   3.654
  279    H    GLN  41           HN       GLN  41  49.559  -2.246   6.318
  280    HA   GLN  41           HA       GLN  41  50.350  -1.845   9.129
  281    HB2  GLN  41           HB2      GLN  41  48.773  -0.044   7.274
  282    HB3  GLN  41           HB1      GLN  41  49.189   0.325   8.949
  283    HG2  GLN  41           HG2      GLN  41  51.174  -0.201   6.715
  284    HG3  GLN  41           HG1      GLN  41  50.787   1.381   7.390
  285   HE21  GLN  41          HE21      GLN  41  53.140  -0.914   7.549
  286   HE22  GLN  41          HE22      GLN  41  53.657  -0.697   9.150
  287    H    THR  42           HN       THR  42  48.424  -3.879   7.779
  288    HA   THR  42           HA       THR  42  46.494  -4.958   8.390
  289    HB   THR  42           HB       THR  42  45.965  -3.359  10.801
  290    HG1  THR  42           HG1      THR  42  47.840  -3.904  11.823
  291   HG21  THR  42          HG21      THR  42  46.687  -6.276  10.484
  292   HG22  THR  42          HG22      THR  42  45.066  -5.655  10.169
  293   HG23  THR  42          HG23      THR  42  45.762  -5.529  11.786
  294    H    GLY  43           HN       GLY  43  44.206  -3.954   9.734
  295    HA2  GLY  43           HA2      GLY  43  43.390  -1.502   8.418
  296    HA3  GLY  43           HA1      GLY  43  42.601  -2.962   7.825
  297    H    ILE  44           HN       ILE  44  41.051  -1.031   8.953
  298    HA   ILE  44           HA       ILE  44  40.629  -1.205  11.723
  299    HB   ILE  44           HB       ILE  44  38.788  -0.495   9.440
  300   HG12  ILE  44          HG12      ILE  44  40.050   1.252  11.566
  301   HG13  ILE  44          HG11      ILE  44  40.795   0.963   9.994
  302   HG21  ILE  44          HG21      ILE  44  38.336  -0.491  12.417
  303   HG22  ILE  44          HG22      ILE  44  37.335  -1.214  11.164
  304   HG23  ILE  44          HG23      ILE  44  37.409   0.538  11.326
  305   HD11  ILE  44          HD11      ILE  44  37.965   1.997  10.285
  306   HD12  ILE  44          HD12      ILE  44  38.969   1.984   8.835
  307   HD13  ILE  44          HD13      ILE  44  39.361   3.069  10.168
  308    H    VAL  45           HN       VAL  45  39.122  -2.960   9.017
  309    HA   VAL  45           HA       VAL  45  37.339  -4.503  10.568
  310    HB   VAL  45           HB       VAL  45  38.597  -4.975   7.864
  311   HG11  VAL  45          HG11      VAL  45  38.084  -7.164   8.704
  312   HG12  VAL  45          HG12      VAL  45  36.736  -6.709   7.659
  313   HG13  VAL  45          HG13      VAL  45  36.567  -6.607   9.409
  314   HG21  VAL  45          HG21      VAL  45  36.212  -4.487   7.170
  315   HG22  VAL  45          HG22      VAL  45  37.036  -3.123   7.926
  316   HG23  VAL  45          HG23      VAL  45  35.874  -4.074   8.851
  317    H    ASP  46           HN       ASP  46  40.608  -5.179   9.374
  318    HA   ASP  46           HA       ASP  46  40.808  -7.783  10.444
  319    HB2  ASP  46           HB2      ASP  46  42.899  -5.741   9.702
  320    HB3  ASP  46           HB1      ASP  46  43.298  -7.360  10.271
  321    H    GLU  47           HN       GLU  47  41.530  -4.591  11.814
  322    HA   GLU  47           HA       GLU  47  42.925  -5.457  14.093
  323    HB2  GLU  47           HB2      GLU  47  42.794  -3.110  13.361
  324    HB3  GLU  47           HB1      GLU  47  41.081  -3.083  13.774
  325    HG2  GLU  47           HG2      GLU  47  41.594  -3.521  16.114
  326    HG3  GLU  47           HG1      GLU  47  43.311  -3.668  15.739
  327    H    CYS  48           HN       CYS  48  39.434  -4.681  13.754
  328    HA   CYS  48           HA       CYS  48  38.782  -5.594  16.395
  329    HB2  CYS  48           HB2      CYS  48  37.036  -5.051  13.990
  330    HB3  CYS  48           HB1      CYS  48  36.436  -5.471  15.582
  331    H    CYS  49           HN       CYS  49  38.615  -7.029  13.172
  332    HA   CYS  49           HA       CYS  49  37.206  -9.358  13.837
  333    HB2  CYS  49           HB2      CYS  49  37.571  -8.643  11.514
  334    HB3  CYS  49           HB1      CYS  49  39.297  -8.957  11.685
  335    H    PHE  50           HN       PHE  50  40.711  -8.764  13.699
  336    HA   PHE  50           HA       PHE  50  41.238 -11.416  14.750
  337    HB2  PHE  50           HB2      PHE  50  42.961  -9.133  13.811
  338    HB3  PHE  50           HB1      PHE  50  43.663 -10.540  14.623
  339    HD1  PHE  50           HD1      PHE  50  41.622  -9.413  11.736
  340    HD2  PHE  50           HD2      PHE  50  43.899 -12.625  13.452
  341    HE1  PHE  50           HE1      PHE  50  41.511 -10.632   9.582
  342    HE2  PHE  50           HE2      PHE  50  43.791 -13.851  11.299
  343    HZ   PHE  50           HZ       PHE  50  42.598 -12.855   9.363
  344    H    ARG  51           HN       ARG  51  42.433  -8.183  15.681
  345    HA   ARG  51           HA       ARG  51  42.826  -8.997  18.422
  346    HB2  ARG  51           HB2      ARG  51  43.115  -6.329  17.023
  347    HB3  ARG  51           HB1      ARG  51  43.474  -6.584  18.731
  348    HG2  ARG  51           HG2      ARG  51  45.058  -8.425  18.033
  349    HG3  ARG  51           HG1      ARG  51  44.809  -7.917  16.360
  350    HD2  ARG  51           HD2      ARG  51  45.807  -6.113  18.581
  351    HD3  ARG  51           HD1      ARG  51  46.838  -6.882  17.376
  352    HE   ARG  51           HE       ARG  51  45.087  -4.606  16.966
  353   HH11  ARG  51          HH11      ARG  51  46.803  -7.257  15.478
  354   HH12  ARG  51          HH12      ARG  51  46.881  -6.494  13.932
  355   HH21  ARG  51          HH21      ARG  51  45.202  -3.638  14.927
  356   HH22  ARG  51          HH22      ARG  51  45.981  -4.462  13.618
  357    H    SER  52           HN       SER  52  41.861  -7.859  20.253
  358    HA   SER  52           HA       SER  52  39.003  -7.459  19.811
  359    HB2  SER  52           HB2      SER  52  39.699  -8.884  21.672
  360    HB3  SER  52           HB1      SER  52  40.649  -7.567  22.350
  361    HG   SER  52           HG       SER  52  37.924  -8.010  22.374
  362    H    CYS  53           HN       CYS  53  38.945  -5.434  18.780
  363    HA   CYS  53           HA       CYS  53  40.245  -3.135  19.917
  364    HB2  CYS  53           HB2      CYS  53  39.081  -1.881  18.185
  365    HB3  CYS  53           HB1      CYS  53  39.752  -3.350  17.487
  366    H    ASP  54           HN       ASP  54  39.345  -1.469  21.108
  367    HA   ASP  54           HA       ASP  54  37.268  -2.139  22.909
  368    HB2  ASP  54           HB2      ASP  54  38.620   0.475  22.240
  369    HB3  ASP  54           HB1      ASP  54  37.396   0.328  23.500
  370    H    LEU  55           HN       LEU  55  35.126  -1.718  22.922
  371    HA   LEU  55           HA       LEU  55  33.772  -1.215  20.497
  372    HB2  LEU  55           HB2      LEU  55  32.845  -1.156  23.373
  373    HB3  LEU  55           HB1      LEU  55  31.755  -0.976  21.998
  374    HG   LEU  55           HG       LEU  55  33.636  -3.328  22.321
  375   HD11  LEU  55          HD11      LEU  55  31.921  -3.132  24.174
  376   HD12  LEU  55          HD12      LEU  55  31.786  -4.595  23.199
  377   HD13  LEU  55          HD13      LEU  55  30.671  -3.255  22.936
  378   HD21  LEU  55          HD21      LEU  55  31.316  -2.654  20.496
  379   HD22  LEU  55          HD22      LEU  55  31.876  -4.312  20.714
  380   HD23  LEU  55          HD23      LEU  55  32.963  -3.096  20.045
  381    H    ARG  56           HN       ARG  56  34.547   0.859  23.264
  382    HA   ARG  56           HA       ARG  56  33.080   3.121  22.443
  383    HB2  ARG  56           HB2      ARG  56  34.015   2.870  24.706
  384    HB3  ARG  56           HB1      ARG  56  35.646   3.007  24.045
  385    HG2  ARG  56           HG2      ARG  56  35.236   5.260  23.301
  386    HG3  ARG  56           HG1      ARG  56  33.520   5.131  23.686
  387    HD2  ARG  56           HD2      ARG  56  34.684   6.371  25.450
  388    HD3  ARG  56           HD1      ARG  56  34.086   4.837  26.076
  389    HE   ARG  56           HE       ARG  56  36.754   4.540  25.144
  390   HH11  ARG  56          HH11      ARG  56  34.864   5.934  27.723
  391   HH12  ARG  56          HH12      ARG  56  36.138   5.812  28.885
  392   HH21  ARG  56          HH21      ARG  56  38.402   4.388  26.689
  393   HH22  ARG  56          HH22      ARG  56  38.127   4.944  28.307
  394    H    ARG  57           HN       ARG  57  36.485   2.217  21.865
  395    HA   ARG  57           HA       ARG  57  37.158   4.497  20.348
  396    HB2  ARG  57           HB2      ARG  57  38.653   2.643  21.408
  397    HB3  ARG  57           HB1      ARG  57  38.417   1.831  19.858
  398    HG2  ARG  57           HG2      ARG  57  39.222   3.830  18.675
  399    HG3  ARG  57           HG1      ARG  57  39.450   4.655  20.221
  400    HD2  ARG  57           HD2      ARG  57  41.586   3.752  19.553
  401    HD3  ARG  57           HD1      ARG  57  40.980   2.792  20.903
  402    HE   ARG  57           HE       ARG  57  40.709   0.990  19.462
  403   HH11  ARG  57          HH11      ARG  57  41.315   3.901  17.636
  404   HH12  ARG  57          HH12      ARG  57  41.551   3.057  16.146
  405   HH21  ARG  57          HH21      ARG  57  41.054  -0.082  17.504
  406   HH22  ARG  57          HH22      ARG  57  41.401   0.822  16.068
  407    H    LEU  58           HN       LEU  58  35.348   1.645  19.611
  408    HA   LEU  58           HA       LEU  58  35.696   1.404  16.858
  409    HB2  LEU  58           HB2      LEU  58  34.254   0.016  18.574
  410    HB3  LEU  58           HB1      LEU  58  32.964   1.100  18.051
  411    HG   LEU  58           HG       LEU  58  33.728   0.504  15.643
  412   HD11  LEU  58          HD11      LEU  58  35.832  -0.646  16.585
  413   HD12  LEU  58          HD12      LEU  58  34.938  -1.524  15.346
  414   HD13  LEU  58          HD13      LEU  58  34.764  -1.970  17.043
  415   HD21  LEU  58          HD21      LEU  58  32.325  -1.412  17.522
  416   HD22  LEU  58          HD22      LEU  58  32.402  -1.684  15.781
  417   HD23  LEU  58          HD23      LEU  58  31.592  -0.250  16.414
  418    H    ASP  59           HN       ASP  59  34.053   3.859  18.694
  419    HA   ASP  59           HA       ASP  59  32.304   4.853  16.711
  420    HB2  ASP  59           HB2      ASP  59  32.281   6.915  18.035
  421    HB3  ASP  59           HB1      ASP  59  32.173   5.504  19.085
  422    H    MET  60           HN       MET  60  35.701   4.856  16.842
  423    HA   MET  60           HA       MET  60  36.334   7.290  15.574
  424    HB2  MET  60           HB2      MET  60  37.721   4.611  15.666
  425    HB3  MET  60           HB1      MET  60  38.414   6.017  14.864
  426    HG2  MET  60           HG2      MET  60  37.487   6.055  17.747
  427    HG3  MET  60           HG1      MET  60  39.146   5.682  17.278
  428    HE1  MET  60           HE1      MET  60  40.990   7.770  16.696
  429    HE2  MET  60           HE2      MET  60  40.329   8.689  15.348
  430    HE3  MET  60           HE3      MET  60  40.174   6.935  15.369
  431    H    TYR  61           HN       TYR  61  35.423   4.115  14.334
  432    HA   TYR  61           HA       TYR  61  35.866   4.836  11.576
  433    HB2  TYR  61           HB2      TYR  61  34.152   2.534  12.466
  434    HB3  TYR  61           HB1      TYR  61  35.193   2.660  11.052
  435    HD1  TYR  61           HD1      TYR  61  35.007   0.772  13.776
  436    HD2  TYR  61           HD2      TYR  61  37.704   3.683  12.131
  437    HE1  TYR  61           HE1      TYR  61  36.880  -0.236  15.051
  438    HE2  TYR  61           HE2      TYR  61  39.574   2.677  13.411
  439    HH   TYR  61           HH       TYR  61  39.030   0.241  15.848
  440    H    CYS  62           HN       CYS  62  33.317   5.259  13.849
  441    HA   CYS  62           HA       CYS  62  31.119   5.315  12.045
  442    HB2  CYS  62           HB2      CYS  62  31.525   6.631  14.741
  443    HB3  CYS  62           HB1      CYS  62  29.991   6.601  13.879
  444    H    ALA  63           HN       ALA  63  29.925   7.226  11.382
  445    HA   ALA  63           HA       ALA  63  31.575   9.105  10.080
  446    HB1  ALA  63           HB1      ALA  63  29.041   8.242   9.699
  447    HB2  ALA  63           HB2      ALA  63  29.665   9.736   9.001
  448    HB3  ALA  63           HB3      ALA  63  28.716   9.786  10.486
  449    HA   PRO  64           HA       PRO  64  32.223  12.493  12.782
  450    HB2  PRO  64           HB2      PRO  64  30.473  14.158  11.014
  451    HB3  PRO  64           HB1      PRO  64  32.128  14.465  11.573
  452    HG2  PRO  64           HG2      PRO  64  31.647  13.664   9.088
  453    HG3  PRO  64           HG1      PRO  64  33.068  13.096   9.985
  454    HD2  PRO  64           HD2      PRO  64  30.557  11.610   9.314
  455    HD3  PRO  64           HD1      PRO  64  32.214  11.009   9.526
  456    H    LEU  65           HN       LEU  65  31.282  13.286  14.620
  457    HA   LEU  65           HA       LEU  65  28.613  12.501  15.270
  458    HB2  LEU  65           HB2      LEU  65  30.454  14.397  16.751
  459    HB3  LEU  65           HB1      LEU  65  29.051  13.561  17.419
  460    HG   LEU  65           HG       LEU  65  31.539  12.224  16.309
  461   HD11  LEU  65          HD11      LEU  65  32.051  13.228  18.430
  462   HD12  LEU  65          HD12      LEU  65  31.787  11.509  18.721
  463   HD13  LEU  65          HD13      LEU  65  30.527  12.674  19.124
  464   HD21  LEU  65          HD21      LEU  65  30.430  10.201  17.462
  465   HD22  LEU  65          HD22      LEU  65  29.735  10.735  15.935
  466   HD23  LEU  65          HD23      LEU  65  28.951  11.163  17.456
  467    H    LYS  66           HN       LYS  66  26.777  13.743  15.522
  468    HA   LYS  66           HA       LYS  66  26.926  16.547  14.588
  469    HB2  LYS  66           HB2      LYS  66  24.802  14.489  13.940
  470    HB3  LYS  66           HB1      LYS  66  24.789  16.180  13.433
  471    HG2  LYS  66           HG2      LYS  66  26.693  15.895  12.044
  472    HG3  LYS  66           HG1      LYS  66  27.096  14.341  12.774
  473    HD2  LYS  66           HD2      LYS  66  25.039  13.365  11.872
  474    HD3  LYS  66           HD1      LYS  66  24.622  14.914  11.132
  475    HE2  LYS  66           HE2      LYS  66  26.637  14.834   9.746
  476    HE3  LYS  66           HE1      LYS  66  27.146  13.341  10.534
  477    HZ1  LYS  66           HZ1      LYS  66  25.999  13.075   8.339
  478    HZ2  LYS  66           HZ2      LYS  66  24.570  13.603   9.093
  479    HZ3  LYS  66           HZ3      LYS  66  25.332  12.178   9.617
  480    HA   PRO  67           HA       PRO  67  24.987  16.231  18.845
  481    HB2  PRO  67           HB2      PRO  67  26.266  18.923  18.944
  482    HB3  PRO  67           HB1      PRO  67  26.282  17.621  20.150
  483    HG2  PRO  67           HG2      PRO  67  28.430  18.141  18.699
  484    HG3  PRO  67           HG1      PRO  67  27.972  16.470  19.079
  485    HD2  PRO  67           HD2      PRO  67  27.614  17.983  16.505
  486    HD3  PRO  67           HD1      PRO  67  28.075  16.284  16.760
  487    H    ALA  68           HN       ALA  68  23.050  17.159  19.455
  488    HA   ALA  68           HA       ALA  68  21.537  18.566  17.510
  489    HB1  ALA  68           HB1      ALA  68  20.796  17.052  19.534
  490    HB2  ALA  68           HB2      ALA  68  19.759  18.365  18.977
  491    HB3  ALA  68           HB3      ALA  68  20.773  18.586  20.402
  492    H    LYS  69           HN       LYS  69  20.949  20.697  17.354
  493    HA   LYS  69           HA       LYS  69  22.751  22.665  18.265
  494    HB2  LYS  69           HB2      LYS  69  19.963  22.852  17.115
  495    HB3  LYS  69           HB1      LYS  69  20.942  24.270  17.495
  496    HG2  LYS  69           HG2      LYS  69  22.676  23.562  15.961
  497    HG3  LYS  69           HG1      LYS  69  21.862  22.022  15.682
  498    HD2  LYS  69           HD2      LYS  69  21.352  23.470  13.815
  499    HD3  LYS  69           HD1      LYS  69  19.891  23.317  14.790
  500    HE2  LYS  69           HE2      LYS  69  20.355  25.462  15.876
  501    HE3  LYS  69           HE1      LYS  69  21.867  25.609  14.981
  502    HZ1  LYS  69           HZ1      LYS  69  19.801  26.795  14.084
  503    HZ2  LYS  69           HZ2      LYS  69  19.302  25.254  13.570
  504    HZ3  LYS  69           HZ3      LYS  69  20.754  25.915  12.990
  505    H    SER  70           HN       SER  70  19.610  21.585  19.467
  506    HA   SER  70           HA       SER  70  19.239  23.595  21.417
  507    HB2  SER  70           HB2      SER  70  17.623  22.064  22.415
  508    HB3  SER  70           HB1      SER  70  17.455  22.052  20.662
  509    HG   SER  70           HG       SER  70  17.702  19.974  20.910
  510    H    ALA  71           HN       ALA  71  21.292  20.806  21.312
  511    HA   ALA  71           HA       ALA  71  21.649  20.377  24.085
  512    HB1  ALA  71           HB1      ALA  71  22.398  18.941  22.042
  513    HB2  ALA  71           HB2      ALA  71  23.412  18.968  23.486
  514    HB3  ALA  71           HB3      ALA  71  23.846  19.948  22.084
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1  38.984 -14.310  16.147
    2    H2   GLY   1           HT2      GLY   1  37.848 -13.088  15.821
    3    H3   GLY   1           HT3      GLY   1  39.023 -13.490  14.662
    4    HA2  GLY   1           HA2      GLY   1  36.757 -14.383  14.191
    5    HA3  GLY   1           HA1      GLY   1  38.047 -15.586  14.236
    6    H    GLY   2           HN       GLY   2  35.572 -14.037  16.263
    7    HA2  GLY   2           HA2      GLY   2  34.503 -16.428  17.259
    8    HA3  GLY   2           HA1      GLY   2  35.695 -15.854  18.420
    9    HA   PRO   3           HA       PRO   3  31.457 -13.843  19.049
   10    HB2  PRO   3           HB2      PRO   3  31.860 -14.949  21.770
   11    HB3  PRO   3           HB1      PRO   3  30.408 -14.964  20.750
   12    HG2  PRO   3           HG2      PRO   3  31.835 -17.171  21.138
   13    HG3  PRO   3           HG1      PRO   3  31.092 -16.817  19.568
   14    HD2  PRO   3           HD2      PRO   3  33.966 -16.519  20.403
   15    HD3  PRO   3           HD1      PRO   3  33.295 -17.099  18.860
   16    H    GLU   4           HN       GLU   4  34.506 -13.855  20.543
   17    HA   GLU   4           HA       GLU   4  34.017 -11.409  22.055
   18    HB2  GLU   4           HB2      GLU   4  36.537 -13.069  21.793
   19    HB3  GLU   4           HB1      GLU   4  36.314 -11.699  22.882
   20    HG2  GLU   4           HG2      GLU   4  34.605 -14.200  22.917
   21    HG3  GLU   4           HG1      GLU   4  35.962 -13.908  24.003
   22    H    THR   5           HN       THR   5  34.654 -12.073  18.921
   23    HA   THR   5           HA       THR   5  36.092  -9.526  18.554
   24    HB   THR   5           HB       THR   5  37.297 -10.525  16.662
   25    HG1  THR   5           HG1      THR   5  36.282 -12.200  15.887
   26   HG21  THR   5          HG21      THR   5  38.770 -12.019  17.962
   27   HG22  THR   5          HG22      THR   5  37.538 -12.135  19.219
   28   HG23  THR   5          HG23      THR   5  38.327 -10.591  18.897
   29    H    LEU   6           HN       LEU   6  35.695  -8.517  16.461
   30    HA   LEU   6           HA       LEU   6  33.021  -9.213  15.403
   31    HB2  LEU   6           HB2      LEU   6  34.428  -6.529  15.416
   32    HB3  LEU   6           HB1      LEU   6  32.805  -6.848  14.806
   33    HG   LEU   6           HG       LEU   6  33.678  -7.335  17.667
   34   HD11  LEU   6          HD11      LEU   6  32.102  -5.349  18.072
   35   HD12  LEU   6          HD12      LEU   6  32.239  -5.026  16.344
   36   HD13  LEU   6          HD13      LEU   6  33.674  -4.969  17.367
   37   HD21  LEU   6          HD21      LEU   6  31.851  -8.779  17.102
   38   HD22  LEU   6          HD22      LEU   6  31.033  -7.504  16.199
   39   HD23  LEU   6          HD23      LEU   6  31.137  -7.412  17.957
   40    H    CYS   7           HN       CYS   7  33.095 -10.127  13.460
   41    HA   CYS   7           HA       CYS   7  34.838  -9.022  11.395
   42    HB2  CYS   7           HB2      CYS   7  35.993 -10.971  12.692
   43    HB3  CYS   7           HB1      CYS   7  34.868 -11.995  11.804
   44    H    GLY   8           HN       GLY   8  34.163  -9.526   9.281
   45    HA2  GLY   8           HA2      GLY   8  32.633  -9.974   7.622
   46    HA3  GLY   8           HA1      GLY   8  32.147 -11.361   8.592
   47    H    ALA   9           HN       ALA   9  30.018 -11.337   8.828
   48    HA   ALA   9           HA       ALA   9  28.357  -9.084   8.591
   49    HB1  ALA   9           HB1      ALA   9  26.734 -10.678   9.939
   50    HB2  ALA   9           HB2      ALA   9  27.992 -11.870   9.608
   51    HB3  ALA   9           HB3      ALA   9  27.186 -11.047   8.273
   52    H    GLU  10           HN       GLU  10  29.874 -10.597  11.403
   53    HA   GLU  10           HA       GLU  10  28.429  -9.236  13.405
   54    HB2  GLU  10           HB2      GLU  10  31.224 -10.368  13.337
   55    HB3  GLU  10           HB1      GLU  10  30.504  -9.690  14.796
   56    HG2  GLU  10           HG2      GLU  10  28.710 -11.317  14.730
   57    HG3  GLU  10           HG1      GLU  10  29.252 -11.912  13.161
   58    H    LEU  11           HN       LEU  11  31.370  -8.362  11.620
   59    HA   LEU  11           HA       LEU  11  31.980  -6.028  13.077
   60    HB2  LEU  11           HB2      LEU  11  33.595  -7.038  11.556
   61    HB3  LEU  11           HB1      LEU  11  32.537  -6.718  10.182
   62    HG   LEU  11           HG       LEU  11  32.718  -4.282  10.625
   63   HD11  LEU  11          HD11      LEU  11  34.517  -5.249  12.856
   64   HD12  LEU  11          HD12      LEU  11  33.089  -4.221  12.986
   65   HD13  LEU  11          HD13      LEU  11  34.562  -3.595  12.245
   66   HD21  LEU  11          HD21      LEU  11  35.474  -5.522  10.515
   67   HD22  LEU  11          HD22      LEU  11  34.935  -4.015   9.773
   68   HD23  LEU  11          HD23      LEU  11  34.355  -5.561   9.152
   69    H    VAL  12           HN       VAL  12  30.131  -6.472  10.064
   70    HA   VAL  12           HA       VAL  12  29.497  -3.766   9.693
   71    HB   VAL  12           HB       VAL  12  28.214  -6.326   8.762
   72   HG11  VAL  12          HG11      VAL  12  26.352  -4.794   8.865
   73   HG12  VAL  12          HG12      VAL  12  26.915  -4.747   7.194
   74   HG13  VAL  12          HG13      VAL  12  27.345  -3.449   8.306
   75   HG21  VAL  12          HG21      VAL  12  30.434  -5.490   7.869
   76   HG22  VAL  12          HG22      VAL  12  29.570  -4.085   7.244
   77   HG23  VAL  12          HG23      VAL  12  29.173  -5.698   6.653
   78    H    ASP  13           HN       ASP  13  27.722  -6.377  11.313
   79    HA   ASP  13           HA       ASP  13  25.416  -4.909  11.972
   80    HB2  ASP  13           HB2      ASP  13  26.724  -7.320  13.235
   81    HB3  ASP  13           HB1      ASP  13  25.193  -6.661  13.809
   82    H    ALA  14           HN       ALA  14  28.454  -5.426  13.739
   83    HA   ALA  14           HA       ALA  14  27.705  -4.088  16.107
   84    HB1  ALA  14           HB1      ALA  14  29.988  -4.155  16.696
   85    HB2  ALA  14           HB2      ALA  14  30.510  -4.154  15.011
   86    HB3  ALA  14           HB3      ALA  14  29.743  -5.587  15.696
   87    H    LEU  15           HN       LEU  15  29.230  -2.942  13.116
   88    HA   LEU  15           HA       LEU  15  29.782  -0.314  13.963
   89    HB2  LEU  15           HB2      LEU  15  29.218  -1.490  11.237
   90    HB3  LEU  15           HB1      LEU  15  29.687   0.192  11.478
   91    HG   LEU  15           HG       LEU  15  31.315  -2.105  12.579
   92   HD11  LEU  15          HD11      LEU  15  32.692  -2.041  10.626
   93   HD12  LEU  15          HD12      LEU  15  31.881  -0.600  10.013
   94   HD13  LEU  15          HD13      LEU  15  31.036  -2.148  10.030
   95   HD21  LEU  15          HD21      LEU  15  31.784   0.846  12.075
   96   HD22  LEU  15          HD22      LEU  15  33.093  -0.282  12.437
   97   HD23  LEU  15          HD23      LEU  15  31.820   0.002  13.622
   98    H    GLN  16           HN       GLN  16  26.920  -1.737  12.418
   99    HA   GLN  16           HA       GLN  16  25.474   0.697  12.174
  100    HB2  GLN  16           HB2      GLN  16  24.587  -2.189  12.270
  101    HB3  GLN  16           HB1      GLN  16  23.482  -0.843  11.985
  102    HG2  GLN  16           HG2      GLN  16  24.679  -0.190   9.992
  103    HG3  GLN  16           HG1      GLN  16  25.962  -1.353  10.323
  104   HE21  GLN  16          HE21      GLN  16  24.175  -1.243   7.924
  105   HE22  GLN  16          HE22      GLN  16  23.378  -2.741   7.882
  106    H    PHE  17           HN       PHE  17  25.645  -1.788  14.684
  107    HA   PHE  17           HA       PHE  17  23.567  -0.844  16.325
  108    HB2  PHE  17           HB2      PHE  17  24.474  -3.002  16.767
  109    HB3  PHE  17           HB1      PHE  17  26.102  -2.353  16.957
  110    HD1  PHE  17           HD1      PHE  17  22.699  -2.433  18.468
  111    HD2  PHE  17           HD2      PHE  17  26.840  -1.403  19.019
  112    HE1  PHE  17           HE1      PHE  17  22.288  -2.070  20.888
  113    HE2  PHE  17           HE2      PHE  17  26.425  -1.049  21.439
  114    HZ   PHE  17           HZ       PHE  17  24.151  -1.381  22.373
  115    H    VAL  18           HN       VAL  18  27.052  -0.132  16.414
  116    HA   VAL  18           HA       VAL  18  26.867   1.682  18.599
  117    HB   VAL  18           HB       VAL  18  29.004   1.362  16.480
  118   HG11  VAL  18          HG11      VAL  18  29.147   3.552  17.562
  119   HG12  VAL  18          HG12      VAL  18  30.443   2.512  18.151
  120   HG13  VAL  18          HG13      VAL  18  29.017   2.793  19.148
  121   HG21  VAL  18          HG21      VAL  18  28.460  -0.629  17.966
  122   HG22  VAL  18          HG22      VAL  18  28.955   0.362  19.338
  123   HG23  VAL  18          HG23      VAL  18  30.120  -0.043  18.077
  124    H    CYS  19           HN       CYS  19  27.161   2.153  15.082
  125    HA   CYS  19           HA       CYS  19  26.104   4.887  15.451
  126    HB2  CYS  19           HB2      CYS  19  28.267   4.019  13.516
  127    HB3  CYS  19           HB1      CYS  19  27.549   5.628  13.595
  128    H    GLY  20           HN       GLY  20  24.082   3.593  15.042
  129    HA2  GLY  20           HA2      GLY  20  23.614   2.499  12.438
  130    HA3  GLY  20           HA1      GLY  20  22.387   2.870  13.644
  131    H    ASP  21           HN       ASP  21  21.901   5.245  13.921
  132    HA   ASP  21           HA       ASP  21  21.103   6.359  11.451
  133    HB2  ASP  21           HB2      ASP  21  21.288   7.513  14.235
  134    HB3  ASP  21           HB1      ASP  21  20.644   8.418  12.867
  135    H    ARG  22           HN       ARG  22  23.836   7.044  13.596
  136    HA   ARG  22           HA       ARG  22  24.796   9.323  12.230
  137    HB2  ARG  22           HB2      ARG  22  26.175   7.284  13.981
  138    HB3  ARG  22           HB1      ARG  22  26.989   8.714  13.343
  139    HG2  ARG  22           HG2      ARG  22  25.136  10.102  14.374
  140    HG3  ARG  22           HG1      ARG  22  24.582   8.634  15.176
  141    HD2  ARG  22           HD2      ARG  22  27.404   9.701  15.420
  142    HD3  ARG  22           HD1      ARG  22  26.127  10.064  16.577
  143    HE   ARG  22           HE       ARG  22  27.514   7.531  16.256
  144   HH11  ARG  22          HH11      ARG  22  24.701   9.202  17.481
  145   HH12  ARG  22          HH12      ARG  22  24.353   7.990  18.666
  146   HH21  ARG  22          HH21      ARG  22  27.020   5.960  17.814
  147   HH22  ARG  22          HH22      ARG  22  25.648   6.170  18.851
  148    H    GLY  23           HN       GLY  23  25.447   5.867  11.842
  149    HA2  GLY  23           HA2      GLY  23  26.088   4.766   9.885
  150    HA3  GLY  23           HA1      GLY  23  26.358   6.329   9.120
  151    H    PHE  24           HN       PHE  24  28.236   4.553   8.592
  152    HA   PHE  24           HA       PHE  24  30.575   5.624   9.946
  153    HB2  PHE  24           HB2      PHE  24  31.490   3.398  10.486
  154    HB3  PHE  24           HB1      PHE  24  30.002   3.717  11.377
  155    HD1  PHE  24           HD1      PHE  24  31.609   1.678   8.804
  156    HD2  PHE  24           HD2      PHE  24  27.869   2.662  10.672
  157    HE1  PHE  24           HE1      PHE  24  30.581  -0.345   7.817
  158    HE2  PHE  24           HE2      PHE  24  26.844   0.634   9.689
  159    HZ   PHE  24           HZ       PHE  24  28.198  -0.870   8.264
  160    H    TYR  25           HN       TYR  25  32.579   5.037   8.854
  161    HA   TYR  25           HA       TYR  25  32.343   3.783   6.232
  162    HB2  TYR  25           HB2      TYR  25  33.186   5.684   5.000
  163    HB3  TYR  25           HB1      TYR  25  31.747   6.194   5.884
  164    HD1  TYR  25           HD1      TYR  25  35.394   6.479   5.616
  165    HD2  TYR  25           HD2      TYR  25  31.932   7.610   7.892
  166    HE1  TYR  25           HE1      TYR  25  36.721   8.231   6.765
  167    HE2  TYR  25           HE2      TYR  25  33.261   9.361   9.039
  168    HH   TYR  25           HH       TYR  25  35.580   9.871   9.547
  169    H    PHE  26           HN       PHE  26  34.470   3.531   5.189
  170    HA   PHE  26           HA       PHE  26  36.697   3.591   7.131
  171    HB2  PHE  26           HB2      PHE  26  35.979   1.362   5.217
  172    HB3  PHE  26           HB1      PHE  26  37.477   1.438   6.143
  173    HD1  PHE  26           HD1      PHE  26  33.854   0.870   6.289
  174    HD2  PHE  26           HD2      PHE  26  37.456   1.251   8.598
  175    HE1  PHE  26           HE1      PHE  26  32.703  -0.117   8.253
  176    HE2  PHE  26           HE2      PHE  26  36.305   0.264  10.559
  177    HZ   PHE  26           HZ       PHE  26  33.932  -0.419  10.387
  178    H    ASN  27           HN       ASN  27  38.743   3.995   6.299
  179    HA   ASN  27           HA       ASN  27  38.764   5.398   3.750
  180    HB2  ASN  27           HB2      ASN  27  40.970   4.986   5.781
  181    HB3  ASN  27           HB1      ASN  27  41.033   6.067   4.390
  182   HD21  ASN  27          HD21      ASN  27  38.784   7.510   4.379
  183   HD22  ASN  27          HD22      ASN  27  38.491   8.275   5.866
  184    H    LYS  28           HN       LYS  28  40.456   5.001   2.146
  185    HA   LYS  28           HA       LYS  28  40.496   2.326   1.314
  186    HB2  LYS  28           HB2      LYS  28  42.310   4.611   0.499
  187    HB3  LYS  28           HB1      LYS  28  42.128   3.091  -0.379
  188    HG2  LYS  28           HG2      LYS  28  39.730   3.547  -0.689
  189    HG3  LYS  28           HG1      LYS  28  39.902   5.067   0.192
  190    HD2  LYS  28           HD2      LYS  28  41.539   5.844  -1.504
  191    HD3  LYS  28           HD1      LYS  28  41.301   4.342  -2.400
  192    HE2  LYS  28           HE2      LYS  28  39.888   6.039  -3.393
  193    HE3  LYS  28           HE1      LYS  28  38.858   4.891  -2.540
  194    HZ1  LYS  28           HZ1      LYS  28  39.821   7.440  -1.370
  195    HZ2  LYS  28           HZ2      LYS  28  38.680   6.373  -0.704
  196    HZ3  LYS  28           HZ3      LYS  28  38.308   7.252  -2.110
  197    HA   PRO  29           HA       PRO  29  43.948   0.679   3.544
  198    HB2  PRO  29           HB2      PRO  29  44.792  -1.272   1.835
  199    HB3  PRO  29           HB1      PRO  29  43.282  -1.384   2.755
  200    HG2  PRO  29           HG2      PRO  29  43.708  -0.687  -0.098
  201    HG3  PRO  29           HG1      PRO  29  42.408  -1.622   0.658
  202    HD2  PRO  29           HD2      PRO  29  42.171   1.018  -0.114
  203    HD3  PRO  29           HD1      PRO  29  41.169   0.244   1.131
  204    H    THR  30           HN       THR  30  44.867   2.990   2.783
  205    HA   THR  30           HA       THR  30  47.210   2.600   1.056
  206    HB   THR  30           HB       THR  30  47.377   5.058   1.087
  207    HG1  THR  30           HG1      THR  30  44.992   4.943   2.608
  208   HG21  THR  30          HG21      THR  30  45.417   5.502  -0.241
  209   HG22  THR  30          HG22      THR  30  44.531   4.187   0.534
  210   HG23  THR  30          HG23      THR  30  45.885   3.827  -0.538
  211    H    GLY  31           HN       GLY  31  46.368   2.578   4.354
  212    HA2  GLY  31           HA2      GLY  31  49.013   2.219   5.227
  213    HA3  GLY  31           HA1      GLY  31  48.524   3.878   5.567
  214    H    TYR  32           HN       TYR  32  48.944   2.898   7.812
  215    HA   TYR  32           HA       TYR  32  46.400   1.772   8.799
  216    HB2  TYR  32           HB2      TYR  32  48.141   0.082   8.991
  217    HB3  TYR  32           HB1      TYR  32  49.213   1.233   9.788
  218    HD1  TYR  32           HD1      TYR  32  45.910  -0.474  10.127
  219    HD2  TYR  32           HD2      TYR  32  49.125   1.550  12.131
  220    HE1  TYR  32           HE1      TYR  32  44.921  -1.072  12.321
  221    HE2  TYR  32           HE2      TYR  32  48.136   0.951  14.325
  222    HH   TYR  32           HH       TYR  32  45.767  -1.380  14.697
  223    H    GLY  33           HN       GLY  33  45.381   2.964  10.309
  224    HA2  GLY  33           HA2      GLY  33  44.951   4.628  11.841
  225    HA3  GLY  33           HA1      GLY  33  46.617   4.418  12.377
  226    H    SER  34           HN       SER  34  47.607   6.332  12.414
  227    HA   SER  34           HA       SER  34  46.983   8.304  10.315
  228    HB2  SER  34           HB2      SER  34  47.949   9.964  11.834
  229    HB3  SER  34           HB1      SER  34  46.677   9.054  12.643
  230    HG   SER  34           HG       SER  34  48.855   9.373  13.709
  231    H    SER  35           HN       SER  35  48.990   5.875  10.478
  232    HA   SER  35           HA       SER  35  51.238   7.381   9.313
  233    HB2  SER  35           HB2      SER  35  52.027   6.709  11.459
  234    HB3  SER  35           HB1      SER  35  51.315   5.106  11.296
  235    HG   SER  35           HG       SER  35  53.520   5.004  10.827
  236    H    SER  36           HN       SER  36  51.291   6.870   7.229
  237    HA   SER  36           HA       SER  36  50.464   4.177   6.376
  238    HB2  SER  36           HB2      SER  36  50.899   6.704   4.769
  239    HB3  SER  36           HB1      SER  36  50.362   5.159   4.113
  240    HG   SER  36           HG       SER  36  48.494   6.135   4.553
  241    H    ARG  37           HN       ARG  37  53.203   5.361   7.469
  242    HA   ARG  37           HA       ARG  37  55.107   5.067   5.418
  243    HB2  ARG  37           HB2      ARG  37  55.297   4.745   8.417
  244    HB3  ARG  37           HB1      ARG  37  56.697   4.680   7.346
  245    HG2  ARG  37           HG2      ARG  37  56.285   6.930   6.563
  246    HG3  ARG  37           HG1      ARG  37  54.754   7.004   7.435
  247    HD2  ARG  37           HD2      ARG  37  57.445   6.613   8.762
  248    HD3  ARG  37           HD1      ARG  37  56.642   8.172   8.607
  249    HE   ARG  37           HE       ARG  37  54.818   6.423   9.800
  250   HH11  ARG  37          HH11      ARG  37  57.945   7.818  10.458
  251   HH12  ARG  37          HH12      ARG  37  57.727   7.800  12.174
  252   HH21  ARG  37          HH21      ARG  37  54.557   6.410  12.053
  253   HH22  ARG  37          HH22      ARG  37  55.824   7.009  13.072
  254    H    ARG  38           HN       ARG  38  53.700   2.744   7.691
  255    HA   ARG  38           HA       ARG  38  54.805   0.575   6.024
  256    HB2  ARG  38           HB2      ARG  38  54.780   0.670   9.049
  257    HB3  ARG  38           HB1      ARG  38  55.213  -0.743   8.085
  258    HG2  ARG  38           HG2      ARG  38  57.093   0.418   7.106
  259    HG3  ARG  38           HG1      ARG  38  56.601   1.939   7.853
  260    HD2  ARG  38           HD2      ARG  38  57.363  -0.552   9.394
  261    HD3  ARG  38           HD1      ARG  38  58.458   0.789   9.074
  262    HE   ARG  38           HE       ARG  38  56.150   1.842  10.269
  263   HH11  ARG  38          HH11      ARG  38  58.787  -0.315  11.016
  264   HH12  ARG  38          HH12      ARG  38  58.766   0.051  12.706
  265   HH21  ARG  38          HH21      ARG  38  56.146   2.303  12.489
  266   HH22  ARG  38          HH22      ARG  38  57.282   1.522  13.537
  267    H    ALA  39           HN       ALA  39  53.436  -1.103   5.641
  268    HA   ALA  39           HA       ALA  39  50.855  -1.134   7.073
  269    HB1  ALA  39           HB1      ALA  39  51.349  -1.020   4.114
  270    HB2  ALA  39           HB2      ALA  39  50.171  -0.132   5.082
  271    HB3  ALA  39           HB3      ALA  39  49.920  -1.845   4.737
  272    HA   PRO  40           HA       PRO  40  52.840  -5.324   6.833
  273    HB2  PRO  40           HB2      PRO  40  52.730  -5.871   9.505
  274    HB3  PRO  40           HB1      PRO  40  54.068  -4.982   8.753
  275    HG2  PRO  40           HG2      PRO  40  51.757  -3.960  10.317
  276    HG3  PRO  40           HG1      PRO  40  53.441  -3.414  10.295
  277    HD2  PRO  40           HD2      PRO  40  51.391  -2.142   8.948
  278    HD3  PRO  40           HD1      PRO  40  53.104  -2.030   8.489
  279    H    GLN  41           HN       GLN  41  50.414  -5.156   5.866
  280    HA   GLN  41           HA       GLN  41  48.305  -6.069   5.757
  281    HB2  GLN  41           HB2      GLN  41  49.691  -8.231   7.359
  282    HB3  GLN  41           HB1      GLN  41  48.182  -8.419   6.464
  283    HG2  GLN  41           HG2      GLN  41  50.869  -7.669   5.269
  284    HG3  GLN  41           HG1      GLN  41  50.085  -9.242   5.134
  285   HE21  GLN  41          HE21      GLN  41  50.589  -6.483   3.382
  286   HE22  GLN  41          HE22      GLN  41  49.192  -6.498   2.418
  287    H    THR  42           HN       THR  42  48.136  -4.135   7.528
  288    HA   THR  42           HA       THR  42  46.505  -5.297   9.691
  289    HB   THR  42           HB       THR  42  48.728  -4.661  10.612
  290    HG1  THR  42           HG1      THR  42  47.475  -4.295  12.240
  291   HG21  THR  42          HG21      THR  42  49.349  -2.287  10.674
  292   HG22  THR  42          HG22      THR  42  47.916  -1.876   9.735
  293   HG23  THR  42          HG23      THR  42  49.201  -2.837   9.005
  294    H    GLY  43           HN       GLY  43  44.788  -3.957  10.409
  295    HA2  GLY  43           HA2      GLY  43  44.308  -1.337   9.444
  296    HA3  GLY  43           HA1      GLY  43  43.433  -2.511   8.465
  297    H    ILE  44           HN       ILE  44  41.774  -0.909   9.642
  298    HA   ILE  44           HA       ILE  44  41.076  -1.349  12.322
  299    HB   ILE  44           HB       ILE  44  39.443  -0.462   9.940
  300   HG12  ILE  44          HG12      ILE  44  40.465   1.108  12.319
  301   HG13  ILE  44          HG11      ILE  44  41.363   0.968  10.807
  302   HG21  ILE  44          HG21      ILE  44  38.741  -0.630  12.870
  303   HG22  ILE  44          HG22      ILE  44  37.898  -1.388  11.519
  304   HG23  ILE  44          HG23      ILE  44  37.855   0.363  11.714
  305   HD11  ILE  44          HD11      ILE  44  39.603   2.034   9.566
  306   HD12  ILE  44          HD12      ILE  44  39.896   3.031  10.992
  307   HD13  ILE  44          HD13      ILE  44  38.502   1.952  10.942
  308    H    VAL  45           HN       VAL  45  39.884  -2.852   9.327
  309    HA   VAL  45           HA       VAL  45  37.974  -4.544  10.517
  310    HB   VAL  45           HB       VAL  45  39.556  -4.781   7.956
  311   HG11  VAL  45          HG11      VAL  45  38.972  -7.040   8.567
  312   HG12  VAL  45          HG12      VAL  45  37.784  -6.510   7.376
  313   HG13  VAL  45          HG13      VAL  45  37.361  -6.542   9.087
  314   HG21  VAL  45          HG21      VAL  45  37.968  -2.953   7.968
  315   HG22  VAL  45          HG22      VAL  45  36.717  -3.982   8.665
  316   HG23  VAL  45          HG23      VAL  45  37.267  -4.260   7.013
  317    H    ASP  46           HN       ASP  46  41.387  -5.081   9.713
  318    HA   ASP  46           HA       ASP  46  41.494  -7.780  10.528
  319    HB2  ASP  46           HB2      ASP  46  43.227  -6.572   9.156
  320    HB3  ASP  46           HB1      ASP  46  43.757  -5.782  10.639
  321    H    GLU  47           HN       GLU  47  42.029  -4.743  12.304
  322    HA   GLU  47           HA       GLU  47  43.032  -5.883  14.668
  323    HB2  GLU  47           HB2      GLU  47  43.115  -3.480  14.193
  324    HB3  GLU  47           HB1      GLU  47  41.356  -3.390  14.297
  325    HG2  GLU  47           HG2      GLU  47  42.370  -2.655  16.407
  326    HG3  GLU  47           HG1      GLU  47  41.468  -4.148  16.656
  327    H    CYS  48           HN       CYS  48  39.680  -4.923  13.880
  328    HA   CYS  48           HA       CYS  48  38.573  -5.978  16.298
  329    HB2  CYS  48           HB2      CYS  48  37.284  -5.223  13.672
  330    HB3  CYS  48           HB1      CYS  48  36.406  -5.703  15.118
  331    H    CYS  49           HN       CYS  49  38.881  -7.215  12.998
  332    HA   CYS  49           HA       CYS  49  37.313  -9.518  13.302
  333    HB2  CYS  49           HB2      CYS  49  38.043  -8.652  11.113
  334    HB3  CYS  49           HB1      CYS  49  39.703  -9.108  11.492
  335    H    PHE  50           HN       PHE  50  40.825  -9.062  13.667
  336    HA   PHE  50           HA       PHE  50  41.140 -11.788  14.585
  337    HB2  PHE  50           HB2      PHE  50  43.016  -9.479  14.118
  338    HB3  PHE  50           HB1      PHE  50  43.566 -10.954  14.922
  339    HD1  PHE  50           HD1      PHE  50  41.951  -9.623  11.843
  340    HD2  PHE  50           HD2      PHE  50  44.040 -12.916  13.647
  341    HE1  PHE  50           HE1      PHE  50  42.178 -10.685   9.616
  342    HE2  PHE  50           HE2      PHE  50  44.269 -13.984  11.421
  343    HZ   PHE  50           HZ       PHE  50  43.341 -12.873   9.405
  344    H    ARG  51           HN       ARG  51  42.308  -8.720  15.984
  345    HA   ARG  51           HA       ARG  51  42.164  -9.797  18.659
  346    HB2  ARG  51           HB2      ARG  51  42.986  -7.128  17.526
  347    HB3  ARG  51           HB1      ARG  51  42.880  -7.419  19.263
  348    HG2  ARG  51           HG2      ARG  51  44.393  -9.418  18.935
  349    HG3  ARG  51           HG1      ARG  51  44.622  -8.884  17.269
  350    HD2  ARG  51           HD2      ARG  51  45.129  -7.060  19.620
  351    HD3  ARG  51           HD1      ARG  51  46.384  -8.103  18.960
  352    HE   ARG  51           HE       ARG  51  45.289  -5.714  17.731
  353   HH11  ARG  51          HH11      ARG  51  46.986  -8.732  17.261
  354   HH12  ARG  51          HH12      ARG  51  47.752  -8.210  15.801
  355   HH21  ARG  51          HH21      ARG  51  46.314  -5.065  15.807
  356   HH22  ARG  51          HH22      ARG  51  47.373  -6.159  14.981
  357    H    SER  52           HN       SER  52  41.086  -8.509  20.413
  358    HA   SER  52           HA       SER  52  38.340  -7.918  19.586
  359    HB2  SER  52           HB2      SER  52  39.611  -8.274  22.307
  360    HB3  SER  52           HB1      SER  52  37.910  -7.899  22.053
  361    HG   SER  52           HG       SER  52  38.734 -10.229  22.216
  362    H    CYS  53           HN       CYS  53  38.556  -5.872  18.635
  363    HA   CYS  53           HA       CYS  53  39.874  -3.696  19.953
  364    HB2  CYS  53           HB2      CYS  53  38.880  -2.319  18.187
  365    HB3  CYS  53           HB1      CYS  53  39.582  -3.782  17.502
  366    H    ASP  54           HN       ASP  54  38.974  -1.950  21.041
  367    HA   ASP  54           HA       ASP  54  36.682  -2.530  22.643
  368    HB2  ASP  54           HB2      ASP  54  38.376  -0.056  22.299
  369    HB3  ASP  54           HB1      ASP  54  37.015  -0.136  23.416
  370    H    LEU  55           HN       LEU  55  34.648  -1.594  22.630
  371    HA   LEU  55           HA       LEU  55  33.530  -0.972  20.107
  372    HB2  LEU  55           HB2      LEU  55  32.489  -0.608  22.924
  373    HB3  LEU  55           HB1      LEU  55  31.525  -0.282  21.483
  374    HG   LEU  55           HG       LEU  55  32.894  -2.935  21.990
  375   HD11  LEU  55          HD11      LEU  55  31.286  -2.667  23.758
  376   HD12  LEU  55          HD12      LEU  55  30.541  -3.708  22.545
  377   HD13  LEU  55          HD13      LEU  55  30.086  -2.007  22.646
  378   HD21  LEU  55          HD21      LEU  55  32.394  -2.667  19.670
  379   HD22  LEU  55          HD22      LEU  55  30.839  -1.909  20.014
  380   HD23  LEU  55          HD23      LEU  55  31.068  -3.633  20.314
  381    H    ARG  56           HN       ARG  56  34.609   1.036  22.810
  382    HA   ARG  56           HA       ARG  56  33.621   3.503  21.903
  383    HB2  ARG  56           HB2      ARG  56  34.526   3.169  24.163
  384    HB3  ARG  56           HB1      ARG  56  36.140   2.943  23.487
  385    HG2  ARG  56           HG2      ARG  56  36.124   5.210  22.587
  386    HG3  ARG  56           HG1      ARG  56  34.462   5.444  23.135
  387    HD2  ARG  56           HD2      ARG  56  36.008   6.473  24.724
  388    HD3  ARG  56           HD1      ARG  56  35.199   5.100  25.471
  389    HE   ARG  56           HE       ARG  56  37.664   4.289  24.293
  390   HH11  ARG  56          HH11      ARG  56  36.299   6.015  26.999
  391   HH12  ARG  56          HH12      ARG  56  37.631   5.666  28.048
  392   HH21  ARG  56          HH21      ARG  56  39.396   3.847  25.689
  393   HH22  ARG  56          HH22      ARG  56  39.372   4.449  27.313
  394    H    ARG  57           HN       ARG  57  36.768   1.894  21.274
  395    HA   ARG  57           HA       ARG  57  37.871   3.948  19.714
  396    HB2  ARG  57           HB2      ARG  57  39.222   2.152  20.648
  397    HB3  ARG  57           HB1      ARG  57  38.350   0.962  19.680
  398    HG2  ARG  57           HG2      ARG  57  39.142   1.963  17.631
  399    HG3  ARG  57           HG1      ARG  57  39.893   3.288  18.523
  400    HD2  ARG  57           HD2      ARG  57  40.609   0.404  18.999
  401    HD3  ARG  57           HD1      ARG  57  41.444   1.387  17.799
  402    HE   ARG  57           HE       ARG  57  41.453   2.772  20.252
  403   HH11  ARG  57          HH11      ARG  57  42.764  -0.113  18.784
  404   HH12  ARG  57          HH12      ARG  57  44.178  -0.122  19.781
  405   HH21  ARG  57          HH21      ARG  57  43.318   2.734  21.539
  406   HH22  ARG  57          HH22      ARG  57  44.490   1.476  21.331
  407    H    LEU  58           HN       LEU  58  35.830   1.170  18.929
  408    HA   LEU  58           HA       LEU  58  35.991   1.320  16.138
  409    HB2  LEU  58           HB2      LEU  58  34.942  -0.539  17.476
  410    HB3  LEU  58           HB1      LEU  58  33.544   0.510  17.711
  411    HG   LEU  58           HG       LEU  58  33.514   0.748  15.144
  412   HD11  LEU  58          HD11      LEU  58  35.790  -0.218  14.805
  413   HD12  LEU  58          HD12      LEU  58  34.555  -1.085  13.899
  414   HD13  LEU  58          HD13      LEU  58  35.195  -1.766  15.395
  415   HD21  LEU  58          HD21      LEU  58  31.786  -0.508  16.208
  416   HD22  LEU  58          HD22      LEU  58  32.885  -1.830  16.593
  417   HD23  LEU  58          HD23      LEU  58  32.404  -1.542  14.922
  418    H    ASP  59           HN       ASP  59  33.983   3.061  18.437
  419    HA   ASP  59           HA       ASP  59  32.150   4.240  16.696
  420    HB2  ASP  59           HB2      ASP  59  32.154   4.338  19.231
  421    HB3  ASP  59           HB1      ASP  59  33.357   5.619  19.094
  422    H    MET  60           HN       MET  60  35.532   4.812  17.067
  423    HA   MET  60           HA       MET  60  35.732   7.480  16.200
  424    HB2  MET  60           HB2      MET  60  37.625   5.148  15.912
  425    HB3  MET  60           HB1      MET  60  38.034   6.803  15.479
  426    HG2  MET  60           HG2      MET  60  37.001   6.046  18.220
  427    HG3  MET  60           HG1      MET  60  38.719   6.108  17.830
  428    HE1  MET  60           HE1      MET  60  40.102   8.659  17.817
  429    HE2  MET  60           HE2      MET  60  39.301   9.597  16.561
  430    HE3  MET  60           HE3      MET  60  39.570   7.872  16.326
  431    H    TYR  61           HN       TYR  61  35.458   4.444  14.429
  432    HA   TYR  61           HA       TYR  61  35.898   5.689  11.855
  433    HB2  TYR  61           HB2      TYR  61  34.657   2.979  12.217
  434    HB3  TYR  61           HB1      TYR  61  35.744   3.552  10.952
  435    HD1  TYR  61           HD1      TYR  61  35.726   1.287  13.422
  436    HD2  TYR  61           HD2      TYR  61  37.944   4.797  12.332
  437    HE1  TYR  61           HE1      TYR  61  37.667   0.458  14.718
  438    HE2  TYR  61           HE2      TYR  61  39.888   3.978  13.637
  439    HH   TYR  61           HH       TYR  61  40.208   0.824  14.656
  440    H    CYS  62           HN       CYS  62  33.595   6.604  13.611
  441    HA   CYS  62           HA       CYS  62  31.295   5.923  11.941
  442    HB2  CYS  62           HB2      CYS  62  31.555   7.399  14.569
  443    HB3  CYS  62           HB1      CYS  62  30.035   7.219  13.694
  444    H    ALA  63           HN       ALA  63  29.960   7.626  11.084
  445    HA   ALA  63           HA       ALA  63  31.413   9.597   9.729
  446    HB1  ALA  63           HB1      ALA  63  28.519   8.941  10.067
  447    HB2  ALA  63           HB2      ALA  63  29.486   9.016   8.594
  448    HB3  ALA  63           HB3      ALA  63  28.949  10.504   9.374
  449    HA   PRO  64           HA       PRO  64  31.433  12.925  12.623
  450    HB2  PRO  64           HB2      PRO  64  31.399  15.081  10.956
  451    HB3  PRO  64           HB1      PRO  64  32.810  14.020  11.134
  452    HG2  PRO  64           HG2      PRO  64  30.767  14.110   8.978
  453    HG3  PRO  64           HG1      PRO  64  32.511  13.810   8.876
  454    HD2  PRO  64           HD2      PRO  64  30.599  11.814   8.788
  455    HD3  PRO  64           HD1      PRO  64  32.275  11.550   9.305
  456    H    LEU  65           HN       LEU  65  30.189  14.673  13.533
  457    HA   LEU  65           HA       LEU  65  27.350  14.597  12.719
  458    HB2  LEU  65           HB2      LEU  65  28.559  15.284  15.409
  459    HB3  LEU  65           HB1      LEU  65  26.836  15.225  15.035
  460    HG   LEU  65           HG       LEU  65  28.736  12.877  14.776
  461   HD11  LEU  65          HD11      LEU  65  26.751  13.674  16.918
  462   HD12  LEU  65          HD12      LEU  65  28.468  13.323  17.113
  463   HD13  LEU  65          HD13      LEU  65  27.340  12.022  16.735
  464   HD21  LEU  65          HD21      LEU  65  26.920  12.605  13.242
  465   HD22  LEU  65          HD22      LEU  65  25.751  13.231  14.406
  466   HD23  LEU  65          HD23      LEU  65  26.491  11.652  14.660
  467    H    LYS  66           HN       LYS  66  26.207  16.481  12.467
  468    HA   LYS  66           HA       LYS  66  27.696  18.756  11.658
  469    HB2  LYS  66           HB2      LYS  66  24.735  18.328  12.090
  470    HB3  LYS  66           HB1      LYS  66  25.416  19.826  11.457
  471    HG2  LYS  66           HG2      LYS  66  26.455  18.583   9.604
  472    HG3  LYS  66           HG1      LYS  66  25.792  17.076  10.237
  473    HD2  LYS  66           HD2      LYS  66  23.505  17.961   9.957
  474    HD3  LYS  66           HD1      LYS  66  24.166  19.467   9.319
  475    HE2  LYS  66           HE2      LYS  66  25.212  18.230   7.461
  476    HE3  LYS  66           HE1      LYS  66  24.564  16.719   8.098
  477    HZ1  LYS  66           HZ1      LYS  66  22.887  19.040   7.327
  478    HZ2  LYS  66           HZ2      LYS  66  22.356  17.481   7.743
  479    HZ3  LYS  66           HZ3      LYS  66  23.215  17.733   6.298
  480    HA   PRO  67           HA       PRO  67  28.013  21.008  15.445
  481    HB2  PRO  67           HB2      PRO  67  27.771  23.591  14.556
  482    HB3  PRO  67           HB1      PRO  67  29.227  22.606  14.317
  483    HG2  PRO  67           HG2      PRO  67  27.009  23.202  12.417
  484    HG3  PRO  67           HG1      PRO  67  28.755  23.117  12.125
  485    HD2  PRO  67           HD2      PRO  67  27.070  21.093  11.462
  486    HD3  PRO  67           HD1      PRO  67  28.755  20.813  11.950
  487    H    ALA  68           HN       ALA  68  26.801  22.113  17.033
  488    HA   ALA  68           HA       ALA  68  24.002  21.751  16.947
  489    HB1  ALA  68           HB1      ALA  68  24.025  23.134  19.050
  490    HB2  ALA  68           HB2      ALA  68  25.752  23.381  18.797
  491    HB3  ALA  68           HB3      ALA  68  25.125  21.755  19.073
  492    H    LYS  69           HN       LYS  69  22.320  23.161  16.612
  493    HA   LYS  69           HA       LYS  69  22.693  25.287  14.797
  494    HB2  LYS  69           HB2      LYS  69  20.355  24.538  16.563
  495    HB3  LYS  69           HB1      LYS  69  20.290  25.829  15.362
  496    HG2  LYS  69           HG2      LYS  69  20.897  24.223  13.593
  497    HG3  LYS  69           HG1      LYS  69  20.970  22.929  14.790
  498    HD2  LYS  69           HD2      LYS  69  18.584  23.305  15.331
  499    HD3  LYS  69           HD1      LYS  69  18.513  24.571  14.106
  500    HE2  LYS  69           HE2      LYS  69  19.240  21.677  13.566
  501    HE3  LYS  69           HE1      LYS  69  17.662  22.398  13.249
  502    HZ1  LYS  69           HZ1      LYS  69  19.103  24.121  11.952
  503    HZ2  LYS  69           HZ2      LYS  69  18.666  22.647  11.231
  504    HZ3  LYS  69           HZ3      LYS  69  20.220  22.847  11.887
  505    H    SER  70           HN       SER  70  22.269  25.215  18.310
  506    HA   SER  70           HA       SER  70  22.526  26.835  19.919
  507    HB2  SER  70           HB2      SER  70  24.347  28.021  17.812
  508    HB3  SER  70           HB1      SER  70  24.304  28.500  19.508
  509    HG   SER  70           HG       SER  70  25.815  26.978  19.536
  510    H    ALA  71           HN       ALA  71  20.252  27.092  18.271
  511    HA   ALA  71           HA       ALA  71  19.650  29.886  18.711
  512    HB1  ALA  71           HB1      ALA  71  18.887  30.254  16.356
  513    HB2  ALA  71           HB2      ALA  71  19.669  28.738  15.912
  514    HB3  ALA  71           HB3      ALA  71  20.635  30.087  16.512
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1  26.667 -14.933  23.255
    2    H2   GLY   1           HT2      GLY   1  28.330 -14.963  23.602
    3    H3   GLY   1           HT3      GLY   1  27.303 -16.157  24.241
    4    HA2  GLY   1           HA2      GLY   1  27.135 -17.297  22.288
    5    HA3  GLY   1           HA1      GLY   1  27.445 -15.849  21.328
    6    H    GLY   2           HN       GLY   2  28.792 -18.397  21.056
    7    HA2  GLY   2           HA2      GLY   2  31.292 -18.516  22.323
    8    HA3  GLY   2           HA1      GLY   2  30.924 -19.212  20.748
    9    HA   PRO   3           HA       PRO   3  33.244 -15.999  18.801
   10    HB2  PRO   3           HB2      PRO   3  31.738 -15.161  16.699
   11    HB3  PRO   3           HB1      PRO   3  32.477 -16.773  16.772
   12    HG2  PRO   3           HG2      PRO   3  29.662 -15.958  17.231
   13    HG3  PRO   3           HG1      PRO   3  30.312 -17.436  16.506
   14    HD2  PRO   3           HD2      PRO   3  29.371 -17.232  19.124
   15    HD3  PRO   3           HD1      PRO   3  30.456 -18.506  18.526
   16    H    GLU   4           HN       GLU   4  32.714 -14.704  20.894
   17    HA   GLU   4           HA       GLU   4  30.888 -12.545  20.758
   18    HB2  GLU   4           HB2      GLU   4  31.984 -11.716  22.757
   19    HB3  GLU   4           HB1      GLU   4  31.802 -13.467  22.884
   20    HG2  GLU   4           HG2      GLU   4  34.129 -13.755  22.083
   21    HG3  GLU   4           HG1      GLU   4  34.312 -12.004  22.012
   22    H    THR   5           HN       THR   5  33.784 -13.059  19.186
   23    HA   THR   5           HA       THR   5  34.757 -10.360  19.114
   24    HB   THR   5           HB       THR   5  36.312 -11.190  17.427
   25    HG1  THR   5           HG1      THR   5  35.866 -12.900  16.291
   26   HG21  THR   5          HG21      THR   5  36.852 -11.725  19.735
   27   HG22  THR   5          HG22      THR   5  37.278 -13.102  18.719
   28   HG23  THR   5          HG23      THR   5  35.805 -13.142  19.688
   29    H    LEU   6           HN       LEU   6  34.942  -9.128  17.079
   30    HA   LEU   6           HA       LEU   6  32.450  -9.353  15.504
   31    HB2  LEU   6           HB2      LEU   6  34.213  -6.936  15.998
   32    HB3  LEU   6           HB1      LEU   6  32.704  -6.948  15.086
   33    HG   LEU   6           HG       LEU   6  32.961  -7.721  18.007
   34   HD11  LEU   6          HD11      LEU   6  31.611  -5.558  18.286
   35   HD12  LEU   6          HD12      LEU   6  32.091  -5.169  16.633
   36   HD13  LEU   6          HD13      LEU   6  33.317  -5.369  17.885
   37   HD21  LEU   6          HD21      LEU   6  30.629  -7.473  16.089
   38   HD22  LEU   6          HD22      LEU   6  30.410  -7.432  17.839
   39   HD23  LEU   6          HD23      LEU   6  31.087  -8.865  17.069
   40    H    CYS   7           HN       CYS   7  32.660  -9.987  13.464
   41    HA   CYS   7           HA       CYS   7  34.771  -9.046  11.762
   42    HB2  CYS   7           HB2      CYS   7  35.867 -10.916  13.060
   43    HB3  CYS   7           HB1      CYS   7  34.714 -12.018  12.307
   44    H    GLY   8           HN       GLY   8  34.345  -9.403   9.575
   45    HA2  GLY   8           HA2      GLY   8  33.022  -9.743   7.724
   46    HA3  GLY   8           HA1      GLY   8  32.498 -11.226   8.515
   47    H    ALA   9           HN       ALA   9  30.362 -11.308   8.503
   48    HA   ALA   9           HA       ALA   9  28.624  -9.113   8.255
   49    HB1  ALA   9           HB1      ALA   9  27.756 -11.222   7.629
   50    HB2  ALA   9           HB2      ALA   9  26.882 -10.796   9.103
   51    HB3  ALA   9           HB3      ALA   9  28.210 -11.955   9.168
   52    H    GLU  10           HN       GLU  10  29.848 -10.831  11.096
   53    HA   GLU  10           HA       GLU  10  28.131  -9.655  13.004
   54    HB2  GLU  10           HB2      GLU  10  30.931 -10.771  13.212
   55    HB3  GLU  10           HB1      GLU  10  30.008 -10.227  14.613
   56    HG2  GLU  10           HG2      GLU  10  29.117 -12.358  12.648
   57    HG3  GLU  10           HG1      GLU  10  29.779 -12.671  14.251
   58    H    LEU  11           HN       LEU  11  31.269  -8.650  11.706
   59    HA   LEU  11           HA       LEU  11  31.613  -6.410  13.393
   60    HB2  LEU  11           HB2      LEU  11  33.482  -7.313  12.132
   61    HB3  LEU  11           HB1      LEU  11  32.674  -6.935  10.610
   62    HG   LEU  11           HG       LEU  11  32.732  -4.530  11.180
   63   HD11  LEU  11          HD11      LEU  11  32.653  -4.534  13.569
   64   HD12  LEU  11          HD12      LEU  11  34.239  -3.889  13.143
   65   HD13  LEU  11          HD13      LEU  11  34.083  -5.561  13.683
   66   HD21  LEU  11          HD21      LEU  11  34.641  -5.714   9.994
   67   HD22  LEU  11          HD22      LEU  11  35.477  -5.740  11.547
   68   HD23  LEU  11          HD23      LEU  11  35.071  -4.198  10.789
   69    H    VAL  12           HN       VAL  12  30.144  -6.763  10.186
   70    HA   VAL  12           HA       VAL  12  29.653  -4.061   9.703
   71    HB   VAL  12           HB       VAL  12  28.296  -6.585   8.782
   72   HG11  VAL  12          HG11      VAL  12  27.178  -5.022   7.081
   73   HG12  VAL  12          HG12      VAL  12  27.611  -3.693   8.157
   74   HG13  VAL  12          HG13      VAL  12  26.517  -4.957   8.714
   75   HG21  VAL  12          HG21      VAL  12  30.519  -6.117   7.908
   76   HG22  VAL  12          HG22      VAL  12  30.038  -4.475   7.480
   77   HG23  VAL  12          HG23      VAL  12  29.329  -5.852   6.635
   78    H    ASP  13           HN       ASP  13  27.620  -6.511  11.282
   79    HA   ASP  13           HA       ASP  13  25.393  -4.847  11.762
   80    HB2  ASP  13           HB2      ASP  13  25.374  -7.329  11.930
   81    HB3  ASP  13           HB1      ASP  13  26.343  -7.210  13.396
   82    H    ALA  14           HN       ALA  14  28.227  -5.627  13.772
   83    HA   ALA  14           HA       ALA  14  27.434  -4.154  16.041
   84    HB1  ALA  14           HB1      ALA  14  29.324  -5.842  15.902
   85    HB2  ALA  14           HB2      ALA  14  29.681  -4.367  16.801
   86    HB3  ALA  14           HB3      ALA  14  30.290  -4.567  15.157
   87    H    LEU  15           HN       LEU  15  29.289  -3.240  13.166
   88    HA   LEU  15           HA       LEU  15  29.992  -0.644  14.023
   89    HB2  LEU  15           HB2      LEU  15  29.649  -1.836  11.272
   90    HB3  LEU  15           HB1      LEU  15  30.193  -0.179  11.533
   91    HG   LEU  15           HG       LEU  15  31.547  -2.576  12.800
   92   HD11  LEU  15          HD11      LEU  15  32.437  -1.047  10.339
   93   HD12  LEU  15          HD12      LEU  15  31.593  -2.595  10.262
   94   HD13  LEU  15          HD13      LEU  15  33.179  -2.491  11.028
   95   HD21  LEU  15          HD21      LEU  15  32.076  -0.551  13.966
   96   HD22  LEU  15          HD22      LEU  15  32.214   0.361  12.464
   97   HD23  LEU  15          HD23      LEU  15  33.438  -0.838  12.884
   98    H    GLN  16           HN       GLN  16  27.153  -1.890  12.298
   99    HA   GLN  16           HA       GLN  16  25.981   0.614  11.742
  100    HB2  GLN  16           HB2      GLN  16  25.287  -1.532  10.710
  101    HB3  GLN  16           HB1      GLN  16  24.599  -2.026  12.258
  102    HG2  GLN  16           HG2      GLN  16  22.847  -1.086  10.836
  103    HG3  GLN  16           HG1      GLN  16  23.132  -0.029  12.217
  104   HE21  GLN  16          HE21      GLN  16  23.075   2.115  11.551
  105   HE22  GLN  16          HE22      GLN  16  23.714   2.702  10.093
  106    H    PHE  17           HN       PHE  17  25.598  -1.624  14.478
  107    HA   PHE  17           HA       PHE  17  23.662  -0.146  15.901
  108    HB2  PHE  17           HB2      PHE  17  24.034  -2.404  16.544
  109    HB3  PHE  17           HB1      PHE  17  25.763  -2.136  16.768
  110    HD1  PHE  17           HD1      PHE  17  22.390  -1.332  18.129
  111    HD2  PHE  17           HD2      PHE  17  26.642  -1.210  18.775
  112    HE1  PHE  17           HE1      PHE  17  22.013  -0.692  20.498
  113    HE2  PHE  17           HE2      PHE  17  26.257  -0.576  21.142
  114    HZ   PHE  17           HZ       PHE  17  23.948  -0.317  22.005
  115    H    VAL  18           HN       VAL  18  27.201  -0.249  16.265
  116    HA   VAL  18           HA       VAL  18  27.338   1.665  18.329
  117    HB   VAL  18           HB       VAL  18  29.385   0.785  16.288
  118   HG11  VAL  18          HG11      VAL  18  29.654   2.501  18.768
  119   HG12  VAL  18          HG12      VAL  18  30.000   2.990  17.109
  120   HG13  VAL  18          HG13      VAL  18  31.017   1.790  17.905
  121   HG21  VAL  18          HG21      VAL  18  28.561  -0.944  17.878
  122   HG22  VAL  18          HG22      VAL  18  28.996   0.109  19.223
  123   HG23  VAL  18          HG23      VAL  18  30.252  -0.537  18.168
  124    H    CYS  19           HN       CYS  19  27.573   1.944  14.823
  125    HA   CYS  19           HA       CYS  19  27.746   4.862  15.040
  126    HB2  CYS  19           HB2      CYS  19  27.998   3.067  12.611
  127    HB3  CYS  19           HB1      CYS  19  28.310   4.804  12.656
  128    H    GLY  20           HN       GLY  20  25.273   3.303  15.622
  129    HA2  GLY  20           HA2      GLY  20  23.430   3.321  13.539
  130    HA3  GLY  20           HA1      GLY  20  23.011   3.524  15.237
  131    H    ASP  21           HN       ASP  21  22.130   4.818  12.622
  132    HA   ASP  21           HA       ASP  21  21.317   6.856  11.975
  133    HB2  ASP  21           HB2      ASP  21  22.137   7.910  14.684
  134    HB3  ASP  21           HB1      ASP  21  20.845   8.488  13.632
  135    H    ARG  22           HN       ARG  22  24.448   6.164  12.321
  136    HA   ARG  22           HA       ARG  22  25.319   8.814  11.388
  137    HB2  ARG  22           HB2      ARG  22  26.743   6.857  13.198
  138    HB3  ARG  22           HB1      ARG  22  27.529   8.246  12.443
  139    HG2  ARG  22           HG2      ARG  22  25.744   9.705  13.474
  140    HG3  ARG  22           HG1      ARG  22  25.203   8.288  14.374
  141    HD2  ARG  22           HD2      ARG  22  28.054   9.231  14.432
  142    HD3  ARG  22           HD1      ARG  22  26.855   9.823  15.574
  143    HE   ARG  22           HE       ARG  22  28.063   7.183  15.520
  144   HH11  ARG  22          HH11      ARG  22  25.395   9.138  16.622
  145   HH12  ARG  22          HH12      ARG  22  25.025   8.090  17.948
  146   HH21  ARG  22          HH21      ARG  22  27.560   5.848  17.268
  147   HH22  ARG  22          HH22      ARG  22  26.237   6.244  18.312
  148    H    GLY  23           HN       GLY  23  25.611   5.326  11.180
  149    HA2  GLY  23           HA2      GLY  23  26.152   3.996   9.365
  150    HA3  GLY  23           HA1      GLY  23  26.408   5.456   8.415
  151    H    PHE  24           HN       PHE  24  28.201   3.589   7.920
  152    HA   PHE  24           HA       PHE  24  30.650   4.719   9.007
  153    HB2  PHE  24           HB2      PHE  24  31.575   2.542   9.691
  154    HB3  PHE  24           HB1      PHE  24  30.137   2.940  10.632
  155    HD1  PHE  24           HD1      PHE  24  31.640   0.628   8.262
  156    HD2  PHE  24           HD2      PHE  24  27.936   1.911  10.016
  157    HE1  PHE  24           HE1      PHE  24  30.548  -1.451   7.479
  158    HE2  PHE  24           HE2      PHE  24  26.844  -0.172   9.238
  159    HZ   PHE  24           HZ       PHE  24  28.149  -1.851   7.968
  160    H    TYR  25           HN       TYR  25  32.553   4.040   7.801
  161    HA   TYR  25           HA       TYR  25  32.154   2.536   5.346
  162    HB2  TYR  25           HB2      TYR  25  32.747   4.321   3.837
  163    HB3  TYR  25           HB1      TYR  25  31.373   4.864   4.801
  164    HD1  TYR  25           HD1      TYR  25  34.966   5.254   4.158
  165    HD2  TYR  25           HD2      TYR  25  31.659   6.539   6.579
  166    HE1  TYR  25           HE1      TYR  25  36.303   7.179   4.956
  167    HE2  TYR  25           HE2      TYR  25  32.995   8.469   7.378
  168    HH   TYR  25           HH       TYR  25  34.881   9.760   6.808
  169    H    PHE  26           HN       PHE  26  34.237   2.470   4.064
  170    HA   PHE  26           HA       PHE  26  36.534   2.551   5.927
  171    HB2  PHE  26           HB2      PHE  26  36.042   0.694   3.585
  172    HB3  PHE  26           HB1      PHE  26  37.479   0.695   4.607
  173    HD1  PHE  26           HD1      PHE  26  34.090  -0.463   4.240
  174    HD2  PHE  26           HD2      PHE  26  37.183   0.299   7.119
  175    HE1  PHE  26           HE1      PHE  26  32.920  -1.911   5.879
  176    HE2  PHE  26           HE2      PHE  26  36.012  -1.148   8.757
  177    HZ   PHE  26           HZ       PHE  26  33.883  -2.253   8.140
  178    H    ASN  27           HN       ASN  27  38.326   3.635   5.322
  179    HA   ASN  27           HA       ASN  27  38.291   4.902   2.653
  180    HB2  ASN  27           HB2      ASN  27  38.174   6.405   4.673
  181    HB3  ASN  27           HB1      ASN  27  39.786   5.837   5.109
  182   HD21  ASN  27          HD21      ASN  27  40.923   7.813   4.696
  183   HD22  ASN  27          HD22      ASN  27  41.036   8.499   3.148
  184    H    LYS  28           HN       LYS  28  39.617   3.883   1.281
  185    HA   LYS  28           HA       LYS  28  42.293   3.088   2.265
  186    HB2  LYS  28           HB2      LYS  28  40.643   1.601   0.209
  187    HB3  LYS  28           HB1      LYS  28  42.216   1.122   0.850
  188    HG2  LYS  28           HG2      LYS  28  41.267   0.876   3.090
  189    HG3  LYS  28           HG1      LYS  28  39.700   1.441   2.510
  190    HD2  LYS  28           HD2      LYS  28  39.729  -0.490   0.867
  191    HD3  LYS  28           HD1      LYS  28  41.131  -1.108   1.745
  192    HE2  LYS  28           HE2      LYS  28  38.469  -0.462   3.030
  193    HE3  LYS  28           HE1      LYS  28  38.961  -2.083   2.538
  194    HZ1  LYS  28           HZ1      LYS  28  39.443  -1.765   4.854
  195    HZ2  LYS  28           HZ2      LYS  28  40.317  -0.344   4.529
  196    HZ3  LYS  28           HZ3      LYS  28  40.907  -1.848   4.001
  197    HA   PRO  29           HA       PRO  29  42.485   6.188  -1.271
  198    HB2  PRO  29           HB2      PRO  29  44.953   6.814   0.292
  199    HB3  PRO  29           HB1      PRO  29  43.764   7.916  -0.432
  200    HG2  PRO  29           HG2      PRO  29  43.805   7.518   2.177
  201    HG3  PRO  29           HG1      PRO  29  42.266   7.655   1.308
  202    HD2  PRO  29           HD2      PRO  29  43.623   5.183   2.357
  203    HD3  PRO  29           HD1      PRO  29  41.895   5.595   2.324
  204    H    THR  30           HN       THR  30  44.953   4.138   0.223
  205    HA   THR  30           HA       THR  30  46.675   4.101  -2.079
  206    HB   THR  30           HB       THR  30  47.929   2.409  -0.853
  207    HG1  THR  30           HG1      THR  30  46.713   1.108   0.250
  208   HG21  THR  30          HG21      THR  30  48.281   4.703  -0.142
  209   HG22  THR  30          HG22      THR  30  48.278   3.667   1.285
  210   HG23  THR  30          HG23      THR  30  46.858   4.637   0.898
  211    H    GLY  31           HN       GLY  31  47.255   2.012  -3.156
  212    HA2  GLY  31           HA2      GLY  31  46.439  -0.303  -3.619
  213    HA3  GLY  31           HA1      GLY  31  44.824   0.400  -3.653
  214    H    TYR  32           HN       TYR  32  47.433   2.258  -4.972
  215    HA   TYR  32           HA       TYR  32  46.217   2.495  -7.486
  216    HB2  TYR  32           HB2      TYR  32  49.041   3.089  -6.595
  217    HB3  TYR  32           HB1      TYR  32  48.382   3.553  -8.164
  218    HD1  TYR  32           HD1      TYR  32  48.274   4.155  -4.537
  219    HD2  TYR  32           HD2      TYR  32  46.629   5.258  -8.350
  220    HE1  TYR  32           HE1      TYR  32  47.252   6.169  -3.514
  221    HE2  TYR  32           HE2      TYR  32  45.608   7.274  -7.326
  222    HH   TYR  32           HH       TYR  32  45.942   8.713  -5.377
  223    H    GLY  33           HN       GLY  33  48.816   0.445  -6.292
  224    HA2  GLY  33           HA2      GLY  33  48.397  -1.466  -8.409
  225    HA3  GLY  33           HA1      GLY  33  49.924  -0.599  -8.555
  226    H    SER  34           HN       SER  34  50.259  -3.177  -8.281
  227    HA   SER  34           HA       SER  34  50.721  -3.710  -5.413
  228    HB2  SER  34           HB2      SER  34  50.856  -6.078  -6.055
  229    HB3  SER  34           HB1      SER  34  49.324  -5.371  -6.561
  230    HG   SER  34           HG       SER  34  51.146  -6.570  -8.052
  231    H    SER  35           HN       SER  35  52.348  -2.506  -7.993
  232    HA   SER  35           HA       SER  35  54.737  -3.985  -8.085
  233    HB2  SER  35           HB2      SER  35  55.620  -2.109  -9.260
  234    HB3  SER  35           HB1      SER  35  53.917  -2.208  -9.699
  235    HG   SER  35           HG       SER  35  55.244  -0.407  -7.993
  236    H    SER  36           HN       SER  36  53.494  -1.689  -5.799
  237    HA   SER  36           HA       SER  36  55.928  -0.841  -4.628
  238    HB2  SER  36           HB2      SER  36  53.830   0.327  -4.193
  239    HB3  SER  36           HB1      SER  36  53.165  -1.108  -3.417
  240    HG   SER  36           HG       SER  36  55.404   0.438  -2.593
  241    H    ARG  37           HN       ARG  37  57.148  -1.668  -2.986
  242    HA   ARG  37           HA       ARG  37  57.220  -4.461  -2.621
  243    HB2  ARG  37           HB2      ARG  37  58.458  -2.194  -1.049
  244    HB3  ARG  37           HB1      ARG  37  58.804  -3.893  -0.732
  245    HG2  ARG  37           HG2      ARG  37  59.111  -2.702  -3.490
  246    HG3  ARG  37           HG1      ARG  37  60.417  -2.643  -2.309
  247    HD2  ARG  37           HD2      ARG  37  59.041  -5.188  -3.224
  248    HD3  ARG  37           HD1      ARG  37  60.587  -4.613  -3.832
  249    HE   ARG  37           HE       ARG  37  60.811  -4.720  -1.056
  250   HH11  ARG  37          HH11      ARG  37  60.224  -6.906  -3.707
  251   HH12  ARG  37          HH12      ARG  37  60.951  -8.258  -2.908
  252   HH21  ARG  37          HH21      ARG  37  61.751  -6.501  -0.038
  253   HH22  ARG  37          HH22      ARG  37  61.811  -8.032  -0.844
  254    H    ARG  38           HN       ARG  38  55.843  -1.857  -0.673
  255    HA   ARG  38           HA       ARG  38  54.109  -3.771   0.660
  256    HB2  ARG  38           HB2      ARG  38  54.756  -3.107   2.912
  257    HB3  ARG  38           HB1      ARG  38  56.152  -3.769   2.061
  258    HG2  ARG  38           HG2      ARG  38  56.907  -1.482   1.521
  259    HG3  ARG  38           HG1      ARG  38  55.520  -0.820   2.390
  260    HD2  ARG  38           HD2      ARG  38  56.293  -1.919   4.460
  261    HD3  ARG  38           HD1      ARG  38  57.682  -2.573   3.596
  262    HE   ARG  38           HE       ARG  38  57.661   0.224   3.265
  263   HH11  ARG  38          HH11      ARG  38  58.101  -2.181   5.750
  264   HH12  ARG  38          HH12      ARG  38  59.154  -1.184   6.692
  265   HH21  ARG  38          HH21      ARG  38  59.035   1.502   4.516
  266   HH22  ARG  38          HH22      ARG  38  59.682   0.888   6.002
  267    H    ALA  39           HN       ALA  39  52.410  -2.713   1.901
  268    HA   ALA  39           HA       ALA  39  52.138   0.159   1.673
  269    HB1  ALA  39           HB1      ALA  39  49.753  -0.455   0.528
  270    HB2  ALA  39           HB2      ALA  39  50.775  -1.704  -0.181
  271    HB3  ALA  39           HB3      ALA  39  51.190  -0.004  -0.389
  272    HA   PRO  40           HA       PRO  40  49.601  -0.477   5.213
  273    HB2  PRO  40           HB2      PRO  40  47.819   1.582   5.054
  274    HB3  PRO  40           HB1      PRO  40  49.533   1.815   5.447
  275    HG2  PRO  40           HG2      PRO  40  48.102   2.257   2.881
  276    HG3  PRO  40           HG1      PRO  40  49.415   3.187   3.618
  277    HD2  PRO  40           HD2      PRO  40  49.785   1.369   1.569
  278    HD3  PRO  40           HD1      PRO  40  51.050   1.831   2.728
  279    H    GLN  41           HN       GLN  41  48.721  -2.513   4.279
  280    HA   GLN  41           HA       GLN  41  46.061  -2.339   3.100
  281    HB2  GLN  41           HB2      GLN  41  47.881  -4.676   3.699
  282    HB3  GLN  41           HB1      GLN  41  46.261  -4.850   3.023
  283    HG2  GLN  41           HG2      GLN  41  46.865  -3.560   1.069
  284    HG3  GLN  41           HG1      GLN  41  48.430  -3.147   1.768
  285   HE21  GLN  41          HE21      GLN  41  47.816  -4.689  -0.762
  286   HE22  GLN  41          HE22      GLN  41  48.614  -6.176  -0.571
  287    H    THR  42           HN       THR  42  47.033  -1.913   6.090
  288    HA   THR  42           HA       THR  42  45.398  -3.799   7.535
  289    HB   THR  42           HB       THR  42  46.063  -2.523   9.508
  290    HG1  THR  42           HG1      THR  42  46.064  -0.452   8.921
  291   HG21  THR  42          HG21      THR  42  48.425  -2.905   9.382
  292   HG22  THR  42          HG22      THR  42  48.430  -2.685   7.632
  293   HG23  THR  42          HG23      THR  42  47.671  -4.112   8.340
  294    H    GLY  43           HN       GLY  43  43.712  -2.990   9.078
  295    HA2  GLY  43           HA2      GLY  43  42.360  -0.530   8.567
  296    HA3  GLY  43           HA1      GLY  43  41.536  -1.888   7.807
  297    H    ILE  44           HN       ILE  44  40.107  -0.625   9.627
  298    HA   ILE  44           HA       ILE  44  40.436  -1.483  12.316
  299    HB   ILE  44           HB       ILE  44  38.168  -0.656  12.650
  300   HG12  ILE  44          HG12      ILE  44  38.044  -0.396   9.627
  301   HG13  ILE  44          HG11      ILE  44  37.200  -1.633  10.555
  302   HG21  ILE  44          HG21      ILE  44  39.648   1.073  10.651
  303   HG22  ILE  44          HG22      ILE  44  40.055   0.955  12.364
  304   HG23  ILE  44          HG23      ILE  44  38.500   1.626  11.871
  305   HD11  ILE  44          HD11      ILE  44  36.814   1.358  10.814
  306   HD12  ILE  44          HD12      ILE  44  36.033   0.151  11.832
  307   HD13  ILE  44          HD13      ILE  44  35.672   0.215  10.107
  308    H    VAL  45           HN       VAL  45  38.952  -2.876   9.485
  309    HA   VAL  45           HA       VAL  45  37.297  -4.783  10.727
  310    HB   VAL  45           HB       VAL  45  38.716  -4.803   8.057
  311   HG11  VAL  45          HG11      VAL  45  36.739  -6.747   9.274
  312   HG12  VAL  45          HG12      VAL  45  38.328  -7.107   8.595
  313   HG13  VAL  45          HG13      VAL  45  37.003  -6.622   7.533
  314   HG21  VAL  45          HG21      VAL  45  35.766  -4.491   8.651
  315   HG22  VAL  45          HG22      VAL  45  36.633  -4.072   7.174
  316   HG23  VAL  45          HG23      VAL  45  36.858  -3.108   8.631
  317    H    ASP  46           HN       ASP  46  40.639  -5.038   9.553
  318    HA   ASP  46           HA       ASP  46  40.998  -7.720  10.366
  319    HB2  ASP  46           HB2      ASP  46  42.958  -5.490   9.816
  320    HB3  ASP  46           HB1      ASP  46  43.457  -7.133  10.215
  321    H    GLU  47           HN       GLU  47  41.622  -4.621  11.990
  322    HA   GLU  47           HA       GLU  47  43.019  -5.659  14.199
  323    HB2  GLU  47           HB2      GLU  47  42.895  -3.257  13.657
  324    HB3  GLU  47           HB1      GLU  47  41.179  -3.253  14.061
  325    HG2  GLU  47           HG2      GLU  47  42.466  -2.419  15.959
  326    HG3  GLU  47           HG1      GLU  47  41.755  -3.976  16.375
  327    H    CYS  48           HN       CYS  48  39.532  -4.909  13.871
  328    HA   CYS  48           HA       CYS  48  38.844  -5.961  16.440
  329    HB2  CYS  48           HB2      CYS  48  37.149  -5.380  14.004
  330    HB3  CYS  48           HB1      CYS  48  36.519  -5.848  15.575
  331    H    CYS  49           HN       CYS  49  38.759  -7.280  13.162
  332    HA   CYS  49           HA       CYS  49  37.407  -9.664  13.754
  333    HB2  CYS  49           HB2      CYS  49  37.739  -8.821  11.465
  334    HB3  CYS  49           HB1      CYS  49  39.465  -9.159  11.594
  335    H    PHE  50           HN       PHE  50  40.890  -8.970  13.586
  336    HA   PHE  50           HA       PHE  50  41.533 -11.635  14.514
  337    HB2  PHE  50           HB2      PHE  50  43.147  -9.233  13.700
  338    HB3  PHE  50           HB1      PHE  50  43.916 -10.638  14.446
  339    HD1  PHE  50           HD1      PHE  50  41.826  -9.472  11.609
  340    HD2  PHE  50           HD2      PHE  50  44.249 -12.654  13.171
  341    HE1  PHE  50           HE1      PHE  50  41.774 -10.585   9.399
  342    HE2  PHE  50           HE2      PHE  50  44.200 -13.775  10.957
  343    HZ   PHE  50           HZ       PHE  50  42.965 -12.741   9.072
  344    H    ARG  51           HN       ARG  51  42.568  -8.406  15.622
  345    HA   ARG  51           HA       ARG  51  42.979  -9.356  18.319
  346    HB2  ARG  51           HB2      ARG  51  43.218  -6.624  17.054
  347    HB3  ARG  51           HB1      ARG  51  43.564  -6.949  18.752
  348    HG2  ARG  51           HG2      ARG  51  45.302  -8.530  18.158
  349    HG3  ARG  51           HG1      ARG  51  44.886  -8.406  16.448
  350    HD2  ARG  51           HD2      ARG  51  46.853  -7.024  16.936
  351    HD3  ARG  51           HD1      ARG  51  45.491  -6.004  16.486
  352    HE   ARG  51           HE       ARG  51  45.631  -6.372  19.322
  353   HH11  ARG  51          HH11      ARG  51  47.030  -4.641  16.639
  354   HH12  ARG  51          HH12      ARG  51  47.529  -3.299  17.611
  355   HH21  ARG  51          HH21      ARG  51  46.292  -4.603  20.567
  356   HH22  ARG  51          HH22      ARG  51  47.116  -3.275  19.818
  357    H    SER  52           HN       SER  52  42.024  -8.195  20.191
  358    HA   SER  52           HA       SER  52  39.142  -7.906  19.786
  359    HB2  SER  52           HB2      SER  52  40.836  -8.088  22.283
  360    HB3  SER  52           HB1      SER  52  39.085  -7.895  22.290
  361    HG   SER  52           HG       SER  52  38.981  -9.841  21.055
  362    H    CYS  53           HN       CYS  53  39.120  -5.856  18.748
  363    HA   CYS  53           HA       CYS  53  40.306  -3.543  19.956
  364    HB2  CYS  53           HB2      CYS  53  39.161  -2.283  18.245
  365    HB3  CYS  53           HB1      CYS  53  39.808  -3.749  17.510
  366    H    ASP  54           HN       ASP  54  39.100  -1.691  20.772
  367    HA   ASP  54           HA       ASP  54  36.933  -2.565  22.533
  368    HB2  ASP  54           HB2      ASP  54  38.443   0.057  22.461
  369    HB3  ASP  54           HB1      ASP  54  37.300  -0.448  23.702
  370    H    LEU  55           HN       LEU  55  34.933  -1.544  22.645
  371    HA   LEU  55           HA       LEU  55  33.859  -0.668  20.156
  372    HB2  LEU  55           HB2      LEU  55  32.727  -0.651  22.963
  373    HB3  LEU  55           HB1      LEU  55  31.804  -0.202  21.529
  374    HG   LEU  55           HG       LEU  55  33.222  -2.861  21.833
  375   HD11  LEU  55          HD11      LEU  55  31.420  -2.550  23.532
  376   HD12  LEU  55          HD12      LEU  55  31.041  -3.814  22.362
  377   HD13  LEU  55          HD13      LEU  55  30.282  -2.228  22.223
  378   HD21  LEU  55          HD21      LEU  55  32.842  -2.375  19.525
  379   HD22  LEU  55          HD22      LEU  55  31.248  -1.699  19.853
  380   HD23  LEU  55          HD23      LEU  55  31.516  -3.435  19.997
  381    H    ARG  56           HN       ARG  56  35.095   0.973  22.996
  382    HA   ARG  56           HA       ARG  56  33.991   3.511  22.615
  383    HB2  ARG  56           HB2      ARG  56  35.221   2.887  24.639
  384    HB3  ARG  56           HB1      ARG  56  36.712   2.753  23.709
  385    HG2  ARG  56           HG2      ARG  56  36.643   4.911  24.861
  386    HG3  ARG  56           HG1      ARG  56  36.534   5.165  23.121
  387    HD2  ARG  56           HD2      ARG  56  34.128   5.451  23.258
  388    HD3  ARG  56           HD1      ARG  56  34.134   5.013  24.962
  389    HE   ARG  56           HE       ARG  56  35.832   7.216  24.651
  390   HH11  ARG  56          HH11      ARG  56  32.465   6.401  24.266
  391   HH12  ARG  56          HH12      ARG  56  31.914   8.001  24.624
  392   HH21  ARG  56          HH21      ARG  56  35.085   9.293  25.122
  393   HH22  ARG  56          HH22      ARG  56  33.386   9.630  25.106
  394    H    ARG  57           HN       ARG  57  37.065   2.179  21.405
  395    HA   ARG  57           HA       ARG  57  37.680   4.526  19.874
  396    HB2  ARG  57           HB2      ARG  57  39.504   3.171  18.945
  397    HB3  ARG  57           HB1      ARG  57  39.448   3.041  20.705
  398    HG2  ARG  57           HG2      ARG  57  38.282   0.916  20.556
  399    HG3  ARG  57           HG1      ARG  57  38.187   1.045  18.801
  400    HD2  ARG  57           HD2      ARG  57  40.761   0.924  20.391
  401    HD3  ARG  57           HD1      ARG  57  40.038  -0.439  19.544
  402    HE   ARG  57           HE       ARG  57  40.303   1.608  17.673
  403   HH11  ARG  57          HH11      ARG  57  42.354  -0.325  19.723
  404   HH12  ARG  57          HH12      ARG  57  43.702  -0.254  18.643
  405   HH21  ARG  57          HH21      ARG  57  42.079   1.689  16.284
  406   HH22  ARG  57          HH22      ARG  57  43.550   0.879  16.706
  407    H    LEU  58           HN       LEU  58  35.902   1.601  19.325
  408    HA   LEU  58           HA       LEU  58  35.972   1.497  16.519
  409    HB2  LEU  58           HB2      LEU  58  35.061  -0.275  18.083
  410    HB3  LEU  58           HB1      LEU  58  33.615   0.723  18.246
  411    HG   LEU  58           HG       LEU  58  33.571   0.705  15.652
  412   HD11  LEU  58          HD11      LEU  58  35.142  -1.845  16.074
  413   HD12  LEU  58          HD12      LEU  58  35.909  -0.342  15.579
  414   HD13  LEU  58          HD13      LEU  58  34.693  -1.087  14.549
  415   HD21  LEU  58          HD21      LEU  58  32.495  -1.629  15.712
  416   HD22  LEU  58          HD22      LEU  58  31.846  -0.427  16.824
  417   HD23  LEU  58          HD23      LEU  58  32.950  -1.668  17.415
  418    H    ASP  59           HN       ASP  59  33.967   3.331  18.756
  419    HA   ASP  59           HA       ASP  59  32.025   4.278  17.000
  420    HB2  ASP  59           HB2      ASP  59  32.018   4.574  19.483
  421    HB3  ASP  59           HB1      ASP  59  33.246   5.825  19.289
  422    H    MET  60           HN       MET  60  35.381   5.176  17.321
  423    HA   MET  60           HA       MET  60  35.262   7.734  16.135
  424    HB2  MET  60           HB2      MET  60  37.495   5.690  16.198
  425    HB3  MET  60           HB1      MET  60  37.683   7.340  15.603
  426    HG2  MET  60           HG2      MET  60  36.777   8.129  17.846
  427    HG3  MET  60           HG1      MET  60  36.948   6.466  18.405
  428    HE1  MET  60           HE1      MET  60  38.809   5.114  18.203
  429    HE2  MET  60           HE2      MET  60  40.429   5.617  18.679
  430    HE3  MET  60           HE3      MET  60  40.002   5.545  16.972
  431    H    TYR  61           HN       TYR  61  35.159   4.519  14.796
  432    HA   TYR  61           HA       TYR  61  35.772   5.325  12.083
  433    HB2  TYR  61           HB2      TYR  61  34.362   2.785  12.911
  434    HB3  TYR  61           HB1      TYR  61  35.338   3.082  11.486
  435    HD1  TYR  61           HD1      TYR  61  35.650   0.997  13.937
  436    HD2  TYR  61           HD2      TYR  61  37.581   4.638  12.728
  437    HE1  TYR  61           HE1      TYR  61  37.721   0.285  15.101
  438    HE2  TYR  61           HE2      TYR  61  39.651   3.929  13.889
  439    HH   TYR  61           HH       TYR  61  40.378   0.960  14.691
  440    H    CYS  62           HN       CYS  62  33.119   5.887  14.013
  441    HA   CYS  62           HA       CYS  62  30.999   5.385  12.177
  442    HB2  CYS  62           HB2      CYS  62  31.182   7.323  14.497
  443    HB3  CYS  62           HB1      CYS  62  29.698   6.911  13.642
  444    H    ALA  63           HN       ALA  63  29.974   6.772  10.758
  445    HA   ALA  63           HA       ALA  63  31.610   8.774   9.551
  446    HB1  ALA  63           HB1      ALA  63  28.744   8.600   8.808
  447    HB2  ALA  63           HB2      ALA  63  29.686   7.123   8.606
  448    HB3  ALA  63           HB3      ALA  63  30.180   8.602   7.783
  449    HA   PRO  64           HA       PRO  64  30.321  12.575  11.326
  450    HB2  PRO  64           HB2      PRO  64  29.082  13.343   8.715
  451    HB3  PRO  64           HB1      PRO  64  30.296  14.201   9.682
  452    HG2  PRO  64           HG2      PRO  64  30.968  12.909   7.464
  453    HG3  PRO  64           HG1      PRO  64  32.034  12.931   8.880
  454    HD2  PRO  64           HD2      PRO  64  30.320  10.699   7.854
  455    HD3  PRO  64           HD1      PRO  64  31.884  10.643   8.693
  456    H    LEU  65           HN       LEU  65  28.578  13.247  12.501
  457    HA   LEU  65           HA       LEU  65  25.963  12.061  11.856
  458    HB2  LEU  65           HB2      LEU  65  25.399  12.626  14.210
  459    HB3  LEU  65           HB1      LEU  65  26.799  11.560  14.089
  460    HG   LEU  65           HG       LEU  65  27.713  14.272  13.938
  461   HD11  LEU  65          HD11      LEU  65  26.976  15.132  16.087
  462   HD12  LEU  65          HD12      LEU  65  26.060  13.658  16.401
  463   HD13  LEU  65          HD13      LEU  65  25.549  14.757  15.119
  464   HD21  LEU  65          HD21      LEU  65  28.867  12.138  14.754
  465   HD22  LEU  65          HD22      LEU  65  27.963  12.343  16.257
  466   HD23  LEU  65          HD23      LEU  65  29.116  13.577  15.745
  467    H    LYS  66           HN       LYS  66  27.156  14.491  10.578
  468    HA   LYS  66           HA       LYS  66  25.779  16.763  11.595
  469    HB2  LYS  66           HB2      LYS  66  27.113  16.216   8.948
  470    HB3  LYS  66           HB1      LYS  66  26.383  17.770   9.354
  471    HG2  LYS  66           HG2      LYS  66  27.863  18.027  11.264
  472    HG3  LYS  66           HG1      LYS  66  28.519  16.407  11.022
  473    HD2  LYS  66           HD2      LYS  66  30.089  17.982  10.077
  474    HD3  LYS  66           HD1      LYS  66  29.293  17.151   8.740
  475    HE2  LYS  66           HE2      LYS  66  27.764  19.034   8.433
  476    HE3  LYS  66           HE1      LYS  66  28.465  19.858   9.826
  477    HZ1  LYS  66           HZ1      LYS  66  29.618  19.394   7.166
  478    HZ2  LYS  66           HZ2      LYS  66  30.659  19.517   8.502
  479    HZ3  LYS  66           HZ3      LYS  66  29.621  20.804   8.110
  480    HA   PRO  67           HA       PRO  67  21.701  16.447   9.960
  481    HB2  PRO  67           HB2      PRO  67  22.123  19.064   8.585
  482    HB3  PRO  67           HB1      PRO  67  20.850  18.578   9.722
  483    HG2  PRO  67           HG2      PRO  67  22.810  20.179  10.489
  484    HG3  PRO  67           HG1      PRO  67  22.186  18.919  11.570
  485    HD2  PRO  67           HD2      PRO  67  24.743  18.952   9.995
  486    HD3  PRO  67           HD1      PRO  67  24.418  18.290  11.613
  487    H    ALA  68           HN       ALA  68  20.709  15.616   8.152
  488    HA   ALA  68           HA       ALA  68  22.239  14.831   5.924
  489    HB1  ALA  68           HB1      ALA  68  19.232  15.071   5.955
  490    HB2  ALA  68           HB2      ALA  68  20.089  13.775   6.787
  491    HB3  ALA  68           HB3      ALA  68  20.220  13.936   5.035
  492    H    LYS  69           HN       LYS  69  20.009  17.523   6.409
  493    HA   LYS  69           HA       LYS  69  20.968  18.673   3.858
  494    HB2  LYS  69           HB2      LYS  69  18.180  18.808   5.031
  495    HB3  LYS  69           HB1      LYS  69  18.723  19.727   3.627
  496    HG2  LYS  69           HG2      LYS  69  19.193  17.675   2.405
  497    HG3  LYS  69           HG1      LYS  69  18.811  16.704   3.826
  498    HD2  LYS  69           HD2      LYS  69  16.872  16.669   2.394
  499    HD3  LYS  69           HD1      LYS  69  16.488  17.704   3.772
  500    HE2  LYS  69           HE2      LYS  69  16.991  19.701   2.450
  501    HE3  LYS  69           HE1      LYS  69  17.471  18.700   1.081
  502    HZ1  LYS  69           HZ1      LYS  69  14.802  18.358   2.266
  503    HZ2  LYS  69           HZ2      LYS  69  15.321  18.057   0.675
  504    HZ3  LYS  69           HZ3      LYS  69  15.081  19.653   1.207
  505    H    SER  70           HN       SER  70  21.410  20.858   3.844
  506    HA   SER  70           HA       SER  70  22.242  22.052   6.256
  507    HB2  SER  70           HB2      SER  70  23.194  22.673   4.083
  508    HB3  SER  70           HB1      SER  70  21.645  23.344   3.582
  509    HG   SER  70           HG       SER  70  23.579  24.525   4.941
  510    H    ALA  71           HN       ALA  71  19.336  22.544   4.274
  511    HA   ALA  71           HA       ALA  71  17.757  23.285   6.532
  512    HB1  ALA  71           HB1      ALA  71  17.466  25.591   6.210
  513    HB2  ALA  71           HB2      ALA  71  18.167  25.548   4.593
  514    HB3  ALA  71           HB3      ALA  71  19.203  25.370   6.008
  Start of MODEL   11
    1    H1   GLY   1           HT1      GLY   1  27.911 -17.104  28.734
    2    H2   GLY   1           HT2      GLY   1  28.865 -16.990  27.332
    3    H3   GLY   1           HT3      GLY   1  28.948 -15.778  28.521
    4    HA2  GLY   1           HA2      GLY   1  30.278 -16.972  29.882
    5    HA3  GLY   1           HA1      GLY   1  29.549 -18.497  29.378
    6    H    GLY   2           HN       GLY   2  32.413 -17.377  29.489
    7    HA2  GLY   2           HA2      GLY   2  34.314 -18.084  28.334
    8    HA3  GLY   2           HA1      GLY   2  33.282 -18.629  27.017
    9    HA   PRO   3           HA       PRO   3  35.226 -14.557  25.853
   10    HB2  PRO   3           HB2      PRO   3  36.970 -15.431  23.971
   11    HB3  PRO   3           HB1      PRO   3  37.376 -15.364  25.696
   12    HG2  PRO   3           HG2      PRO   3  36.716 -17.688  23.993
   13    HG3  PRO   3           HG1      PRO   3  37.759 -17.587  25.419
   14    HD2  PRO   3           HD2      PRO   3  35.109 -18.549  25.356
   15    HD3  PRO   3           HD1      PRO   3  36.049 -18.173  26.816
   16    H    GLU   4           HN       GLU   4  35.267 -13.553  23.619
   17    HA   GLU   4           HA       GLU   4  33.898 -14.847  21.474
   18    HB2  GLU   4           HB2      GLU   4  31.888 -13.470  21.476
   19    HB3  GLU   4           HB1      GLU   4  31.997 -14.361  22.994
   20    HG2  GLU   4           HG2      GLU   4  33.012 -12.363  24.069
   21    HG3  GLU   4           HG1      GLU   4  32.812 -11.473  22.560
   22    H    THR   5           HN       THR   5  34.193 -13.773  19.579
   23    HA   THR   5           HA       THR   5  35.380 -11.071  19.695
   24    HB   THR   5           HB       THR   5  36.945 -11.697  17.921
   25    HG1  THR   5           HG1      THR   5  35.936 -14.322  18.263
   26   HG21  THR   5          HG21      THR   5  36.957 -13.615  20.269
   27   HG22  THR   5          HG22      THR   5  37.673 -12.003  20.239
   28   HG23  THR   5          HG23      THR   5  38.339 -13.284  19.226
   29    H    LEU   6           HN       LEU   6  35.207  -9.864  17.661
   30    HA   LEU   6           HA       LEU   6  32.759 -10.619  16.181
   31    HB2  LEU   6           HB2      LEU   6  33.962  -7.874  16.624
   32    HB3  LEU   6           HB1      LEU   6  32.474  -8.218  15.743
   33    HG   LEU   6           HG       LEU   6  32.942  -8.925  18.654
   34   HD11  LEU   6          HD11      LEU   6  31.154  -6.752  17.536
   35   HD12  LEU   6          HD12      LEU   6  32.802  -6.438  18.085
   36   HD13  LEU   6          HD13      LEU   6  31.590  -7.035  19.221
   37   HD21  LEU   6          HD21      LEU   6  30.579  -9.123  16.777
   38   HD22  LEU   6          HD22      LEU   6  30.388  -9.163  18.528
   39   HD23  LEU   6          HD23      LEU   6  31.326 -10.415  17.714
   40    H    CYS   7           HN       CYS   7  32.964 -11.093  14.093
   41    HA   CYS   7           HA       CYS   7  34.862  -9.769  12.382
   42    HB2  CYS   7           HB2      CYS   7  36.315 -11.435  13.533
   43    HB3  CYS   7           HB1      CYS   7  35.283 -12.718  12.901
   44    H    GLY   8           HN       GLY   8  34.244  -9.895  10.272
   45    HA2  GLY   8           HA2      GLY   8  33.204 -10.839   8.379
   46    HA3  GLY   8           HA1      GLY   8  32.390 -11.996   9.427
   47    H    ALA   9           HN       ALA   9  30.323 -11.629   8.676
   48    HA   ALA   9           HA       ALA   9  29.153  -9.117   8.204
   49    HB1  ALA   9           HB1      ALA   9  28.071 -11.857   8.763
   50    HB2  ALA   9           HB2      ALA   9  27.954 -10.891   7.294
   51    HB3  ALA   9           HB3      ALA   9  26.975 -10.478   8.702
   52    H    GLU  10           HN       GLU  10  29.351 -11.097  11.130
   53    HA   GLU  10           HA       GLU  10  27.576  -9.643  12.740
   54    HB2  GLU  10           HB2      GLU  10  28.466 -11.834  13.390
   55    HB3  GLU  10           HB1      GLU  10  30.081 -11.143  13.541
   56    HG2  GLU  10           HG2      GLU  10  29.015 -11.285  15.744
   57    HG3  GLU  10           HG1      GLU  10  29.243  -9.603  15.286
   58    H    LEU  11           HN       LEU  11  31.051  -9.230  12.157
   59    HA   LEU  11           HA       LEU  11  31.458  -7.132  13.992
   60    HB2  LEU  11           HB2      LEU  11  33.330  -8.347  13.020
   61    HB3  LEU  11           HB1      LEU  11  32.907  -7.765  11.410
   62    HG   LEU  11           HG       LEU  11  33.302  -5.438  12.148
   63   HD11  LEU  11          HD11      LEU  11  33.952  -6.813  14.763
   64   HD12  LEU  11          HD12      LEU  11  32.761  -5.546  14.478
   65   HD13  LEU  11          HD13      LEU  11  34.482  -5.172  14.394
   66   HD21  LEU  11          HD21      LEU  11  35.165  -6.718  11.175
   67   HD22  LEU  11          HD22      LEU  11  35.591  -7.325  12.775
   68   HD23  LEU  11          HD23      LEU  11  35.745  -5.607  12.413
   69    H    VAL  12           HN       VAL  12  30.591  -7.126  10.553
   70    HA   VAL  12           HA       VAL  12  30.662  -4.361  10.146
   71    HB   VAL  12           HB       VAL  12  29.152  -6.595   8.813
   72   HG11  VAL  12          HG11      VAL  12  29.037  -3.604   8.277
   73   HG12  VAL  12          HG12      VAL  12  27.683  -4.710   8.512
   74   HG13  VAL  12          HG13      VAL  12  28.645  -4.799   7.039
   75   HG21  VAL  12          HG21      VAL  12  31.450  -4.768   8.047
   76   HG22  VAL  12          HG22      VAL  12  30.685  -5.908   6.939
   77   HG23  VAL  12          HG23      VAL  12  31.526  -6.501   8.371
   78    H    ASP  13           HN       ASP  13  28.023  -6.489  11.182
   79    HA   ASP  13           HA       ASP  13  25.970  -4.576  11.258
   80    HB2  ASP  13           HB2      ASP  13  25.585  -7.007  11.446
   81    HB3  ASP  13           HB1      ASP  13  26.338  -6.995  13.039
   82    H    ALA  14           HN       ALA  14  28.376  -5.517  13.683
   83    HA   ALA  14           HA       ALA  14  27.372  -4.033  15.847
   84    HB1  ALA  14           HB1      ALA  14  29.352  -5.759  15.680
   85    HB2  ALA  14           HB2      ALA  14  29.387  -4.485  16.901
   86    HB3  ALA  14           HB3      ALA  14  30.324  -4.312  15.416
   87    H    LEU  15           HN       LEU  15  29.573  -3.122  13.214
   88    HA   LEU  15           HA       LEU  15  30.258  -0.563  14.167
   89    HB2  LEU  15           HB2      LEU  15  30.084  -1.713  11.381
   90    HB3  LEU  15           HB1      LEU  15  30.668  -0.078  11.697
   91    HG   LEU  15           HG       LEU  15  31.821  -2.526  13.059
   92   HD11  LEU  15          HD11      LEU  15  32.041  -2.487  10.492
   93   HD12  LEU  15          HD12      LEU  15  33.540  -2.598  11.413
   94   HD13  LEU  15          HD13      LEU  15  33.049  -1.054  10.714
   95   HD21  LEU  15          HD21      LEU  15  32.648   0.375  12.754
   96   HD22  LEU  15          HD22      LEU  15  33.759  -0.875  13.312
   97   HD23  LEU  15          HD23      LEU  15  32.318  -0.498  14.250
   98    H    GLN  16           HN       GLN  16  27.597  -1.630  12.069
   99    HA   GLN  16           HA       GLN  16  26.524   0.944  11.579
  100    HB2  GLN  16           HB2      GLN  16  25.949  -1.067  10.251
  101    HB3  GLN  16           HB1      GLN  16  25.084  -1.716  11.644
  102    HG2  GLN  16           HG2      GLN  16  23.603   0.257  11.641
  103    HG3  GLN  16           HG1      GLN  16  24.460   0.895  10.243
  104   HE21  GLN  16          HE21      GLN  16  23.182   0.569   8.417
  105   HE22  GLN  16          HE22      GLN  16  22.317  -0.853   8.080
  106    H    PHE  17           HN       PHE  17  25.878  -1.488  14.077
  107    HA   PHE  17           HA       PHE  17  23.711  -0.189  15.324
  108    HB2  PHE  17           HB2      PHE  17  24.130  -2.455  15.905
  109    HB3  PHE  17           HB1      PHE  17  25.799  -2.113  16.360
  110    HD1  PHE  17           HD1      PHE  17  22.247  -1.704  17.335
  111    HD2  PHE  17           HD2      PHE  17  26.352  -1.111  18.490
  112    HE1  PHE  17           HE1      PHE  17  21.525  -1.224  19.660
  113    HE2  PHE  17           HE2      PHE  17  25.621  -0.640  20.816
  114    HZ   PHE  17           HZ       PHE  17  23.211  -0.696  21.400
  115    H    VAL  18           HN       VAL  18  27.191  -0.111  16.085
  116    HA   VAL  18           HA       VAL  18  26.994   1.721  18.223
  117    HB   VAL  18           HB       VAL  18  29.293   1.078  16.368
  118   HG11  VAL  18          HG11      VAL  18  29.157   2.734  18.895
  119   HG12  VAL  18          HG12      VAL  18  29.714   3.256  17.304
  120   HG13  VAL  18          HG13      VAL  18  30.663   2.097  18.234
  121   HG21  VAL  18          HG21      VAL  18  30.037  -0.357  18.147
  122   HG22  VAL  18          HG22      VAL  18  28.334  -0.729  17.878
  123   HG23  VAL  18          HG23      VAL  18  28.812   0.272  19.248
  124    H    CYS  19           HN       CYS  19  27.541   2.172  14.754
  125    HA   CYS  19           HA       CYS  19  27.710   5.059  15.046
  126    HB2  CYS  19           HB2      CYS  19  27.662   3.317  12.571
  127    HB3  CYS  19           HB1      CYS  19  27.990   5.047  12.608
  128    H    GLY  20           HN       GLY  20  25.198   3.046  15.287
  129    HA2  GLY  20           HA2      GLY  20  22.948   3.164  14.882
  130    HA3  GLY  20           HA1      GLY  20  23.195   4.901  15.045
  131    H    ASP  21           HN       ASP  21  22.150   5.871  13.430
  132    HA   ASP  21           HA       ASP  21  22.072   4.632  10.778
  133    HB2  ASP  21           HB2      ASP  21  20.434   6.380  10.255
  134    HB3  ASP  21           HB1      ASP  21  19.985   5.521  11.727
  135    H    ARG  22           HN       ARG  22  24.107   6.685  12.425
  136    HA   ARG  22           HA       ARG  22  24.625   8.704  10.520
  137    HB2  ARG  22           HB2      ARG  22  26.342   7.508  12.702
  138    HB3  ARG  22           HB1      ARG  22  26.810   8.906  11.745
  139    HG2  ARG  22           HG2      ARG  22  24.880  10.157  12.519
  140    HG3  ARG  22           HG1      ARG  22  24.248   8.738  13.353
  141    HD2  ARG  22           HD2      ARG  22  26.918  10.017  13.979
  142    HD3  ARG  22           HD1      ARG  22  25.431  10.359  14.862
  143    HE   ARG  22           HE       ARG  22  25.768   7.583  14.862
  144   HH11  ARG  22          HH11      ARG  22  27.387  10.442  16.015
  145   HH12  ARG  22          HH12      ARG  22  28.089   9.646  17.375
  146   HH21  ARG  22          HH21      ARG  22  26.701   6.553  16.658
  147   HH22  ARG  22          HH22      ARG  22  27.704   7.455  17.743
  148    H    GLY  23           HN       GLY  23  25.946   5.466  11.043
  149    HA2  GLY  23           HA2      GLY  23  26.797   4.076   9.318
  150    HA3  GLY  23           HA1      GLY  23  27.000   5.497   8.296
  151    H    PHE  24           HN       PHE  24  29.105   4.048   8.145
  152    HA   PHE  24           HA       PHE  24  31.129   5.439   9.729
  153    HB2  PHE  24           HB2      PHE  24  32.288   3.245  10.179
  154    HB3  PHE  24           HB1      PHE  24  30.791   3.483  11.079
  155    HD1  PHE  24           HD1      PHE  24  32.433   1.633   8.357
  156    HD2  PHE  24           HD2      PHE  24  28.760   2.248  10.498
  157    HE1  PHE  24           HE1      PHE  24  31.497  -0.430   7.360
  158    HE2  PHE  24           HE2      PHE  24  27.827   0.180   9.503
  159    HZ   PHE  24           HZ       PHE  24  29.201  -1.159   7.930
  160    H    TYR  25           HN       TYR  25  33.354   4.945   8.908
  161    HA   TYR  25           HA       TYR  25  33.316   4.256   6.032
  162    HB2  TYR  25           HB2      TYR  25  34.812   6.116   5.558
  163    HB3  TYR  25           HB1      TYR  25  33.364   6.731   6.353
  164    HD1  TYR  25           HD1      TYR  25  36.951   5.972   6.772
  165    HD2  TYR  25           HD2      TYR  25  33.440   7.601   8.616
  166    HE1  TYR  25           HE1      TYR  25  38.351   6.935   8.566
  167    HE2  TYR  25           HE2      TYR  25  34.839   8.578  10.420
  168    HH   TYR  25           HH       TYR  25  37.887   7.640  11.083
  169    H    PHE  26           HN       PHE  26  35.566   3.862   5.197
  170    HA   PHE  26           HA       PHE  26  37.164   2.472   7.260
  171    HB2  PHE  26           HB2      PHE  26  36.887   1.877   4.301
  172    HB3  PHE  26           HB1      PHE  26  37.950   1.012   5.412
  173    HD1  PHE  26           HD1      PHE  26  34.473   1.589   4.378
  174    HD2  PHE  26           HD2      PHE  26  37.029  -0.421   7.179
  175    HE1  PHE  26           HE1      PHE  26  32.584   0.134   5.057
  176    HE2  PHE  26           HE2      PHE  26  35.140  -1.876   7.863
  177    HZ   PHE  26           HZ       PHE  26  32.918  -1.598   6.800
  178    H    ASN  27           HN       ASN  27  37.136   4.978   4.924
  179    HA   ASN  27           HA       ASN  27  40.078   5.110   4.882
  180    HB2  ASN  27           HB2      ASN  27  37.954   6.406   3.163
  181    HB3  ASN  27           HB1      ASN  27  39.663   6.828   3.072
  182   HD21  ASN  27          HD21      ASN  27  38.102   5.560   0.916
  183   HD22  ASN  27          HD22      ASN  27  38.820   4.049   0.626
  184    H    LYS  28           HN       LYS  28  40.972   6.380   6.356
  185    HA   LYS  28           HA       LYS  28  39.469   8.328   7.797
  186    HB2  LYS  28           HB2      LYS  28  42.405   7.624   7.798
  187    HB3  LYS  28           HB1      LYS  28  41.703   8.837   8.862
  188    HG2  LYS  28           HG2      LYS  28  40.170   7.159   9.797
  189    HG3  LYS  28           HG1      LYS  28  40.838   5.936   8.715
  190    HD2  LYS  28           HD2      LYS  28  43.057   6.226   9.750
  191    HD3  LYS  28           HD1      LYS  28  42.396   7.453  10.832
  192    HE2  LYS  28           HE2      LYS  28  40.845   5.793  11.783
  193    HE3  LYS  28           HE1      LYS  28  41.485   4.563  10.693
  194    HZ1  LYS  28           HZ1      LYS  28  43.071   6.043  12.722
  195    HZ2  LYS  28           HZ2      LYS  28  43.648   4.812  11.702
  196    HZ3  LYS  28           HZ3      LYS  28  42.496   4.457  12.899
  197    HA   PRO  29           HA       PRO  29  40.083  12.065   5.549
  198    HB2  PRO  29           HB2      PRO  29  41.414  13.198   7.976
  199    HB3  PRO  29           HB1      PRO  29  40.037  13.822   7.048
  200    HG2  PRO  29           HG2      PRO  29  39.683  12.668   9.408
  201    HG3  PRO  29           HG1      PRO  29  38.528  12.424   8.084
  202    HD2  PRO  29           HD2      PRO  29  40.592  10.552   9.154
  203    HD3  PRO  29           HD1      PRO  29  38.988  10.206   8.472
  204    H    THR  30           HN       THR  30  42.850  10.990   7.502
  205    HA   THR  30           HA       THR  30  44.630  11.488   5.236
  206    HB   THR  30           HB       THR  30  44.680  13.577   6.589
  207    HG1  THR  30           HG1      THR  30  46.967  13.533   6.855
  208   HG21  THR  30          HG21      THR  30  44.171  12.510   8.771
  209   HG22  THR  30          HG22      THR  30  45.624  13.508   8.847
  210   HG23  THR  30          HG23      THR  30  45.764  11.751   8.753
  211    H    GLY  31           HN       GLY  31  46.410  10.147   5.202
  212    HA2  GLY  31           HA2      GLY  31  46.525   8.112   7.349
  213    HA3  GLY  31           HA1      GLY  31  46.845   7.763   5.654
  214    H    TYR  32           HN       TYR  32  48.038  10.785   6.718
  215    HA   TYR  32           HA       TYR  32  50.710  10.172   6.141
  216    HB2  TYR  32           HB2      TYR  32  49.908  12.458   6.072
  217    HB3  TYR  32           HB1      TYR  32  49.534  12.409   7.795
  218    HD1  TYR  32           HD1      TYR  32  52.343  12.102   5.353
  219    HD2  TYR  32           HD2      TYR  32  51.185  12.910   9.408
  220    HE1  TYR  32           HE1      TYR  32  54.667  12.789   5.880
  221    HE2  TYR  32           HE2      TYR  32  53.509  13.596   9.936
  222    HH   TYR  32           HH       TYR  32  55.841  14.186   7.527
  223    H    GLY  33           HN       GLY  33  49.077  10.543   9.266
  224    HA2  GLY  33           HA2      GLY  33  49.634   9.813  11.383
  225    HA3  GLY  33           HA1      GLY  33  50.430   8.470  10.569
  226    H    SER  34           HN       SER  34  52.416   8.270  11.393
  227    HA   SER  34           HA       SER  34  54.025  10.722  11.784
  228    HB2  SER  34           HB2      SER  34  55.294   9.445  13.465
  229    HB3  SER  34           HB1      SER  34  53.587   9.534  13.885
  230    HG   SER  34           HG       SER  34  53.323   7.450  13.112
  231    H    SER  35           HN       SER  35  53.608   8.763   9.404
  232    HA   SER  35           HA       SER  35  56.402   8.672   8.665
  233    HB2  SER  35           HB2      SER  35  56.132   6.514   9.767
  234    HB3  SER  35           HB1      SER  35  54.688   6.180   8.815
  235    HG   SER  35           HG       SER  35  57.045   5.483   8.165
  236    H    SER  36           HN       SER  36  56.652   8.960   6.529
  237    HA   SER  36           HA       SER  36  54.522   9.807   4.918
  238    HB2  SER  36           HB2      SER  36  56.823  10.527   4.502
  239    HB3  SER  36           HB1      SER  36  57.264   8.877   4.076
  240    HG   SER  36           HG       SER  36  55.944  10.795   2.625
  241    H    ARG  37           HN       ARG  37  56.230   6.753   5.059
  242    HA   ARG  37           HA       ARG  37  54.930   5.504   2.876
  243    HB2  ARG  37           HB2      ARG  37  57.010   4.632   3.891
  244    HB3  ARG  37           HB1      ARG  37  56.105   4.203   5.343
  245    HG2  ARG  37           HG2      ARG  37  54.720   2.653   4.094
  246    HG3  ARG  37           HG1      ARG  37  55.446   3.169   2.571
  247    HD2  ARG  37           HD2      ARG  37  56.984   1.904   4.850
  248    HD3  ARG  37           HD1      ARG  37  56.393   1.025   3.443
  249    HE   ARG  37           HE       ARG  37  57.886   3.175   2.479
  250   HH11  ARG  37          HH11      ARG  37  58.339   0.336   4.441
  251   HH12  ARG  37          HH12      ARG  37  59.989   0.130   3.982
  252   HH21  ARG  37          HH21      ARG  37  60.059   2.887   1.884
  253   HH22  ARG  37          HH22      ARG  37  60.964   1.564   2.541
  254    H    ARG  38           HN       ARG  38  52.981   4.569   2.678
  255    HA   ARG  38           HA       ARG  38  51.336   4.295   5.127
  256    HB2  ARG  38           HB2      ARG  38  50.506   5.061   2.319
  257    HB3  ARG  38           HB1      ARG  38  49.375   4.698   3.624
  258    HG2  ARG  38           HG2      ARG  38  50.311   6.521   4.974
  259    HG3  ARG  38           HG1      ARG  38  51.492   6.867   3.709
  260    HD2  ARG  38           HD2      ARG  38  49.668   7.390   2.139
  261    HD3  ARG  38           HD1      ARG  38  48.481   7.029   3.385
  262    HE   ARG  38           HE       ARG  38  48.941   9.096   4.352
  263   HH11  ARG  38          HH11      ARG  38  51.385   8.242   2.022
  264   HH12  ARG  38          HH12      ARG  38  52.138   9.792   2.064
  265   HH21  ARG  38          HH21      ARG  38  49.954  11.128   4.397
  266   HH22  ARG  38          HH22      ARG  38  51.339  11.420   3.400
  267    H    ALA  39           HN       ALA  39  50.314   2.391   5.470
  268    HA   ALA  39           HA       ALA  39  50.400   0.362   3.327
  269    HB1  ALA  39           HB1      ALA  39  50.894  -1.328   5.140
  270    HB2  ALA  39           HB2      ALA  39  51.228   0.029   6.215
  271    HB3  ALA  39           HB3      ALA  39  52.218  -0.221   4.776
  272    HA   PRO  40           HA       PRO  40  46.220   0.654   5.324
  273    HB2  PRO  40           HB2      PRO  40  44.805   1.285   3.083
  274    HB3  PRO  40           HB1      PRO  40  45.594   2.504   4.096
  275    HG2  PRO  40           HG2      PRO  40  46.421   1.392   1.476
  276    HG3  PRO  40           HG1      PRO  40  46.641   3.018   2.138
  277    HD2  PRO  40           HD2      PRO  40  48.613   1.034   2.054
  278    HD3  PRO  40           HD1      PRO  40  48.653   2.479   3.087
  279    H    GLN  41           HN       GLN  41  47.297  -1.734   5.021
  280    HA   GLN  41           HA       GLN  41  45.524  -3.232   3.189
  281    HB2  GLN  41           HB2      GLN  41  48.275  -3.895   4.251
  282    HB3  GLN  41           HB1      GLN  41  47.251  -5.057   3.408
  283    HG2  GLN  41           HG2      GLN  41  47.213  -3.685   1.418
  284    HG3  GLN  41           HG1      GLN  41  48.035  -2.370   2.255
  285   HE21  GLN  41          HE21      GLN  41  48.925  -3.983  -0.157
  286   HE22  GLN  41          HE22      GLN  41  50.442  -4.609   0.278
  287    H    THR  42           HN       THR  42  45.258  -2.251   6.119
  288    HA   THR  42           HA       THR  42  44.709  -4.876   7.339
  289    HB   THR  42           HB       THR  42  44.684  -3.567   9.494
  290    HG1  THR  42           HG1      THR  42  45.314  -1.498   9.454
  291   HG21  THR  42          HG21      THR  42  46.660  -4.861   8.681
  292   HG22  THR  42          HG22      THR  42  47.112  -3.458   9.649
  293   HG23  THR  42          HG23      THR  42  47.251  -3.398   7.892
  294    H    GLY  43           HN       GLY  43  43.427  -1.663   8.073
  295    HA2  GLY  43           HA2      GLY  43  41.250  -0.842   7.671
  296    HA3  GLY  43           HA1      GLY  43  40.756  -2.462   7.188
  297    H    ILE  44           HN       ILE  44  39.245  -0.916   8.949
  298    HA   ILE  44           HA       ILE  44  39.756  -1.457  11.688
  299    HB   ILE  44           HB       ILE  44  37.439  -0.787  12.049
  300   HG12  ILE  44          HG12      ILE  44  37.191  -0.914   9.031
  301   HG13  ILE  44          HG11      ILE  44  36.449  -2.045  10.156
  302   HG21  ILE  44          HG21      ILE  44  38.642   0.850   9.805
  303   HG22  ILE  44          HG22      ILE  44  39.200   0.923  11.477
  304   HG23  ILE  44          HG23      ILE  44  37.557   1.425  11.071
  305   HD11  ILE  44          HD11      ILE  44  35.854   0.894   9.845
  306   HD12  ILE  44          HD12      ILE  44  35.327  -0.040  11.247
  307   HD13  ILE  44          HD13      ILE  44  34.752  -0.467   9.636
  308    H    VAL  45           HN       VAL  45  38.208  -3.260   9.125
  309    HA   VAL  45           HA       VAL  45  36.800  -5.137  10.682
  310    HB   VAL  45           HB       VAL  45  38.009  -5.319   7.920
  311   HG11  VAL  45          HG11      VAL  45  36.283  -7.292   9.443
  312   HG12  VAL  45          HG12      VAL  45  37.878  -7.591   8.743
  313   HG13  VAL  45          HG13      VAL  45  36.485  -7.327   7.692
  314   HG21  VAL  45          HG21      VAL  45  35.544  -5.224   7.323
  315   HG22  VAL  45          HG22      VAL  45  36.178  -3.752   8.055
  316   HG23  VAL  45          HG23      VAL  45  35.217  -4.872   9.019
  317    H    ASP  46           HN       ASP  46  40.064  -5.279   9.289
  318    HA   ASP  46           HA       ASP  46  40.713  -7.828  10.312
  319    HB2  ASP  46           HB2      ASP  46  42.420  -5.501   9.417
  320    HB3  ASP  46           HB1      ASP  46  43.102  -7.043   9.936
  321    H    GLU  47           HN       GLU  47  41.090  -4.559  11.613
  322    HA   GLU  47           HA       GLU  47  42.766  -5.191  13.774
  323    HB2  GLU  47           HB2      GLU  47  40.649  -3.052  13.426
  324    HB3  GLU  47           HB1      GLU  47  41.732  -3.119  14.815
  325    HG2  GLU  47           HG2      GLU  47  43.675  -2.890  13.399
  326    HG3  GLU  47           HG1      GLU  47  42.693  -3.050  11.945
  327    H    CYS  48           HN       CYS  48  39.207  -4.917  13.709
  328    HA   CYS  48           HA       CYS  48  38.879  -5.851  16.399
  329    HB2  CYS  48           HB2      CYS  48  36.925  -5.604  14.110
  330    HB3  CYS  48           HB1      CYS  48  36.496  -6.062  15.740
  331    H    CYS  49           HN       CYS  49  38.643  -7.370  13.202
  332    HA   CYS  49           HA       CYS  49  37.631  -9.849  14.002
  333    HB2  CYS  49           HB2      CYS  49  37.756  -9.131  11.647
  334    HB3  CYS  49           HB1      CYS  49  39.514  -9.243  11.706
  335    H    PHE  50           HN       PHE  50  41.016  -8.825  13.545
  336    HA   PHE  50           HA       PHE  50  41.992 -11.332  14.581
  337    HB2  PHE  50           HB2      PHE  50  43.308  -8.811  13.595
  338    HB3  PHE  50           HB1      PHE  50  44.252 -10.104  14.356
  339    HD1  PHE  50           HD1      PHE  50  41.912  -9.289  11.567
  340    HD2  PHE  50           HD2      PHE  50  44.743 -12.106  13.142
  341    HE1  PHE  50           HE1      PHE  50  41.879 -10.501   9.412
  342    HE2  PHE  50           HE2      PHE  50  44.719 -13.330  10.985
  343    HZ   PHE  50           HZ       PHE  50  43.293 -12.532   9.120
  344    H    ARG  51           HN       ARG  51  42.828  -7.983  15.493
  345    HA   ARG  51           HA       ARG  51  43.380  -8.788  18.210
  346    HB2  ARG  51           HB2      ARG  51  43.462  -6.123  16.801
  347    HB3  ARG  51           HB1      ARG  51  43.845  -6.329  18.510
  348    HG2  ARG  51           HG2      ARG  51  45.654  -7.858  17.986
  349    HG3  ARG  51           HG1      ARG  51  45.208  -7.862  16.279
  350    HD2  ARG  51           HD2      ARG  51  46.006  -5.358  17.770
  351    HD3  ARG  51           HD1      ARG  51  47.155  -6.351  16.879
  352    HE   ARG  51           HE       ARG  51  45.053  -5.774  15.133
  353   HH11  ARG  51          HH11      ARG  51  47.503  -4.098  16.953
  354   HH12  ARG  51          HH12      ARG  51  47.635  -2.803  15.818
  355   HH21  ARG  51          HH21      ARG  51  45.243  -4.063  13.652
  356   HH22  ARG  51          HH22      ARG  51  46.365  -2.779  13.956
  357    H    SER  52           HN       SER  52  42.401  -7.652  20.069
  358    HA   SER  52           HA       SER  52  39.502  -7.507  19.741
  359    HB2  SER  52           HB2      SER  52  40.373  -8.804  21.614
  360    HB3  SER  52           HB1      SER  52  41.264  -7.403  22.203
  361    HG   SER  52           HG       SER  52  39.412  -7.340  23.328
  362    H    CYS  53           HN       CYS  53  39.051  -5.557  18.768
  363    HA   CYS  53           HA       CYS  53  40.247  -3.092  19.679
  364    HB2  CYS  53           HB2      CYS  53  38.737  -2.040  18.059
  365    HB3  CYS  53           HB1      CYS  53  39.570  -3.402  17.328
  366    H    ASP  54           HN       ASP  54  39.301  -1.481  20.889
  367    HA   ASP  54           HA       ASP  54  37.266  -2.335  22.751
  368    HB2  ASP  54           HB2      ASP  54  39.307  -0.871  23.275
  369    HB3  ASP  54           HB1      ASP  54  38.401   0.446  22.530
  370    H    LEU  55           HN       LEU  55  35.247  -1.331  23.086
  371    HA   LEU  55           HA       LEU  55  33.810  -0.691  20.736
  372    HB2  LEU  55           HB2      LEU  55  33.141  -0.339  23.665
  373    HB3  LEU  55           HB1      LEU  55  31.997  -0.022  22.361
  374    HG   LEU  55           HG       LEU  55  33.437  -2.666  22.688
  375   HD11  LEU  55          HD11      LEU  55  31.279  -3.491  23.612
  376   HD12  LEU  55          HD12      LEU  55  30.670  -1.836  23.619
  377   HD13  LEU  55          HD13      LEU  55  32.027  -2.281  24.654
  378   HD21  LEU  55          HD21      LEU  55  32.635  -2.370  20.448
  379   HD22  LEU  55          HD22      LEU  55  31.119  -1.665  21.009
  380   HD23  LEU  55          HD23      LEU  55  31.439  -3.382  21.253
  381    H    ARG  56           HN       ARG  56  35.237   1.300  23.282
  382    HA   ARG  56           HA       ARG  56  34.123   3.771  22.568
  383    HB2  ARG  56           HB2      ARG  56  35.383   3.412  24.649
  384    HB3  ARG  56           HB1      ARG  56  36.867   3.203  23.717
  385    HG2  ARG  56           HG2      ARG  56  36.736   5.477  22.885
  386    HG3  ARG  56           HG1      ARG  56  35.155   5.701  23.636
  387    HD2  ARG  56           HD2      ARG  56  37.674   5.056  25.181
  388    HD3  ARG  56           HD1      ARG  56  37.061   6.690  24.946
  389    HE   ARG  56           HE       ARG  56  34.965   5.160  25.991
  390   HH11  ARG  56          HH11      ARG  56  38.148   6.252  26.886
  391   HH12  ARG  56          HH12      ARG  56  37.791   6.297  28.574
  392   HH21  ARG  56          HH21      ARG  56  34.515   5.226  28.216
  393   HH22  ARG  56          HH22      ARG  56  35.748   5.720  29.330
  394    H    ARG  57           HN       ARG  57  37.178   2.225  21.450
  395    HA   ARG  57           HA       ARG  57  37.934   4.315  19.735
  396    HB2  ARG  57           HB2      ARG  57  39.520   2.633  20.503
  397    HB3  ARG  57           HB1      ARG  57  38.607   1.366  19.684
  398    HG2  ARG  57           HG2      ARG  57  39.053   2.365  17.528
  399    HG3  ARG  57           HG1      ARG  57  39.827   3.753  18.288
  400    HD2  ARG  57           HD2      ARG  57  40.786   0.934  18.685
  401    HD3  ARG  57           HD1      ARG  57  41.402   1.962  17.390
  402    HE   ARG  57           HE       ARG  57  41.619   3.365  19.819
  403   HH11  ARG  57          HH11      ARG  57  42.909   0.555  18.217
  404   HH12  ARG  57          HH12      ARG  57  44.429   0.639  19.028
  405   HH21  ARG  57          HH21      ARG  57  43.626   3.459  20.873
  406   HH22  ARG  57          HH22      ARG  57  44.840   2.273  20.526
  407    H    LEU  58           HN       LEU  58  35.976   1.408  19.297
  408    HA   LEU  58           HA       LEU  58  35.740   1.468  16.505
  409    HB2  LEU  58           HB2      LEU  58  34.866  -0.232  18.385
  410    HB3  LEU  58           HB1      LEU  58  33.368   0.659  18.109
  411    HG   LEU  58           HG       LEU  58  33.803   0.278  15.601
  412   HD11  LEU  58          HD11      LEU  58  36.197  -0.453  16.002
  413   HD12  LEU  58          HD12      LEU  58  35.254  -1.566  15.017
  414   HD13  LEU  58          HD13      LEU  58  35.556  -1.928  16.715
  415   HD21  LEU  58          HD21      LEU  58  33.148  -1.965  17.526
  416   HD22  LEU  58          HD22      LEU  58  32.946  -2.114  15.781
  417   HD23  LEU  58          HD23      LEU  58  32.019  -0.909  16.678
  418    H    ASP  59           HN       ASP  59  34.198   3.361  18.984
  419    HA   ASP  59           HA       ASP  59  31.996   4.348  17.526
  420    HB2  ASP  59           HB2      ASP  59  32.382   4.609  20.004
  421    HB3  ASP  59           HB1      ASP  59  33.571   5.854  19.623
  422    H    MET  60           HN       MET  60  35.381   5.292  17.625
  423    HA   MET  60           HA       MET  60  35.077   7.763  16.245
  424    HB2  MET  60           HB2      MET  60  37.454   5.947  16.638
  425    HB3  MET  60           HB1      MET  60  37.552   7.519  15.848
  426    HG2  MET  60           HG2      MET  60  36.508   8.530  17.919
  427    HG3  MET  60           HG1      MET  60  36.683   6.957  18.696
  428    HE1  MET  60           HE1      MET  60  39.213   6.162  19.820
  429    HE2  MET  60           HE2      MET  60  40.369   6.187  18.492
  430    HE3  MET  60           HE3      MET  60  38.733   5.603  18.215
  431    H    TYR  61           HN       TYR  61  34.869   4.534  15.197
  432    HA   TYR  61           HA       TYR  61  35.850   4.935  12.536
  433    HB2  TYR  61           HB2      TYR  61  34.213   2.735  13.820
  434    HB3  TYR  61           HB1      TYR  61  34.729   2.684  12.137
  435    HD1  TYR  61           HD1      TYR  61  37.266   4.467  13.722
  436    HD2  TYR  61           HD2      TYR  61  35.664   0.477  13.561
  437    HE1  TYR  61           HE1      TYR  61  39.415   3.596  14.458
  438    HE2  TYR  61           HE2      TYR  61  37.852  -0.401  14.315
  439    HH   TYR  61           HH       TYR  61  40.017   1.073  15.802
  440    H    CYS  62           HN       CYS  62  33.027   5.818  14.150
  441    HA   CYS  62           HA       CYS  62  31.146   5.533  12.041
  442    HB2  CYS  62           HB2      CYS  62  31.161   7.459  14.379
  443    HB3  CYS  62           HB1      CYS  62  29.768   7.066  13.371
  444    H    ALA  63           HN       ALA  63  30.296   7.171  10.668
  445    HA   ALA  63           HA       ALA  63  32.250   8.865   9.541
  446    HB1  ALA  63           HB1      ALA  63  29.388   8.239   9.009
  447    HB2  ALA  63           HB2      ALA  63  30.772   8.188   7.916
  448    HB3  ALA  63           HB3      ALA  63  30.034   9.735   8.331
  449    HA   PRO  64           HA       PRO  64  31.529  12.578  11.793
  450    HB2  PRO  64           HB2      PRO  64  32.054  14.475   9.912
  451    HB3  PRO  64           HB1      PRO  64  33.317  13.465  10.641
  452    HG2  PRO  64           HG2      PRO  64  32.000  13.233   7.985
  453    HG3  PRO  64           HG1      PRO  64  33.685  12.934   8.445
  454    HD2  PRO  64           HD2      PRO  64  31.808  10.933   8.070
  455    HD3  PRO  64           HD1      PRO  64  33.251  10.750   9.085
  456    H    LEU  65           HN       LEU  65  30.100  14.380  12.080
  457    HA   LEU  65           HA       LEU  65  27.474  13.956  11.000
  458    HB2  LEU  65           HB2      LEU  65  28.550  16.228  12.695
  459    HB3  LEU  65           HB1      LEU  65  26.847  15.884  12.389
  460    HG   LEU  65           HG       LEU  65  28.763  13.926  13.684
  461   HD11  LEU  65          HD11      LEU  65  26.663  15.729  14.927
  462   HD12  LEU  65          HD12      LEU  65  28.409  15.894  15.123
  463   HD13  LEU  65          HD13      LEU  65  27.575  14.484  15.780
  464   HD21  LEU  65          HD21      LEU  65  26.546  12.875  14.356
  465   HD22  LEU  65          HD22      LEU  65  26.928  12.779  12.636
  466   HD23  LEU  65          HD23      LEU  65  25.771  13.977  13.218
  467    H    LYS  66           HN       LYS  66  26.287  15.290   9.637
  468    HA   LYS  66           HA       LYS  66  27.773  16.585   7.595
  469    HB2  LYS  66           HB2      LYS  66  24.814  16.426   8.165
  470    HB3  LYS  66           HB1      LYS  66  25.473  17.245   6.751
  471    HG2  LYS  66           HG2      LYS  66  26.598  15.163   6.060
  472    HG3  LYS  66           HG1      LYS  66  25.945  14.339   7.477
  473    HD2  LYS  66           HD2      LYS  66  23.652  14.796   6.685
  474    HD3  LYS  66           HD1      LYS  66  24.307  15.608   5.262
  475    HE2  LYS  66           HE2      LYS  66  25.425  13.521   4.576
  476    HE3  LYS  66           HE1      LYS  66  24.780  12.705   6.001
  477    HZ1  LYS  66           HZ1      LYS  66  23.054  14.034   3.993
  478    HZ2  LYS  66           HZ2      LYS  66  22.588  12.953   5.218
  479    HZ3  LYS  66           HZ3      LYS  66  23.489  12.398   3.889
  480    HA   PRO  67           HA       PRO  67  27.950  20.704   9.163
  481    HB2  PRO  67           HB2      PRO  67  27.782  22.165   6.854
  482    HB3  PRO  67           HB1      PRO  67  29.226  21.248   7.324
  483    HG2  PRO  67           HG2      PRO  67  27.076  20.533   5.390
  484    HG3  PRO  67           HG1      PRO  67  28.827  20.282   5.278
  485    HD2  PRO  67           HD2      PRO  67  27.092  18.296   5.968
  486    HD3  PRO  67           HD1      PRO  67  28.770  18.354   6.547
  487    H    ALA  68           HN       ALA  68  26.657  22.447   9.771
  488    HA   ALA  68           HA       ALA  68  23.853  22.079   9.700
  489    HB1  ALA  68           HB1      ALA  68  23.709  24.054  10.975
  490    HB2  ALA  68           HB2      ALA  68  25.186  24.717  10.276
  491    HB3  ALA  68           HB3      ALA  68  25.278  23.374  11.415
  492    H    LYS  69           HN       LYS  69  22.260  23.007   8.481
  493    HA   LYS  69           HA       LYS  69  22.994  23.984   5.876
  494    HB2  LYS  69           HB2      LYS  69  20.269  23.865   7.197
  495    HB3  LYS  69           HB1      LYS  69  20.588  24.075   5.475
  496    HG2  LYS  69           HG2      LYS  69  21.432  21.662   7.103
  497    HG3  LYS  69           HG1      LYS  69  20.022  21.717   6.046
  498    HD2  LYS  69           HD2      LYS  69  21.571  22.330   4.150
  499    HD3  LYS  69           HD1      LYS  69  22.926  22.022   5.236
  500    HE2  LYS  69           HE2      LYS  69  20.780  20.008   4.518
  501    HE3  LYS  69           HE1      LYS  69  22.412  20.040   3.850
  502    HZ1  LYS  69           HZ1      LYS  69  23.077  20.024   6.348
  503    HZ2  LYS  69           HZ2      LYS  69  22.655  18.574   5.570
  504    HZ3  LYS  69           HZ3      LYS  69  21.529  19.365   6.568
  505    H    SER  70           HN       SER  70  22.728  26.027   5.027
  506    HA   SER  70           HA       SER  70  23.161  28.223   6.740
  507    HB2  SER  70           HB2      SER  70  22.240  28.115   3.862
  508    HB3  SER  70           HB1      SER  70  22.703  29.596   4.693
  509    HG   SER  70           HG       SER  70  24.753  28.916   4.787
  510    H    ALA  71           HN       ALA  71  20.234  27.007   5.155
  511    HA   ALA  71           HA       ALA  71  18.014  27.567   5.398
  512    HB1  ALA  71           HB1      ALA  71  17.390  28.140   7.813
  513    HB2  ALA  71           HB2      ALA  71  19.104  27.954   8.184
  514    HB3  ALA  71           HB3      ALA  71  18.185  26.589   7.550
  Start of MODEL   12
    1    H1   GLY   1           HT1      GLY   1  30.092 -14.499  24.644
    2    H2   GLY   1           HT2      GLY   1  31.724 -14.670  25.084
    3    H3   GLY   1           HT3      GLY   1  31.051 -15.683  23.898
    4    HA2  GLY   1           HA2      GLY   1  30.713 -13.778  22.437
    5    HA3  GLY   1           HA1      GLY   1  31.456 -12.751  23.664
    6    H    GLY   2           HN       GLY   2  32.458 -13.069  21.022
    7    HA2  GLY   2           HA2      GLY   2  35.196 -13.611  21.573
    8    HA3  GLY   2           HA1      GLY   2  34.484 -14.938  20.661
    9    HA   PRO   3           HA       PRO   3  35.832 -11.462  17.811
   10    HB2  PRO   3           HB2      PRO   3  37.711 -12.873  16.419
   11    HB3  PRO   3           HB1      PRO   3  38.087 -11.935  17.877
   12    HG2  PRO   3           HG2      PRO   3  37.645 -14.864  17.568
   13    HG3  PRO   3           HG1      PRO   3  38.818 -13.995  18.575
   14    HD2  PRO   3           HD2      PRO   3  36.506 -15.068  19.578
   15    HD3  PRO   3           HD1      PRO   3  37.294 -13.638  20.280
   16    H    GLU   4           HN       GLU   4  34.626 -14.590  17.596
   17    HA   GLU   4           HA       GLU   4  34.251 -14.727  14.764
   18    HB2  GLU   4           HB2      GLU   4  32.999 -16.282  17.028
   19    HB3  GLU   4           HB1      GLU   4  32.713 -16.629  15.322
   20    HG2  GLU   4           HG2      GLU   4  35.112 -17.011  14.976
   21    HG3  GLU   4           HG1      GLU   4  35.431 -16.619  16.664
   22    H    THR   5           HN       THR   5  32.810 -12.908  17.138
   23    HA   THR   5           HA       THR   5  30.279 -12.687  15.645
   24    HB   THR   5           HB       THR   5  29.340 -11.706  17.692
   25    HG1  THR   5           HG1      THR   5  30.797 -10.842  18.929
   26   HG21  THR   5          HG21      THR   5  29.234 -14.141  17.394
   27   HG22  THR   5          HG22      THR   5  29.452 -13.742  19.098
   28   HG23  THR   5          HG23      THR   5  30.821 -14.312  18.144
   29    H    LEU   6           HN       LEU   6  33.132 -11.325  15.465
   30    HA   LEU   6           HA       LEU   6  32.031  -8.652  14.959
   31    HB2  LEU   6           HB2      LEU   6  34.517  -9.304  16.547
   32    HB3  LEU   6           HB1      LEU   6  34.204  -7.710  15.860
   33    HG   LEU   6           HG       LEU   6  32.245  -9.133  17.677
   34   HD11  LEU   6          HD11      LEU   6  33.082  -7.653  19.466
   35   HD12  LEU   6          HD12      LEU   6  34.318  -7.028  18.373
   36   HD13  LEU   6          HD13      LEU   6  34.362  -8.715  18.882
   37   HD21  LEU   6          HD21      LEU   6  31.512  -6.672  17.955
   38   HD22  LEU   6          HD22      LEU   6  31.144  -7.442  16.414
   39   HD23  LEU   6          HD23      LEU   6  32.514  -6.339  16.543
   40    H    CYS   7           HN       CYS   7  32.660 -10.890  13.204
   41    HA   CYS   7           HA       CYS   7  34.726  -9.568  11.557
   42    HB2  CYS   7           HB2      CYS   7  34.374 -12.537  12.023
   43    HB3  CYS   7           HB1      CYS   7  35.432 -11.843  10.795
   44    H    GLY   8           HN       GLY   8  34.409  -9.646   9.323
   45    HA2  GLY   8           HA2      GLY   8  33.176  -9.645   7.383
   46    HA3  GLY   8           HA1      GLY   8  32.470 -11.147   7.971
   47    H    ALA   9           HN       ALA   9  30.328 -11.003   7.820
   48    HA   ALA   9           HA       ALA   9  28.840  -8.624   7.743
   49    HB1  ALA   9           HB1      ALA   9  28.030 -11.467   8.367
   50    HB2  ALA   9           HB2      ALA   9  27.875 -10.615   6.831
   51    HB3  ALA   9           HB3      ALA   9  26.873 -10.147   8.204
   52    H    GLU  10           HN       GLU  10  29.748 -10.732  10.419
   53    HA   GLU  10           HA       GLU  10  28.018  -9.688  12.379
   54    HB2  GLU  10           HB2      GLU  10  30.780 -10.899  12.629
   55    HB3  GLU  10           HB1      GLU  10  29.722 -10.559  13.993
   56    HG2  GLU  10           HG2      GLU  10  28.908 -12.292  11.651
   57    HG3  GLU  10           HG1      GLU  10  29.595 -12.935  13.142
   58    H    LEU  11           HN       LEU  11  31.247  -8.675  11.323
   59    HA   LEU  11           HA       LEU  11  31.645  -6.689  13.291
   60    HB2  LEU  11           HB2      LEU  11  33.475  -7.553  11.896
   61    HB3  LEU  11           HB1      LEU  11  32.732  -6.840  10.467
   62    HG   LEU  11           HG       LEU  11  32.932  -4.591  11.513
   63   HD11  LEU  11          HD11      LEU  11  34.501  -4.476  13.526
   64   HD12  LEU  11          HD12      LEU  11  34.248  -6.213  13.703
   65   HD13  LEU  11          HD13      LEU  11  32.886  -5.103  13.849
   66   HD21  LEU  11          HD21      LEU  11  35.270  -4.336  11.108
   67   HD22  LEU  11          HD22      LEU  11  34.741  -5.651  10.058
   68   HD23  LEU  11          HD23      LEU  11  35.602  -6.010  11.555
   69    H    VAL  12           HN       VAL  12  30.241  -6.568  10.034
   70    HA   VAL  12           HA       VAL  12  29.849  -3.799   9.897
   71    HB   VAL  12           HB       VAL  12  28.469  -6.131   8.584
   72   HG11  VAL  12          HG11      VAL  12  27.898  -3.155   8.345
   73   HG12  VAL  12          HG12      VAL  12  26.746  -4.449   8.668
   74   HG13  VAL  12          HG13      VAL  12  27.476  -4.301   7.070
   75   HG21  VAL  12          HG21      VAL  12  29.623  -5.201   6.597
   76   HG22  VAL  12          HG22      VAL  12  30.754  -5.620   7.882
   77   HG23  VAL  12          HG23      VAL  12  30.316  -3.933   7.608
   78    H    ASP  13           HN       ASP  13  27.766  -6.405  11.110
   79    HA   ASP  13           HA       ASP  13  25.477  -4.869  11.661
   80    HB2  ASP  13           HB2      ASP  13  25.577  -7.363  11.682
   81    HB3  ASP  13           HB1      ASP  13  26.475  -7.280  13.197
   82    H    ALA  14           HN       ALA  14  28.289  -5.662  13.692
   83    HA   ALA  14           HA       ALA  14  27.397  -4.353  16.032
   84    HB1  ALA  14           HB1      ALA  14  29.542  -4.699  16.873
   85    HB2  ALA  14           HB2      ALA  14  30.301  -4.515  15.289
   86    HB3  ALA  14           HB3      ALA  14  29.398  -5.981  15.670
   87    H    LEU  15           HN       LEU  15  29.258  -3.229  13.235
   88    HA   LEU  15           HA       LEU  15  29.926  -0.673  14.227
   89    HB2  LEU  15           HB2      LEU  15  29.530  -1.722  11.421
   90    HB3  LEU  15           HB1      LEU  15  30.084  -0.084  11.764
   91    HG   LEU  15           HG       LEU  15  31.448  -2.523  12.909
   92   HD11  LEU  15          HD11      LEU  15  32.327  -0.951  10.474
   93   HD12  LEU  15          HD12      LEU  15  31.425  -2.462  10.361
   94   HD13  LEU  15          HD13      LEU  15  33.023  -2.444  11.103
   95   HD21  LEU  15          HD21      LEU  15  33.345  -0.800  13.003
   96   HD22  LEU  15          HD22      LEU  15  31.999  -0.519  14.103
   97   HD23  LEU  15          HD23      LEU  15  32.129   0.417  12.618
   98    H    GLN  16           HN       GLN  16  27.125  -1.821  12.369
   99    HA   GLN  16           HA       GLN  16  25.875   0.718  12.104
  100    HB2  GLN  16           HB2      GLN  16  24.784  -2.101  12.003
  101    HB3  GLN  16           HB1      GLN  16  23.813  -0.667  11.664
  102    HG2  GLN  16           HG2      GLN  16  25.244  -0.047   9.819
  103    HG3  GLN  16           HG1      GLN  16  26.395  -1.319  10.227
  104   HE21  GLN  16          HE21      GLN  16  24.802  -0.957   7.690
  105   HE22  GLN  16          HE22      GLN  16  23.930  -2.403   7.509
  106    H    PHE  17           HN       PHE  17  25.646  -1.866  14.512
  107    HA   PHE  17           HA       PHE  17  23.482  -0.863  15.988
  108    HB2  PHE  17           HB2      PHE  17  24.224  -3.084  16.437
  109    HB3  PHE  17           HB1      PHE  17  25.865  -2.544  16.792
  110    HD1  PHE  17           HD1      PHE  17  22.358  -2.562  18.009
  111    HD2  PHE  17           HD2      PHE  17  26.455  -1.611  18.927
  112    HE1  PHE  17           HE1      PHE  17  21.751  -2.255  20.394
  113    HE2  PHE  17           HE2      PHE  17  25.839  -1.311  21.315
  114    HZ   PHE  17           HZ       PHE  17  23.491  -1.632  22.048
  115    H    VAL  18           HN       VAL  18  26.980  -0.362  16.438
  116    HA   VAL  18           HA       VAL  18  26.766   1.314  18.689
  117    HB   VAL  18           HB       VAL  18  28.916   1.170  16.563
  118   HG11  VAL  18          HG11      VAL  18  28.881   2.458  19.302
  119   HG12  VAL  18          HG12      VAL  18  29.084   3.283  17.757
  120   HG13  VAL  18          HG13      VAL  18  30.342   2.200  18.350
  121   HG21  VAL  18          HG21      VAL  18  28.364  -0.911  17.933
  122   HG22  VAL  18          HG22      VAL  18  28.885  -0.005  19.353
  123   HG23  VAL  18          HG23      VAL  18  30.029  -0.341  18.052
  124    H    CYS  19           HN       CYS  19  27.041   2.090  15.229
  125    HA   CYS  19           HA       CYS  19  26.068   4.813  15.862
  126    HB2  CYS  19           HB2      CYS  19  28.052   4.009  13.719
  127    HB3  CYS  19           HB1      CYS  19  27.428   5.632  13.979
  128    H    GLY  20           HN       GLY  20  24.012   3.442  15.493
  129    HA2  GLY  20           HA2      GLY  20  23.309   2.588  12.890
  130    HA3  GLY  20           HA1      GLY  20  22.179   2.987  14.179
  131    H    ASP  21           HN       ASP  21  22.768   5.657  14.604
  132    HA   ASP  21           HA       ASP  21  21.470   6.844  12.301
  133    HB2  ASP  21           HB2      ASP  21  20.834   7.387  14.663
  134    HB3  ASP  21           HB1      ASP  21  22.396   8.182  14.850
  135    H    ARG  22           HN       ARG  22  24.459   7.482  14.139
  136    HA   ARG  22           HA       ARG  22  25.467   9.447  12.387
  137    HB2  ARG  22           HB2      ARG  22  26.847   7.590  14.330
  138    HB3  ARG  22           HB1      ARG  22  27.683   8.874  13.457
  139    HG2  ARG  22           HG2      ARG  22  26.283  10.561  14.467
  140    HG3  ARG  22           HG1      ARG  22  25.242   9.336  15.191
  141    HD2  ARG  22           HD2      ARG  22  28.191   9.626  15.807
  142    HD3  ARG  22           HD1      ARG  22  26.909  10.327  16.789
  143    HE   ARG  22           HE       ARG  22  26.320   7.613  16.513
  144   HH11  ARG  22          HH11      ARG  22  28.829   9.636  17.816
  145   HH12  ARG  22          HH12      ARG  22  29.270   8.513  19.049
  146   HH21  ARG  22          HH21      ARG  22  26.909   6.144  18.140
  147   HH22  ARG  22          HH22      ARG  22  28.190   6.540  19.238
  148    H    GLY  23           HN       GLY  23  25.908   5.935  12.498
  149    HA2  GLY  23           HA2      GLY  23  26.449   4.476  10.780
  150    HA3  GLY  23           HA1      GLY  23  26.521   5.852   9.682
  151    H    PHE  24           HN       PHE  24  28.431   4.347   9.038
  152    HA   PHE  24           HA       PHE  24  30.846   5.595  10.077
  153    HB2  PHE  24           HB2      PHE  24  31.967   3.458  10.524
  154    HB3  PHE  24           HB1      PHE  24  30.547   3.639  11.554
  155    HD1  PHE  24           HD1      PHE  24  32.112   1.736   8.870
  156    HD2  PHE  24           HD2      PHE  24  28.431   2.434  10.970
  157    HE1  PHE  24           HE1      PHE  24  31.188  -0.370   7.953
  158    HE2  PHE  24           HE2      PHE  24  27.508   0.326  10.053
  159    HZ   PHE  24           HZ       PHE  24  28.887  -1.077   8.545
  160    H    TYR  25           HN       TYR  25  32.729   5.144   8.738
  161    HA   TYR  25           HA       TYR  25  32.235   3.864   6.158
  162    HB2  TYR  25           HB2      TYR  25  32.815   5.818   4.848
  163    HB3  TYR  25           HB1      TYR  25  31.464   6.234   5.903
  164    HD1  TYR  25           HD1      TYR  25  35.057   6.700   5.257
  165    HD2  TYR  25           HD2      TYR  25  31.773   7.702   7.838
  166    HE1  TYR  25           HE1      TYR  25  36.401   8.524   6.257
  167    HE2  TYR  25           HE2      TYR  25  33.117   9.530   8.838
  168    HH   TYR  25           HH       TYR  25  36.452   9.807   8.406
  169    H    PHE  26           HN       PHE  26  34.218   3.685   4.867
  170    HA   PHE  26           HA       PHE  26  36.641   3.771   6.569
  171    HB2  PHE  26           HB2      PHE  26  35.929   1.798   4.379
  172    HB3  PHE  26           HB1      PHE  26  37.447   1.823   5.278
  173    HD1  PHE  26           HD1      PHE  26  33.906   0.944   5.360
  174    HD2  PHE  26           HD2      PHE  26  37.467   1.354   7.725
  175    HE1  PHE  26           HE1      PHE  26  32.858  -0.389   7.170
  176    HE2  PHE  26           HE2      PHE  26  36.420   0.022   9.535
  177    HZ   PHE  26           HZ       PHE  26  34.115  -0.850   9.258
  178    H    ASN  27           HN       ASN  27  38.105   5.188   5.890
  179    HA   ASN  27           HA       ASN  27  38.138   5.935   3.035
  180    HB2  ASN  27           HB2      ASN  27  39.058   8.063   3.713
  181    HB3  ASN  27           HB1      ASN  27  37.591   7.761   4.641
  182   HD21  ASN  27          HD21      ASN  27  39.417   9.562   5.726
  183   HD22  ASN  27          HD22      ASN  27  40.210   8.856   7.051
  184    H    LYS  28           HN       LYS  28  39.516   3.656   4.436
  185    HA   LYS  28           HA       LYS  28  41.574   2.633   4.455
  186    HB2  LYS  28           HB2      LYS  28  42.140   4.624   2.244
  187    HB3  LYS  28           HB1      LYS  28  43.037   3.138   2.563
  188    HG2  LYS  28           HG2      LYS  28  40.075   3.212   1.938
  189    HG3  LYS  28           HG1      LYS  28  41.324   2.911   0.730
  190    HD2  LYS  28           HD2      LYS  28  42.113   0.972   2.085
  191    HD3  LYS  28           HD1      LYS  28  40.779   1.240   3.204
  192    HE2  LYS  28           HE2      LYS  28  39.174   0.947   1.334
  193    HE3  LYS  28           HE1      LYS  28  40.524   0.602   0.255
  194    HZ1  LYS  28           HZ1      LYS  28  39.321  -1.356   1.327
  195    HZ2  LYS  28           HZ2      LYS  28  40.139  -0.925   2.752
  196    HZ3  LYS  28           HZ3      LYS  28  41.016  -1.359   1.364
  197    HA   PRO  29           HA       PRO  29  43.405   6.252   6.791
  198    HB2  PRO  29           HB2      PRO  29  43.131   5.186   9.290
  199    HB3  PRO  29           HB1      PRO  29  41.879   6.175   8.513
  200    HG2  PRO  29           HG2      PRO  29  42.051   3.220   8.810
  201    HG3  PRO  29           HG1      PRO  29  40.641   4.288   8.906
  202    HD2  PRO  29           HD2      PRO  29  41.249   2.781   6.689
  203    HD3  PRO  29           HD1      PRO  29  40.323   4.295   6.622
  204    H    THR  30           HN       THR  30  43.859   2.825   6.656
  205    HA   THR  30           HA       THR  30  46.207   2.527   8.176
  206    HB   THR  30           HB       THR  30  45.326   1.015   5.704
  207    HG1  THR  30           HG1      THR  30  43.809   0.782   7.267
  208   HG21  THR  30          HG21      THR  30  46.751  -0.796   6.803
  209   HG22  THR  30          HG22      THR  30  47.423   0.482   7.816
  210   HG23  THR  30          HG23      THR  30  47.636   0.541   6.066
  211    H    GLY  31           HN       GLY  31  48.287   3.044   7.815
  212    HA2  GLY  31           HA2      GLY  31  49.170   3.695   5.092
  213    HA3  GLY  31           HA1      GLY  31  49.337   4.931   6.335
  214    H    TYR  32           HN       TYR  32  50.619   2.024   5.019
  215    HA   TYR  32           HA       TYR  32  52.230   1.117   7.116
  216    HB2  TYR  32           HB2      TYR  32  52.585   0.995   4.120
  217    HB3  TYR  32           HB1      TYR  32  53.690   0.202   5.243
  218    HD1  TYR  32           HD1      TYR  32  50.264   0.243   3.888
  219    HD2  TYR  32           HD2      TYR  32  52.974  -1.700   6.595
  220    HE1  TYR  32           HE1      TYR  32  48.690  -1.662   4.096
  221    HE2  TYR  32           HE2      TYR  32  51.401  -3.605   6.802
  222    HH   TYR  32           HH       TYR  32  48.724  -4.014   4.705
  223    H    GLY  33           HN       GLY  33  52.643   3.762   4.867
  224    HA2  GLY  33           HA2      GLY  33  55.391   4.254   5.197
  225    HA3  GLY  33           HA1      GLY  33  54.187   5.460   4.750
  226    H    SER  34           HN       SER  34  52.580   5.245   7.111
  227    HA   SER  34           HA       SER  34  54.391   6.573   9.027
  228    HB2  SER  34           HB2      SER  34  52.390   7.730   9.848
  229    HB3  SER  34           HB1      SER  34  52.598   7.992   8.119
  230    HG   SER  34           HG       SER  34  50.629   7.257   8.020
  231    H    SER  35           HN       SER  35  53.265   3.613   8.588
  232    HA   SER  35           HA       SER  35  53.088   3.086  11.452
  233    HB2  SER  35           HB2      SER  35  50.762   3.261  10.833
  234    HB3  SER  35           HB1      SER  35  51.016   2.238   9.421
  235    HG   SER  35           HG       SER  35  51.406   0.513  10.777
  236    H    SER  36           HN       SER  36  54.373   1.441  11.949
  237    HA   SER  36           HA       SER  36  55.738  -0.063   9.934
  238    HB2  SER  36           HB2      SER  36  55.629  -0.410  12.939
  239    HB3  SER  36           HB1      SER  36  56.715  -1.290  11.868
  240    HG   SER  36           HG       SER  36  57.554   0.741  11.209
  241    H    ARG  37           HN       ARG  37  55.413  -2.119   9.227
  242    HA   ARG  37           HA       ARG  37  52.839  -3.256   9.368
  243    HB2  ARG  37           HB2      ARG  37  53.778  -5.133   8.175
  244    HB3  ARG  37           HB1      ARG  37  54.514  -3.657   7.548
  245    HG2  ARG  37           HG2      ARG  37  56.454  -4.016   9.076
  246    HG3  ARG  37           HG1      ARG  37  55.735  -5.544   9.585
  247    HD2  ARG  37           HD2      ARG  37  55.813  -6.377   7.288
  248    HD3  ARG  37           HD1      ARG  37  56.480  -4.843   6.737
  249    HE   ARG  37           HE       ARG  37  58.132  -5.884   8.781
  250   HH11  ARG  37          HH11      ARG  37  57.149  -6.479   5.501
  251   HH12  ARG  37          HH12      ARG  37  58.631  -7.245   5.061
  252   HH21  ARG  37          HH21      ARG  37  60.079  -6.891   8.190
  253   HH22  ARG  37          HH22      ARG  37  60.289  -7.479   6.574
  254    H    ARG  38           HN       ARG  38  55.517  -3.428  11.516
  255    HA   ARG  38           HA       ARG  38  55.118  -5.939  12.709
  256    HB2  ARG  38           HB2      ARG  38  57.101  -4.541  13.133
  257    HB3  ARG  38           HB1      ARG  38  56.095  -3.367  13.981
  258    HG2  ARG  38           HG2      ARG  38  55.476  -5.057  15.645
  259    HG3  ARG  38           HG1      ARG  38  56.415  -6.275  14.780
  260    HD2  ARG  38           HD2      ARG  38  58.469  -4.955  15.150
  261    HD3  ARG  38           HD1      ARG  38  57.535  -3.740  16.013
  262    HE   ARG  38           HE       ARG  38  57.474  -5.161  17.858
  263   HH11  ARG  38          HH11      ARG  38  58.512  -6.857  15.000
  264   HH12  ARG  38          HH12      ARG  38  58.964  -8.280  15.856
  265   HH21  ARG  38          HH21      ARG  38  58.073  -7.052  18.970
  266   HH22  ARG  38          HH22      ARG  38  58.718  -8.399  18.095
  267    H    ALA  39           HN       ALA  39  53.690  -2.764  13.405
  268    HA   ALA  39           HA       ALA  39  52.150  -3.709  15.621
  269    HB1  ALA  39           HB1      ALA  39  52.381  -1.168  14.094
  270    HB2  ALA  39           HB2      ALA  39  52.434  -1.448  15.835
  271    HB3  ALA  39           HB3      ALA  39  50.885  -1.431  14.994
  272    HA   PRO  40           HA       PRO  40  48.642  -5.251  13.440
  273    HB2  PRO  40           HB2      PRO  40  46.643  -4.786  15.233
  274    HB3  PRO  40           HB1      PRO  40  47.900  -6.007  15.489
  275    HG2  PRO  40           HG2      PRO  40  47.614  -3.306  16.678
  276    HG3  PRO  40           HG1      PRO  40  48.257  -4.794  17.386
  277    HD2  PRO  40           HD2      PRO  40  49.811  -2.703  16.396
  278    HD3  PRO  40           HD1      PRO  40  50.382  -4.367  16.646
  279    H    GLN  41           HN       GLN  41  49.185  -3.013  12.152
  280    HA   GLN  41           HA       GLN  41  46.722  -1.381  12.170
  281    HB2  GLN  41           HB2      GLN  41  49.461  -0.707  11.069
  282    HB3  GLN  41           HB1      GLN  41  48.051   0.353  11.048
  283    HG2  GLN  41           HG2      GLN  41  49.385  -0.756  13.534
  284    HG3  GLN  41           HG1      GLN  41  49.530   0.898  12.944
  285   HE21  GLN  41          HE21      GLN  41  47.896  -0.885  15.211
  286   HE22  GLN  41          HE22      GLN  41  46.481   0.043  15.335
  287    H    THR  42           HN       THR  42  47.168  -4.027  10.867
  288    HA   THR  42           HA       THR  42  47.544  -3.773   8.102
  289    HB   THR  42           HB       THR  42  45.825  -5.742   9.620
  290    HG1  THR  42           HG1      THR  42  47.629  -6.773   9.958
  291   HG21  THR  42          HG21      THR  42  46.842  -5.679   6.775
  292   HG22  THR  42          HG22      THR  42  45.173  -5.825   7.323
  293   HG23  THR  42          HG23      THR  42  46.298  -7.161   7.559
  294    H    GLY  43           HN       GLY  43  44.574  -3.638  10.031
  295    HA2  GLY  43           HA2      GLY  43  43.324  -1.749   8.323
  296    HA3  GLY  43           HA1      GLY  43  42.714  -3.362   7.973
  297    H    ILE  44           HN       ILE  44  41.130  -1.232   9.015
  298    HA   ILE  44           HA       ILE  44  40.781  -1.335  11.802
  299    HB   ILE  44           HB       ILE  44  38.867  -0.659   9.560
  300   HG12  ILE  44          HG12      ILE  44  40.250   1.130  11.575
  301   HG13  ILE  44          HG11      ILE  44  40.928   0.777   9.988
  302   HG21  ILE  44          HG21      ILE  44  37.501  -1.299  11.412
  303   HG22  ILE  44          HG22      ILE  44  37.583   0.461  11.456
  304   HG23  ILE  44          HG23      ILE  44  38.569  -0.498  12.559
  305   HD11  ILE  44          HD11      ILE  44  38.125   1.862  10.335
  306   HD12  ILE  44          HD12      ILE  44  39.094   1.803   8.862
  307   HD13  ILE  44          HD13      ILE  44  39.531   2.914  10.159
  308    H    VAL  45           HN       VAL  45  39.195  -3.120   9.162
  309    HA   VAL  45           HA       VAL  45  37.405  -4.590  10.759
  310    HB   VAL  45           HB       VAL  45  38.665  -5.178   8.075
  311   HG11  VAL  45          HG11      VAL  45  36.612  -6.722   9.675
  312   HG12  VAL  45          HG12      VAL  45  38.101  -7.331   8.949
  313   HG13  VAL  45          HG13      VAL  45  36.741  -6.864   7.922
  314   HG21  VAL  45          HG21      VAL  45  37.150  -3.300   8.023
  315   HG22  VAL  45          HG22      VAL  45  35.967  -4.156   9.010
  316   HG23  VAL  45          HG23      VAL  45  36.279  -4.682   7.357
  317    H    ASP  46           HN       ASP  46  40.670  -5.377   9.603
  318    HA   ASP  46           HA       ASP  46  40.796  -7.953  10.750
  319    HB2  ASP  46           HB2      ASP  46  42.949  -5.990   9.946
  320    HB3  ASP  46           HB1      ASP  46  43.296  -7.616  10.530
  321    H    GLU  47           HN       GLU  47  41.594  -4.739  11.989
  322    HA   GLU  47           HA       GLU  47  42.995  -5.521  14.287
  323    HB2  GLU  47           HB2      GLU  47  42.897  -3.194  13.491
  324    HB3  GLU  47           HB1      GLU  47  41.178  -3.125  13.881
  325    HG2  GLU  47           HG2      GLU  47  41.642  -3.451  16.237
  326    HG3  GLU  47           HG1      GLU  47  43.356  -3.702  15.904
  327    H    CYS  48           HN       CYS  48  39.533  -4.708  13.968
  328    HA   CYS  48           HA       CYS  48  38.893  -5.550  16.636
  329    HB2  CYS  48           HB2      CYS  48  37.160  -4.975  14.233
  330    HB3  CYS  48           HB1      CYS  48  36.549  -5.360  15.827
  331    H    CYS  49           HN       CYS  49  38.648  -7.034  13.439
  332    HA   CYS  49           HA       CYS  49  37.176  -9.290  14.156
  333    HB2  CYS  49           HB2      CYS  49  37.577  -8.645  11.817
  334    HB3  CYS  49           HB1      CYS  49  39.286  -9.035  12.004
  335    H    PHE  50           HN       PHE  50  40.689  -8.802  14.038
  336    HA   PHE  50           HA       PHE  50  41.155 -11.441  15.142
  337    HB2  PHE  50           HB2      PHE  50  42.954  -9.227  14.182
  338    HB3  PHE  50           HB1      PHE  50  43.601 -10.635  15.038
  339    HD1  PHE  50           HD1      PHE  50  41.665  -9.516  12.057
  340    HD2  PHE  50           HD2      PHE  50  43.768 -12.755  13.938
  341    HE1  PHE  50           HE1      PHE  50  41.555 -10.797   9.942
  342    HE2  PHE  50           HE2      PHE  50  43.664 -14.046  11.824
  343    HZ   PHE  50           HZ       PHE  50  42.562 -13.073   9.827
  344    H    ARG  51           HN       ARG  51  42.389  -8.208  16.023
  345    HA   ARG  51           HA       ARG  51  42.710  -8.996  18.787
  346    HB2  ARG  51           HB2      ARG  51  44.322  -7.488  17.692
  347    HB3  ARG  51           HB1      ARG  51  43.050  -6.283  17.492
  348    HG2  ARG  51           HG2      ARG  51  42.764  -6.118  19.906
  349    HG3  ARG  51           HG1      ARG  51  43.927  -7.420  20.163
  350    HD2  ARG  51           HD2      ARG  51  45.700  -6.051  19.140
  351    HD3  ARG  51           HD1      ARG  51  44.544  -4.755  18.852
  352    HE   ARG  51           HE       ARG  51  44.707  -4.180  21.101
  353   HH11  ARG  51          HH11      ARG  51  46.025  -7.348  20.526
  354   HH12  ARG  51          HH12      ARG  51  46.680  -7.501  22.112
  355   HH21  ARG  51          HH21      ARG  51  45.574  -4.399  23.189
  356   HH22  ARG  51          HH22      ARG  51  46.429  -5.843  23.621
  357    H    SER  52           HN       SER  52  41.602  -8.089  20.566
  358    HA   SER  52           HA       SER  52  38.826  -7.443  20.034
  359    HB2  SER  52           HB2      SER  52  39.306  -8.904  21.899
  360    HB3  SER  52           HB1      SER  52  40.410  -7.724  22.600
  361    HG   SER  52           HG       SER  52  38.760  -6.624  23.335
  362    H    CYS  53           HN       CYS  53  38.941  -5.413  19.005
  363    HA   CYS  53           HA       CYS  53  40.276  -3.176  20.221
  364    HB2  CYS  53           HB2      CYS  53  39.276  -1.869  18.447
  365    HB3  CYS  53           HB1      CYS  53  39.857  -3.384  17.764
  366    H    ASP  54           HN       ASP  54  39.405  -1.501  21.393
  367    HA   ASP  54           HA       ASP  54  37.166  -2.083  23.039
  368    HB2  ASP  54           HB2      ASP  54  38.794   0.420  22.599
  369    HB3  ASP  54           HB1      ASP  54  37.457   0.346  23.746
  370    H    LEU  55           HN       LEU  55  35.140  -1.050  23.147
  371    HA   LEU  55           HA       LEU  55  33.856  -0.617  20.665
  372    HB2  LEU  55           HB2      LEU  55  33.034   0.027  23.507
  373    HB3  LEU  55           HB1      LEU  55  31.970   0.256  22.118
  374    HG   LEU  55           HG       LEU  55  33.307  -2.382  22.769
  375   HD11  LEU  55          HD11      LEU  55  31.764  -1.729  24.585
  376   HD12  LEU  55          HD12      LEU  55  31.109  -3.075  23.652
  377   HD13  LEU  55          HD13      LEU  55  30.490  -1.443  23.399
  378   HD21  LEU  55          HD21      LEU  55  31.146  -1.477  20.847
  379   HD22  LEU  55          HD22      LEU  55  31.377  -3.173  21.273
  380   HD23  LEU  55          HD23      LEU  55  32.666  -2.287  20.467
  381    H    ARG  56           HN       ARG  56  35.213   1.588  23.064
  382    HA   ARG  56           HA       ARG  56  34.205   3.986  22.019
  383    HB2  ARG  56           HB2      ARG  56  35.288   3.874  24.213
  384    HB3  ARG  56           HB1      ARG  56  36.825   3.468  23.450
  385    HG2  ARG  56           HG2      ARG  56  36.781   5.856  23.988
  386    HG3  ARG  56           HG1      ARG  56  36.767   5.646  22.242
  387    HD2  ARG  56           HD2      ARG  56  34.376   6.014  22.151
  388    HD3  ARG  56           HD1      ARG  56  34.274   6.038  23.908
  389    HE   ARG  56           HE       ARG  56  36.053   8.039  23.257
  390   HH11  ARG  56          HH11      ARG  56  32.782   7.189  22.442
  391   HH12  ARG  56          HH12      ARG  56  32.281   8.823  22.212
  392   HH21  ARG  56          HH21      ARG  56  35.380  10.185  22.954
  393   HH22  ARG  56          HH22      ARG  56  33.742  10.519  22.500
  394    H    ARG  57           HN       ARG  57  37.244   2.228  21.293
  395    HA   ARG  57           HA       ARG  57  38.262   4.084  19.452
  396    HB2  ARG  57           HB2      ARG  57  39.657   2.349  20.453
  397    HB3  ARG  57           HB1      ARG  57  38.688   1.094  19.677
  398    HG2  ARG  57           HG2      ARG  57  39.319   1.972  17.465
  399    HG3  ARG  57           HG1      ARG  57  40.280   3.228  18.240
  400    HD2  ARG  57           HD2      ARG  57  40.725   0.292  18.742
  401    HD3  ARG  57           HD1      ARG  57  41.564   1.162  17.460
  402    HE   ARG  57           HE       ARG  57  42.064   1.371  20.306
  403   HH11  ARG  57          HH11      ARG  57  42.323   2.876  17.178
  404   HH12  ARG  57          HH12      ARG  57  43.643   3.883  17.633
  405   HH21  ARG  57          HH21      ARG  57  43.804   2.712  20.890
  406   HH22  ARG  57          HH22      ARG  57  44.483   3.798  19.726
  407    H    LEU  58           HN       LEU  58  36.091   1.317  19.124
  408    HA   LEU  58           HA       LEU  58  36.031   1.157  16.327
  409    HB2  LEU  58           HB2      LEU  58  35.053  -0.508  17.951
  410    HB3  LEU  58           HB1      LEU  58  33.702   0.604  18.168
  411    HG   LEU  58           HG       LEU  58  33.445   0.554  15.620
  412   HD11  LEU  58          HD11      LEU  58  34.356  -1.629  14.635
  413   HD12  LEU  58          HD12      LEU  58  35.395  -1.716  16.056
  414   HD13  LEU  58          HD13      LEU  58  35.543  -0.366  14.941
  415   HD21  LEU  58          HD21      LEU  58  31.828  -0.605  16.934
  416   HD22  LEU  58          HD22      LEU  58  32.976  -1.872  17.365
  417   HD23  LEU  58          HD23      LEU  58  32.360  -1.765  15.720
  418    H    ASP  59           HN       ASP  59  34.236   3.180  18.587
  419    HA   ASP  59           HA       ASP  59  32.334   4.221  16.800
  420    HB2  ASP  59           HB2      ASP  59  32.405   4.458  19.340
  421    HB3  ASP  59           HB1      ASP  59  33.552   5.766  19.083
  422    H    MET  60           HN       MET  60  35.715   4.803  17.083
  423    HA   MET  60           HA       MET  60  35.894   7.422  16.097
  424    HB2  MET  60           HB2      MET  60  37.803   5.090  15.851
  425    HB3  MET  60           HB1      MET  60  38.202   6.733  15.396
  426    HG2  MET  60           HG2      MET  60  37.841   7.528  17.657
  427    HG3  MET  60           HG1      MET  60  37.235   5.949  18.156
  428    HE1  MET  60           HE1      MET  60  40.118   8.125  17.064
  429    HE2  MET  60           HE2      MET  60  40.261   6.914  15.792
  430    HE3  MET  60           HE3      MET  60  41.533   7.063  17.000
  431    H    TYR  61           HN       TYR  61  35.395   4.352  14.495
  432    HA   TYR  61           HA       TYR  61  35.907   5.366  11.831
  433    HB2  TYR  61           HB2      TYR  61  34.391   2.857  12.521
  434    HB3  TYR  61           HB1      TYR  61  35.325   3.211  11.083
  435    HD1  TYR  61           HD1      TYR  61  35.455   1.289  13.904
  436    HD2  TYR  61           HD2      TYR  61  37.848   4.165  11.792
  437    HE1  TYR  61           HE1      TYR  61  37.502   0.354  14.953
  438    HE2  TYR  61           HE2      TYR  61  39.893   3.231  12.842
  439    HH   TYR  61           HH       TYR  61  39.979   1.487  15.467
  440    H    CYS  62           HN       CYS  62  33.488   6.034  13.940
  441    HA   CYS  62           HA       CYS  62  31.253   5.841  12.118
  442    HB2  CYS  62           HB2      CYS  62  31.542   7.097  14.851
  443    HB3  CYS  62           HB1      CYS  62  30.041   7.030  13.952
  444    H    ALA  63           HN       ALA  63  30.097   7.670  11.307
  445    HA   ALA  63           HA       ALA  63  31.754   9.751  10.348
  446    HB1  ALA  63           HB1      ALA  63  28.885   8.998  10.076
  447    HB2  ALA  63           HB2      ALA  63  30.089   9.307   8.826
  448    HB3  ALA  63           HB3      ALA  63  29.339  10.655   9.679
  449    HA   PRO  64           HA       PRO  64  31.171  12.773  13.487
  450    HB2  PRO  64           HB2      PRO  64  31.246  15.092  12.061
  451    HB3  PRO  64           HB1      PRO  64  32.676  14.075  12.321
  452    HG2  PRO  64           HG2      PRO  64  30.930  14.314   9.926
  453    HG3  PRO  64           HG1      PRO  64  32.687  14.105  10.030
  454    HD2  PRO  64           HD2      PRO  64  30.926  12.045   9.480
  455    HD3  PRO  64           HD1      PRO  64  32.527  11.795  10.198
  456    H    LEU  65           HN       LEU  65  29.704  14.318  14.408
  457    HA   LEU  65           HA       LEU  65  26.969  13.856  13.756
  458    HB2  LEU  65           HB2      LEU  65  28.277  15.895  15.575
  459    HB3  LEU  65           HB1      LEU  65  26.539  15.612  15.486
  460    HG   LEU  65           HG       LEU  65  28.563  13.449  16.122
  461   HD11  LEU  65          HD11      LEU  65  26.917  15.249  17.910
  462   HD12  LEU  65          HD12      LEU  65  28.656  14.962  17.962
  463   HD13  LEU  65          HD13      LEU  65  27.538  13.692  18.460
  464   HD21  LEU  65          HD21      LEU  65  26.395  12.382  17.024
  465   HD22  LEU  65          HD22      LEU  65  26.568  12.469  15.272
  466   HD23  LEU  65          HD23      LEU  65  25.540  13.628  16.114
  467    H    LYS  66           HN       LYS  66  25.463  15.175  12.789
  468    HA   LYS  66           HA       LYS  66  24.731  16.632  11.171
  469    HB2  LYS  66           HB2      LYS  66  25.048  18.123  13.181
  470    HB3  LYS  66           HB1      LYS  66  26.618  18.572  12.516
  471    HG2  LYS  66           HG2      LYS  66  25.089  20.251  11.767
  472    HG3  LYS  66           HG1      LYS  66  25.377  19.207  10.378
  473    HD2  LYS  66           HD2      LYS  66  23.294  18.013  10.775
  474    HD3  LYS  66           HD1      LYS  66  23.029  18.911  12.269
  475    HE2  LYS  66           HE2      LYS  66  22.910  21.012  10.972
  476    HE3  LYS  66           HE1      LYS  66  23.151  20.099   9.482
  477    HZ1  LYS  66           HZ1      LYS  66  21.134  18.806  10.095
  478    HZ2  LYS  66           HZ2      LYS  66  20.833  20.444   9.758
  479    HZ3  LYS  66           HZ3      LYS  66  20.869  19.895  11.365
  480    HA   PRO  67           HA       PRO  67  28.703  16.213   8.739
  481    HB2  PRO  67           HB2      PRO  67  27.831  14.302   7.000
  482    HB3  PRO  67           HB1      PRO  67  28.579  13.919   8.564
  483    HG2  PRO  67           HG2      PRO  67  25.718  13.922   7.781
  484    HG3  PRO  67           HG1      PRO  67  26.591  12.822   8.855
  485    HD2  PRO  67           HD2      PRO  67  24.979  14.872   9.758
  486    HD3  PRO  67           HD1      PRO  67  26.330  14.188  10.691
  487    H    ALA  68           HN       ALA  68  29.024  16.727   6.443
  488    HA   ALA  68           HA       ALA  68  27.362  18.804   5.533
  489    HB1  ALA  68           HB1      ALA  68  28.650  18.304   3.302
  490    HB2  ALA  68           HB2      ALA  68  29.594  17.217   4.322
  491    HB3  ALA  68           HB3      ALA  68  29.522  18.939   4.696
  492    H    LYS  69           HN       LYS  69  27.475  15.373   4.749
  493    HA   LYS  69           HA       LYS  69  25.774  15.399   2.507
  494    HB2  LYS  69           HB2      LYS  69  26.305  13.276   4.594
  495    HB3  LYS  69           HB1      LYS  69  25.326  12.995   3.154
  496    HG2  LYS  69           HG2      LYS  69  27.230  13.645   1.727
  497    HG3  LYS  69           HG1      LYS  69  28.211  13.926   3.165
  498    HD2  LYS  69           HD2      LYS  69  27.929  11.555   3.815
  499    HD3  LYS  69           HD1      LYS  69  26.974  11.278   2.359
  500    HE2  LYS  69           HE2      LYS  69  29.840  12.266   2.377
  501    HE3  LYS  69           HE1      LYS  69  29.355  10.597   2.074
  502    HZ1  LYS  69           HZ1      LYS  69  29.666  11.747   0.002
  503    HZ2  LYS  69           HZ2      LYS  69  28.591  12.976   0.469
  504    HZ3  LYS  69           HZ3      LYS  69  28.018  11.399   0.200
  505    H    SER  70           HN       SER  70  25.071  15.133   5.972
  506    HA   SER  70           HA       SER  70  22.284  14.692   5.713
  507    HB2  SER  70           HB2      SER  70  23.912  15.876   7.968
  508    HB3  SER  70           HB1      SER  70  22.198  15.490   8.088
  509    HG   SER  70           HG       SER  70  22.656  13.364   7.842
  510    H    ALA  71           HN       ALA  71  24.233  17.627   6.006
  511    HA   ALA  71           HA       ALA  71  21.843  19.308   5.878
  512    HB1  ALA  71           HB1      ALA  71  23.728  21.132   5.900
  513    HB2  ALA  71           HB2      ALA  71  24.755  19.790   6.405
  514    HB3  ALA  71           HB3      ALA  71  23.353  20.243   7.377
  Start of MODEL   13
    1    H1   GLY   1           HT1      GLY   1  39.428 -17.093  17.048
    2    H2   GLY   1           HT2      GLY   1  40.940 -16.760  16.347
    3    H3   GLY   1           HT3      GLY   1  39.808 -15.512  16.567
    4    HA2  GLY   1           HA2      GLY   1  41.743 -16.553  18.391
    5    HA3  GLY   1           HA1      GLY   1  40.823 -15.049  18.473
    6    H    GLY   2           HN       GLY   2  38.267 -15.749  18.640
    7    HA2  GLY   2           HA2      GLY   2  37.637 -17.964  20.294
    8    HA3  GLY   2           HA1      GLY   2  37.867 -16.530  21.289
    9    HA   PRO   3           HA       PRO   3  33.546 -16.534  19.499
   10    HB2  PRO   3           HB2      PRO   3  32.138 -17.114  21.748
   11    HB3  PRO   3           HB1      PRO   3  32.811 -18.374  20.693
   12    HG2  PRO   3           HG2      PRO   3  33.782 -17.380  23.309
   13    HG3  PRO   3           HG1      PRO   3  33.841 -19.008  22.619
   14    HD2  PRO   3           HD2      PRO   3  35.969 -17.200  22.669
   15    HD3  PRO   3           HD1      PRO   3  35.871 -18.633  21.624
   16    H    GLU   4           HN       GLU   4  31.671 -15.183  20.321
   17    HA   GLU   4           HA       GLU   4  30.863 -13.112  20.888
   18    HB2  GLU   4           HB2      GLU   4  32.845 -13.495  23.143
   19    HB3  GLU   4           HB1      GLU   4  31.645 -12.204  23.081
   20    HG2  GLU   4           HG2      GLU   4  29.836 -13.848  23.004
   21    HG3  GLU   4           HG1      GLU   4  31.007 -15.166  22.972
   22    H    THR   5           HN       THR   5  32.649 -13.012  18.844
   23    HA   THR   5           HA       THR   5  34.159 -10.534  19.413
   24    HB   THR   5           HB       THR   5  35.891 -11.282  17.849
   25    HG1  THR   5           HG1      THR   5  34.981 -12.643  16.472
   26   HG21  THR   5          HG21      THR   5  35.400 -13.534  19.799
   27   HG22  THR   5          HG22      THR   5  35.888 -11.927  20.341
   28   HG23  THR   5          HG23      THR   5  36.942 -12.858  19.278
   29    H    LEU   6           HN       LEU   6  34.559  -9.213  17.457
   30    HA   LEU   6           HA       LEU   6  32.230  -9.357  15.648
   31    HB2  LEU   6           HB2      LEU   6  34.034  -7.005  16.273
   32    HB3  LEU   6           HB1      LEU   6  32.561  -6.965  15.304
   33    HG   LEU   6           HG       LEU   6  32.699  -7.751  18.231
   34   HD11  LEU   6          HD11      LEU   6  31.719  -5.224  16.871
   35   HD12  LEU   6          HD12      LEU   6  33.116  -5.361  17.934
   36   HD13  LEU   6          HD13      LEU   6  31.491  -5.596  18.578
   37   HD21  LEU   6          HD21      LEU   6  30.429  -7.466  16.247
   38   HD22  LEU   6          HD22      LEU   6  30.168  -7.466  17.991
   39   HD23  LEU   6          HD23      LEU   6  30.857  -8.885  17.203
   40    H    CYS   7           HN       CYS   7  32.577  -9.952  13.621
   41    HA   CYS   7           HA       CYS   7  34.861  -9.078  12.117
   42    HB2  CYS   7           HB2      CYS   7  35.829 -10.975  13.406
   43    HB3  CYS   7           HB1      CYS   7  34.626 -12.042  12.682
   44    H    GLY   8           HN       GLY   8  34.593  -9.349   9.904
   45    HA2  GLY   8           HA2      GLY   8  33.418  -9.581   7.940
   46    HA3  GLY   8           HA1      GLY   8  32.802 -11.079   8.629
   47    H    ALA   9           HN       ALA   9  30.673 -11.125   8.455
   48    HA   ALA   9           HA       ALA   9  28.996  -8.899   8.117
   49    HB1  ALA   9           HB1      ALA   9  28.547 -11.780   8.803
   50    HB2  ALA   9           HB2      ALA   9  28.026 -10.875   7.382
   51    HB3  ALA   9           HB3      ALA   9  27.203 -10.644   8.926
   52    H    GLU  10           HN       GLU  10  29.957 -10.701  11.010
   53    HA   GLU  10           HA       GLU  10  28.116  -9.523  12.796
   54    HB2  GLU  10           HB2      GLU  10  30.867 -10.705  13.209
   55    HB3  GLU  10           HB1      GLU  10  29.850 -10.162  14.539
   56    HG2  GLU  10           HG2      GLU  10  29.079 -12.253  12.482
   57    HG3  GLU  10           HG1      GLU  10  29.594 -12.590  14.132
   58    H    LEU  11           HN       LEU  11  31.350  -8.552  11.738
   59    HA   LEU  11           HA       LEU  11  31.632  -6.365  13.510
   60    HB2  LEU  11           HB2      LEU  11  33.538  -7.310  12.291
   61    HB3  LEU  11           HB1      LEU  11  32.834  -6.782  10.763
   62    HG   LEU  11           HG       LEU  11  32.940  -4.426  11.549
   63   HD11  LEU  11          HD11      LEU  11  34.405  -4.013  13.587
   64   HD12  LEU  11          HD12      LEU  11  34.222  -5.727  13.961
   65   HD13  LEU  11          HD13      LEU  11  32.808  -4.676  13.930
   66   HD21  LEU  11          HD21      LEU  11  35.636  -5.766  11.856
   67   HD22  LEU  11          HD22      LEU  11  35.296  -4.157  11.218
   68   HD23  LEU  11          HD23      LEU  11  34.832  -5.586  10.296
   69    H    VAL  12           HN       VAL  12  30.348  -6.619  10.212
   70    HA   VAL  12           HA       VAL  12  29.924  -3.898   9.757
   71    HB   VAL  12           HB       VAL  12  28.587  -6.380   8.693
   72   HG11  VAL  12          HG11      VAL  12  28.008  -3.462   8.084
   73   HG12  VAL  12          HG12      VAL  12  26.850  -4.712   8.531
   74   HG13  VAL  12          HG13      VAL  12  27.626  -4.754   6.948
   75   HG21  VAL  12          HG21      VAL  12  29.756  -5.557   6.616
   76   HG22  VAL  12          HG22      VAL  12  30.844  -6.004   7.933
   77   HG23  VAL  12          HG23      VAL  12  30.504  -4.304   7.606
   78    H    ASP  13           HN       ASP  13  27.769  -6.351  11.142
   79    HA   ASP  13           HA       ASP  13  25.528  -4.672  11.513
   80    HB2  ASP  13           HB2      ASP  13  25.497  -7.173  11.608
   81    HB3  ASP  13           HB1      ASP  13  26.317  -7.081  13.165
   82    H    ALA  14           HN       ALA  14  28.252  -5.512  13.628
   83    HA   ALA  14           HA       ALA  14  27.360  -4.153  15.926
   84    HB1  ALA  14           HB1      ALA  14  29.452  -4.567  16.810
   85    HB2  ALA  14           HB2      ALA  14  30.276  -4.285  15.275
   86    HB3  ALA  14           HB3      ALA  14  29.388  -5.787  15.538
   87    H    LEU  15           HN       LEU  15  29.260  -3.059  13.143
   88    HA   LEU  15           HA       LEU  15  29.955  -0.514  14.128
   89    HB2  LEU  15           HB2      LEU  15  29.540  -1.569  11.328
   90    HB3  LEU  15           HB1      LEU  15  30.118   0.063  11.658
   91    HG   LEU  15           HG       LEU  15  31.463  -2.369  12.845
   92   HD11  LEU  15          HD11      LEU  15  32.170  -0.916  10.277
   93   HD12  LEU  15          HD12      LEU  15  31.468  -2.533  10.356
   94   HD13  LEU  15          HD13      LEU  15  33.082  -2.238  11.007
   95   HD21  LEU  15          HD21      LEU  15  32.012  -0.256  13.908
   96   HD22  LEU  15          HD22      LEU  15  32.254   0.513  12.344
   97   HD23  LEU  15          HD23      LEU  15  33.378  -0.727  12.899
   98    H    GLN  16           HN       GLN  16  27.135  -1.619  12.264
   99    HA   GLN  16           HA       GLN  16  25.943   0.936  11.975
  100    HB2  GLN  16           HB2      GLN  16  25.325  -1.041  10.612
  101    HB3  GLN  16           HB1      GLN  16  24.585  -1.769  12.040
  102    HG2  GLN  16           HG2      GLN  16  23.018   0.089  12.224
  103    HG3  GLN  16           HG1      GLN  16  23.804   0.921  10.883
  104   HE21  GLN  16          HE21      GLN  16  21.254   0.598  10.280
  105   HE22  GLN  16          HE22      GLN  16  20.959  -0.751   9.293
  106    H    PHE  17           HN       PHE  17  25.579  -1.627  14.402
  107    HA   PHE  17           HA       PHE  17  23.499  -0.431  15.886
  108    HB2  PHE  17           HB2      PHE  17  23.989  -2.723  16.277
  109    HB3  PHE  17           HB1      PHE  17  25.677  -2.371  16.646
  110    HD1  PHE  17           HD1      PHE  17  22.183  -2.033  17.871
  111    HD2  PHE  17           HD2      PHE  17  26.355  -1.541  18.800
  112    HE1  PHE  17           HE1      PHE  17  21.616  -1.709  20.266
  113    HE2  PHE  17           HE2      PHE  17  25.783  -1.228  21.191
  114    HZ   PHE  17           HZ       PHE  17  23.416  -1.312  21.925
  115    H    VAL  18           HN       VAL  18  27.027  -0.357  16.395
  116    HA   VAL  18           HA       VAL  18  26.979   1.272  18.692
  117    HB   VAL  18           HB       VAL  18  29.121   0.861  16.598
  118   HG11  VAL  18          HG11      VAL  18  30.618   1.679  18.499
  119   HG12  VAL  18          HG12      VAL  18  29.148   2.284  19.262
  120   HG13  VAL  18          HG13      VAL  18  29.650   2.910  17.690
  121   HG21  VAL  18          HG21      VAL  18  28.313  -1.120  17.977
  122   HG22  VAL  18          HG22      VAL  18  28.903  -0.265  19.403
  123   HG23  VAL  18          HG23      VAL  18  30.031  -0.746  18.131
  124    H    CYS  19           HN       CYS  19  27.534   2.115  15.273
  125    HA   CYS  19           HA       CYS  19  27.762   4.925  15.744
  126    HB2  CYS  19           HB2      CYS  19  27.128   3.370  13.225
  127    HB3  CYS  19           HB1      CYS  19  27.477   5.090  13.280
  128    H    GLY  20           HN       GLY  20  25.107   2.804  14.852
  129    HA2  GLY  20           HA2      GLY  20  22.828   3.122  14.872
  130    HA3  GLY  20           HA1      GLY  20  23.123   4.499  15.929
  131    H    ASP  21           HN       ASP  21  22.100   6.213  15.099
  132    HA   ASP  21           HA       ASP  21  21.384   6.566  12.408
  133    HB2  ASP  21           HB2      ASP  21  21.693   8.534  14.677
  134    HB3  ASP  21           HB1      ASP  21  21.063   8.984  13.093
  135    H    ARG  22           HN       ARG  22  24.315   7.357  14.143
  136    HA   ARG  22           HA       ARG  22  25.403   9.249  12.356
  137    HB2  ARG  22           HB2      ARG  22  26.721   7.255  14.204
  138    HB3  ARG  22           HB1      ARG  22  27.609   8.479  13.305
  139    HG2  ARG  22           HG2      ARG  22  26.105  10.218  14.348
  140    HG3  ARG  22           HG1      ARG  22  25.455   8.942  15.379
  141    HD2  ARG  22           HD2      ARG  22  28.389   9.665  15.204
  142    HD3  ARG  22           HD1      ARG  22  27.303  10.234  16.469
  143    HE   ARG  22           HE       ARG  22  28.402   7.562  16.189
  144   HH11  ARG  22          HH11      ARG  22  25.878   9.533  17.589
  145   HH12  ARG  22          HH12      ARG  22  25.568   8.426  18.876
  146   HH21  ARG  22          HH21      ARG  22  27.961   6.137  17.883
  147   HH22  ARG  22          HH22      ARG  22  26.732   6.518  19.042
  148    H    GLY  23           HN       GLY  23  25.501   5.705  12.392
  149    HA2  GLY  23           HA2      GLY  23  25.877   4.229  10.646
  150    HA3  GLY  23           HA1      GLY  23  25.983   5.611   9.558
  151    H    PHE  24           HN       PHE  24  27.740   3.909   8.836
  152    HA   PHE  24           HA       PHE  24  30.294   5.012   9.707
  153    HB2  PHE  24           HB2      PHE  24  31.302   2.851  10.177
  154    HB3  PHE  24           HB1      PHE  24  29.897   3.073  11.216
  155    HD1  PHE  24           HD1      PHE  24  31.418   1.055   8.633
  156    HD2  PHE  24           HD2      PHE  24  27.694   2.020  10.543
  157    HE1  PHE  24           HE1      PHE  24  30.404  -1.004   7.705
  158    HE2  PHE  24           HE2      PHE  24  26.684  -0.044   9.619
  159    HZ   PHE  24           HZ       PHE  24  28.039  -1.553   8.198
  160    H    TYR  25           HN       TYR  25  32.072   4.355   8.275
  161    HA   TYR  25           HA       TYR  25  31.307   3.139   5.736
  162    HB2  TYR  25           HB2      TYR  25  32.034   5.019   4.390
  163    HB3  TYR  25           HB1      TYR  25  30.778   5.570   5.498
  164    HD1  TYR  25           HD1      TYR  25  34.380   5.641   4.726
  165    HD2  TYR  25           HD2      TYR  25  31.307   7.026   7.389
  166    HE1  TYR  25           HE1      TYR  25  35.946   7.317   5.658
  167    HE2  TYR  25           HE2      TYR  25  32.876   8.708   8.322
  168    HH   TYR  25           HH       TYR  25  35.206   9.141   8.506
  169    H    PHE  26           HN       PHE  26  33.203   2.793   4.324
  170    HA   PHE  26           HA       PHE  26  35.683   2.555   5.922
  171    HB2  PHE  26           HB2      PHE  26  34.699   0.793   3.664
  172    HB3  PHE  26           HB1      PHE  26  36.229   0.600   4.521
  173    HD1  PHE  26           HD1      PHE  26  32.681  -0.070   4.557
  174    HD2  PHE  26           HD2      PHE  26  36.181   0.192   7.033
  175    HE1  PHE  26           HE1      PHE  26  31.526  -1.370   6.326
  176    HE2  PHE  26           HE2      PHE  26  35.026  -1.107   8.803
  177    HZ   PHE  26           HZ       PHE  26  32.698  -1.889   8.449
  178    H    ASN  27           HN       ASN  27  34.225   3.637   2.959
  179    HA   ASN  27           HA       ASN  27  36.612   5.131   2.291
  180    HB2  ASN  27           HB2      ASN  27  36.996   2.866   1.275
  181    HB3  ASN  27           HB1      ASN  27  35.564   3.131   0.281
  182   HD21  ASN  27          HD21      ASN  27  36.817   3.213  -1.714
  183   HD22  ASN  27          HD22      ASN  27  37.825   4.531  -2.070
  184    H    LYS  28           HN       LYS  28  35.635   7.062   2.143
  185    HA   LYS  28           HA       LYS  28  32.976   7.384   1.163
  186    HB2  LYS  28           HB2      LYS  28  35.157   9.393   1.729
  187    HB3  LYS  28           HB1      LYS  28  33.512   9.831   1.268
  188    HG2  LYS  28           HG2      LYS  28  32.649   8.542   3.210
  189    HG3  LYS  28           HG1      LYS  28  34.308   8.207   3.694
  190    HD2  LYS  28           HD2      LYS  28  33.213  11.006   3.334
  191    HD3  LYS  28           HD1      LYS  28  33.252  10.169   4.886
  192    HE2  LYS  28           HE2      LYS  28  35.722   9.879   4.615
  193    HE3  LYS  28           HE1      LYS  28  35.639  10.849   3.146
  194    HZ1  LYS  28           HZ1      LYS  28  35.151  11.674   5.932
  195    HZ2  LYS  28           HZ2      LYS  28  34.484  12.554   4.641
  196    HZ3  LYS  28           HZ3      LYS  28  36.168  12.380   4.774
  197    HA   PRO  29           HA       PRO  29  33.427   7.762  -3.208
  198    HB2  PRO  29           HB2      PRO  29  32.152  10.459  -2.999
  199    HB3  PRO  29           HB1      PRO  29  31.691   9.068  -3.999
  200    HG2  PRO  29           HG2      PRO  29  30.297   9.697  -1.844
  201    HG3  PRO  29           HG1      PRO  29  30.617   8.000  -2.254
  202    HD2  PRO  29           HD2      PRO  29  31.894   9.703  -0.139
  203    HD3  PRO  29           HD1      PRO  29  31.481   7.972  -0.106
  204    H    THR  30           HN       THR  30  34.154  10.747  -1.401
  205    HA   THR  30           HA       THR  30  36.478  11.178  -3.171
  206    HB   THR  30           HB       THR  30  34.639  13.291  -2.025
  207    HG1  THR  30           HG1      THR  30  33.729  12.345  -3.808
  208   HG21  THR  30          HG21      THR  30  36.082  14.785  -3.490
  209   HG22  THR  30          HG22      THR  30  37.205  13.432  -3.612
  210   HG23  THR  30          HG23      THR  30  36.864  14.155  -2.041
  211    H    GLY  31           HN       GLY  31  38.380  11.376  -2.124
  212    HA2  GLY  31           HA2      GLY  31  39.197  12.733  -0.001
  213    HA3  GLY  31           HA1      GLY  31  38.371  11.396   0.795
  214    H    TYR  32           HN       TYR  32  39.179   9.716  -1.664
  215    HA   TYR  32           HA       TYR  32  41.586   8.689  -0.490
  216    HB2  TYR  32           HB2      TYR  32  39.942   7.149  -1.420
  217    HB3  TYR  32           HB1      TYR  32  40.111   7.901  -3.008
  218    HD1  TYR  32           HD1      TYR  32  41.987   6.048  -0.367
  219    HD2  TYR  32           HD2      TYR  32  41.845   7.256  -4.487
  220    HE1  TYR  32           HE1      TYR  32  43.905   4.558  -0.870
  221    HE2  TYR  32           HE2      TYR  32  43.763   5.767  -4.990
  222    HH   TYR  32           HH       TYR  32  45.775   4.787  -3.478
  223    H    GLY  33           HN       GLY  33  43.592   9.276  -0.957
  224    HA2  GLY  33           HA2      GLY  33  45.431   9.888  -2.244
  225    HA3  GLY  33           HA1      GLY  33  44.371  10.027  -3.643
  226    H    SER  34           HN       SER  34  42.828  11.708  -1.282
  227    HA   SER  34           HA       SER  34  44.142  14.244  -2.040
  228    HB2  SER  34           HB2      SER  34  41.936  15.298  -1.770
  229    HB3  SER  34           HB1      SER  34  41.878  14.014  -2.976
  230    HG   SER  34           HG       SER  34  40.174  13.651  -1.645
  231    H    SER  35           HN       SER  35  43.164  12.165   0.531
  232    HA   SER  35           HA       SER  35  43.376  14.283   2.541
  233    HB2  SER  35           HB2      SER  35  41.581  12.710   2.871
  234    HB3  SER  35           HB1      SER  35  42.686  11.347   2.713
  235    HG   SER  35           HG       SER  35  43.735  12.085   4.600
  236    H    SER  36           HN       SER  36  45.501  14.830   2.679
  237    HA   SER  36           HA       SER  36  47.744  14.671   3.167
  238    HB2  SER  36           HB2      SER  36  46.751  12.349   4.835
  239    HB3  SER  36           HB1      SER  36  48.305  13.157   5.018
  240    HG   SER  36           HG       SER  36  47.280  14.978   5.683
  241    H    ARG  37           HN       ARG  37  46.679  13.147   0.861
  242    HA   ARG  37           HA       ARG  37  47.333  11.537  -0.651
  243    HB2  ARG  37           HB2      ARG  37  50.016  12.159   0.607
  244    HB3  ARG  37           HB1      ARG  37  49.770  11.354  -0.945
  245    HG2  ARG  37           HG2      ARG  37  48.646  13.327  -1.837
  246    HG3  ARG  37           HG1      ARG  37  48.756  14.129  -0.270
  247    HD2  ARG  37           HD2      ARG  37  50.551  14.957  -1.670
  248    HD3  ARG  37           HD1      ARG  37  51.248  13.947  -0.409
  249    HE   ARG  37           HE       ARG  37  50.714  12.390  -2.728
  250   HH11  ARG  37          HH11      ARG  37  52.873  14.831  -1.475
  251   HH12  ARG  37          HH12      ARG  37  54.194  14.348  -2.479
  252   HH21  ARG  37          HH21      ARG  37  52.463  11.784  -4.028
  253   HH22  ARG  37          HH22      ARG  37  53.966  12.637  -3.915
  254    H    ARG  38           HN       ARG  38  46.490  10.603   1.996
  255    HA   ARG  38           HA       ARG  38  47.625   7.918   1.819
  256    HB2  ARG  38           HB2      ARG  38  48.987   9.211   3.507
  257    HB3  ARG  38           HB1      ARG  38  47.516   9.381   4.465
  258    HG2  ARG  38           HG2      ARG  38  47.298   6.942   4.604
  259    HG3  ARG  38           HG1      ARG  38  48.723   6.742   3.590
  260    HD2  ARG  38           HD2      ARG  38  50.092   7.903   5.285
  261    HD3  ARG  38           HD1      ARG  38  48.667   8.090   6.302
  262    HE   ARG  38           HE       ARG  38  48.848   5.853   6.897
  263   HH11  ARG  38          HH11      ARG  38  50.853   6.521   4.117
  264   HH12  ARG  38          HH12      ARG  38  51.635   4.983   4.164
  265   HH21  ARG  38          HH21      ARG  38  49.890   3.850   6.925
  266   HH22  ARG  38          HH22      ARG  38  51.095   3.480   5.736
  267    H    ALA  39           HN       ALA  39  46.151   6.351   2.293
  268    HA   ALA  39           HA       ALA  39  43.553   7.231   3.402
  269    HB1  ALA  39           HB1      ALA  39  42.409   5.772   1.855
  270    HB2  ALA  39           HB2      ALA  39  43.941   5.164   1.230
  271    HB3  ALA  39           HB3      ALA  39  43.470   6.837   0.933
  272    HA   PRO  40           HA       PRO  40  45.184   3.651   5.846
  273    HB2  PRO  40           HB2      PRO  40  44.751   4.727   8.309
  274    HB3  PRO  40           HB1      PRO  40  46.205   5.070   7.357
  275    HG2  PRO  40           HG2      PRO  40  43.778   6.734   7.768
  276    HG3  PRO  40           HG1      PRO  40  45.478   7.219   7.648
  277    HD2  PRO  40           HD2      PRO  40  43.651   7.427   5.577
  278    HD3  PRO  40           HD1      PRO  40  45.410   7.341   5.358
  279    H    GLN  41           HN       GLN  41  42.857   3.331   4.616
  280    HA   GLN  41           HA       GLN  41  40.790   2.991   6.685
  281    HB2  GLN  41           HB2      GLN  41  40.628   3.077   3.668
  282    HB3  GLN  41           HB1      GLN  41  39.266   2.639   4.703
  283    HG2  GLN  41           HG2      GLN  41  39.310   4.792   5.792
  284    HG3  GLN  41           HG1      GLN  41  40.816   5.225   4.987
  285   HE21  GLN  41          HE21      GLN  41  38.191   6.643   4.805
  286   HE22  GLN  41          HE22      GLN  41  37.776   6.629   3.159
  287    H    THR  42           HN       THR  42  43.241   1.245   5.858
  288    HA   THR  42           HA       THR  42  41.735  -1.278   5.566
  289    HB   THR  42           HB       THR  42  44.555  -0.646   4.667
  290    HG1  THR  42           HG1      THR  42  43.522   0.011   2.974
  291   HG21  THR  42          HG21      THR  42  44.384  -2.951   5.380
  292   HG22  THR  42          HG22      THR  42  44.368  -2.917   3.617
  293   HG23  THR  42          HG23      THR  42  42.865  -3.152   4.507
  294    H    GLY  43           HN       GLY  43  42.033  -2.824   7.057
  295    HA2  GLY  43           HA2      GLY  43  43.471  -3.996   8.629
  296    HA3  GLY  43           HA1      GLY  43  44.183  -2.441   9.046
  297    H    ILE  44           HN       ILE  44  41.205  -1.423   8.848
  298    HA   ILE  44           HA       ILE  44  40.710  -1.352  11.613
  299    HB   ILE  44           HB       ILE  44  38.919  -0.892   9.221
  300   HG12  ILE  44          HG12      ILE  44  40.169   1.085  11.151
  301   HG13  ILE  44          HG11      ILE  44  40.924   0.617   9.628
  302   HG21  ILE  44          HG21      ILE  44  37.454  -1.408  11.023
  303   HG22  ILE  44          HG22      ILE  44  37.511   0.350  10.942
  304   HG23  ILE  44          HG23      ILE  44  38.435  -0.505  12.177
  305   HD11  ILE  44          HD11      ILE  44  39.581   2.710   9.422
  306   HD12  ILE  44          HD12      ILE  44  38.141   1.799   9.877
  307   HD13  ILE  44          HD13      ILE  44  38.986   1.421   8.376
  308    H    VAL  45           HN       VAL  45  39.236  -3.297   9.018
  309    HA   VAL  45           HA       VAL  45  37.468  -4.760  10.679
  310    HB   VAL  45           HB       VAL  45  38.651  -5.351   7.961
  311   HG11  VAL  45          HG11      VAL  45  38.177  -7.505   8.940
  312   HG12  VAL  45          HG12      VAL  45  36.811  -7.112   7.890
  313   HG13  VAL  45          HG13      VAL  45  36.664  -6.915   9.637
  314   HG21  VAL  45          HG21      VAL  45  36.201  -4.943   7.362
  315   HG22  VAL  45          HG22      VAL  45  37.086  -3.526   7.928
  316   HG23  VAL  45          HG23      VAL  45  35.983  -4.369   9.016
  317    H    ASP  46           HN       ASP  46  40.719  -5.452   9.468
  318    HA   ASP  46           HA       ASP  46  40.958  -8.032  10.572
  319    HB2  ASP  46           HB2      ASP  46  43.020  -5.958   9.840
  320    HB3  ASP  46           HB1      ASP  46  43.436  -7.574  10.406
  321    H    GLU  47           HN       GLU  47  41.662  -4.817  11.925
  322    HA   GLU  47           HA       GLU  47  43.036  -5.676  14.222
  323    HB2  GLU  47           HB2      GLU  47  42.926  -3.332  13.480
  324    HB3  GLU  47           HB1      GLU  47  41.205  -3.293  13.860
  325    HG2  GLU  47           HG2      GLU  47  42.491  -2.301  15.690
  326    HG3  GLU  47           HG1      GLU  47  41.735  -3.797  16.232
  327    H    CYS  48           HN       CYS  48  39.550  -4.911  13.818
  328    HA   CYS  48           HA       CYS  48  38.847  -5.766  16.462
  329    HB2  CYS  48           HB2      CYS  48  37.154  -5.314  14.003
  330    HB3  CYS  48           HB1      CYS  48  36.525  -5.682  15.597
  331    H    CYS  49           HN       CYS  49  38.735  -7.295  13.277
  332    HA   CYS  49           HA       CYS  49  37.328  -9.616  13.994
  333    HB2  CYS  49           HB2      CYS  49  37.717  -8.942  11.660
  334    HB3  CYS  49           HB1      CYS  49  39.436  -9.281  11.851
  335    H    PHE  50           HN       PHE  50  40.836  -9.017  13.832
  336    HA   PHE  50           HA       PHE  50  41.392 -11.632  14.939
  337    HB2  PHE  50           HB2      PHE  50  43.078  -9.319  14.007
  338    HB3  PHE  50           HB1      PHE  50  43.803 -10.696  14.849
  339    HD1  PHE  50           HD1      PHE  50  41.784  -9.655  11.922
  340    HD2  PHE  50           HD2      PHE  50  44.110 -12.792  13.704
  341    HE1  PHE  50           HE1      PHE  50  41.737 -10.888   9.777
  342    HE2  PHE  50           HE2      PHE  50  44.070 -14.038  11.557
  343    HZ   PHE  50           HZ       PHE  50  42.886 -13.088   9.593
  344    H    ARG  51           HN       ARG  51  42.555  -8.393  15.864
  345    HA   ARG  51           HA       ARG  51  42.861  -9.179  18.625
  346    HB2  ARG  51           HB2      ARG  51  43.240  -6.534  17.212
  347    HB3  ARG  51           HB1      ARG  51  43.569  -6.794  18.926
  348    HG2  ARG  51           HG2      ARG  51  45.213  -8.510  18.395
  349    HG3  ARG  51           HG1      ARG  51  44.831  -8.388  16.678
  350    HD2  ARG  51           HD2      ARG  51  46.854  -7.112  17.140
  351    HD3  ARG  51           HD1      ARG  51  45.548  -6.008  16.717
  352    HE   ARG  51           HE       ARG  51  45.653  -6.369  19.535
  353   HH11  ARG  51          HH11      ARG  51  47.322  -4.836  16.881
  354   HH12  ARG  51          HH12      ARG  51  47.963  -3.566  17.861
  355   HH21  ARG  51          HH21      ARG  51  46.507  -4.691  20.790
  356   HH22  ARG  51          HH22      ARG  51  47.507  -3.482  20.058
  357    H    SER  52           HN       SER  52  41.906  -7.900  20.405
  358    HA   SER  52           HA       SER  52  39.055  -7.505  19.901
  359    HB2  SER  52           HB2      SER  52  39.732  -8.867  21.827
  360    HB3  SER  52           HB1      SER  52  40.643  -7.507  22.479
  361    HG   SER  52           HG       SER  52  37.844  -7.717  22.061
  362    H    CYS  53           HN       CYS  53  38.878  -5.524  18.884
  363    HA   CYS  53           HA       CYS  53  40.223  -3.184  19.929
  364    HB2  CYS  53           HB2      CYS  53  39.091  -1.992  18.131
  365    HB3  CYS  53           HB1      CYS  53  39.785  -3.478  17.500
  366    H    ASP  54           HN       ASP  54  39.370  -1.597  21.191
  367    HA   ASP  54           HA       ASP  54  37.141  -2.195  22.840
  368    HB2  ASP  54           HB2      ASP  54  38.729   0.332  22.392
  369    HB3  ASP  54           HB1      ASP  54  37.413   0.227  23.557
  370    H    LEU  55           HN       LEU  55  35.076  -1.333  22.896
  371    HA   LEU  55           HA       LEU  55  33.832  -0.811  20.411
  372    HB2  LEU  55           HB2      LEU  55  32.897  -0.398  23.259
  373    HB3  LEU  55           HB1      LEU  55  31.861  -0.171  21.849
  374    HG   LEU  55           HG       LEU  55  33.368  -2.740  22.405
  375   HD11  LEU  55          HD11      LEU  55  30.466  -2.062  22.994
  376   HD12  LEU  55          HD12      LEU  55  31.731  -2.263  24.207
  377   HD13  LEU  55          HD13      LEU  55  31.229  -3.636  23.222
  378   HD21  LEU  55          HD21      LEU  55  31.526  -3.591  20.826
  379   HD22  LEU  55          HD22      LEU  55  32.775  -2.585  20.094
  380   HD23  LEU  55          HD23      LEU  55  31.194  -1.897  20.469
  381    H    ARG  56           HN       ARG  56  34.945   1.302  23.021
  382    HA   ARG  56           HA       ARG  56  33.820   3.700  22.096
  383    HB2  ARG  56           HB2      ARG  56  34.833   3.468  24.321
  384    HB3  ARG  56           HB1      ARG  56  36.425   3.283  23.584
  385    HG2  ARG  56           HG2      ARG  56  36.299   5.523  22.640
  386    HG3  ARG  56           HG1      ARG  56  34.645   5.710  23.225
  387    HD2  ARG  56           HD2      ARG  56  36.190   6.840  24.747
  388    HD3  ARG  56           HD1      ARG  56  35.453   5.460  25.553
  389    HE   ARG  56           HE       ARG  56  37.932   4.739  24.323
  390   HH11  ARG  56          HH11      ARG  56  36.535   6.372  27.074
  391   HH12  ARG  56          HH12      ARG  56  37.899   6.075  28.092
  392   HH21  ARG  56          HH21      ARG  56  39.701   4.368  25.683
  393   HH22  ARG  56          HH22      ARG  56  39.678   4.949  27.313
  394    H    ARG  57           HN       ARG  57  37.000   2.231  21.403
  395    HA   ARG  57           HA       ARG  57  37.954   4.283  19.740
  396    HB2  ARG  57           HB2      ARG  57  39.265   2.379  20.766
  397    HB3  ARG  57           HB1      ARG  57  38.599   1.344  19.500
  398    HG2  ARG  57           HG2      ARG  57  39.538   2.786  17.781
  399    HG3  ARG  57           HG1      ARG  57  40.124   3.899  19.018
  400    HD2  ARG  57           HD2      ARG  57  41.995   2.544  18.428
  401    HD3  ARG  57           HD1      ARG  57  41.427   1.972  19.995
  402    HE   ARG  57           HE       ARG  57  40.164   0.475  17.960
  403   HH11  ARG  57          HH11      ARG  57  43.305   0.972  19.408
  404   HH12  ARG  57          HH12      ARG  57  43.851  -0.628  19.055
  405   HH21  ARG  57          HH21      ARG  57  40.918  -1.606  17.506
  406   HH22  ARG  57          HH22      ARG  57  42.512  -2.078  17.988
  407    H    LEU  58           HN       LEU  58  36.034   1.389  19.112
  408    HA   LEU  58           HA       LEU  58  36.055   1.460  16.307
  409    HB2  LEU  58           HB2      LEU  58  35.195  -0.413  17.810
  410    HB3  LEU  58           HB1      LEU  58  33.714   0.532  17.971
  411    HG   LEU  58           HG       LEU  58  33.761   0.624  15.368
  412   HD11  LEU  58          HD11      LEU  58  36.117  -0.390  15.354
  413   HD12  LEU  58          HD12      LEU  58  34.950  -1.108  14.248
  414   HD13  LEU  58          HD13      LEU  58  35.345  -1.919  15.762
  415   HD21  LEU  58          HD21      LEU  58  33.109  -1.819  17.022
  416   HD22  LEU  58          HD22      LEU  58  32.715  -1.723  15.306
  417   HD23  LEU  58          HD23      LEU  58  32.007  -0.573  16.439
  418    H    ASP  59           HN       ASP  59  34.171   3.223  18.669
  419    HA   ASP  59           HA       ASP  59  32.067   4.161  17.090
  420    HB2  ASP  59           HB2      ASP  59  32.366   4.465  19.586
  421    HB3  ASP  59           HB1      ASP  59  33.484   5.775  19.213
  422    H    MET  60           HN       MET  60  35.428   5.164  17.221
  423    HA   MET  60           HA       MET  60  35.181   7.669  15.961
  424    HB2  MET  60           HB2      MET  60  37.442   5.666  15.972
  425    HB3  MET  60           HB1      MET  60  37.572   7.274  15.259
  426    HG2  MET  60           HG2      MET  60  36.799   8.181  17.524
  427    HG3  MET  60           HG1      MET  60  37.070   6.556  18.155
  428    HE1  MET  60           HE1      MET  60  40.673   5.817  17.893
  429    HE2  MET  60           HE2      MET  60  39.797   5.625  16.376
  430    HE3  MET  60           HE3      MET  60  38.997   5.251  17.900
  431    H    TYR  61           HN       TYR  61  34.845   4.459  14.720
  432    HA   TYR  61           HA       TYR  61  35.479   5.118  12.011
  433    HB2  TYR  61           HB2      TYR  61  34.102   2.751  13.290
  434    HB3  TYR  61           HB1      TYR  61  34.394   2.851  11.547
  435    HD1  TYR  61           HD1      TYR  61  35.516   1.285  14.275
  436    HD2  TYR  61           HD2      TYR  61  37.053   3.974  11.304
  437    HE1  TYR  61           HE1      TYR  61  37.804   0.477  14.741
  438    HE2  TYR  61           HE2      TYR  61  39.352   3.165  11.764
  439    HH   TYR  61           HH       TYR  61  40.559   2.082  13.730
  440    H    CYS  62           HN       CYS  62  32.862   5.845  13.993
  441    HA   CYS  62           HA       CYS  62  30.691   5.567  12.170
  442    HB2  CYS  62           HB2      CYS  62  31.028   7.372  14.577
  443    HB3  CYS  62           HB1      CYS  62  29.503   7.047  13.755
  444    H    ALA  63           HN       ALA  63  29.703   7.118  10.877
  445    HA   ALA  63           HA       ALA  63  31.441   9.021   9.684
  446    HB1  ALA  63           HB1      ALA  63  29.323   7.653   8.768
  447    HB2  ALA  63           HB2      ALA  63  29.850   9.170   8.040
  448    HB3  ALA  63           HB3      ALA  63  28.509   9.159   9.186
  449    HA   PRO  64           HA       PRO  64  30.739  12.809  11.807
  450    HB2  PRO  64           HB2      PRO  64  29.489  13.895   9.317
  451    HB3  PRO  64           HB1      PRO  64  30.830  14.543  10.280
  452    HG2  PRO  64           HG2      PRO  64  31.264  13.341   7.954
  453    HG3  PRO  64           HG1      PRO  64  32.378  13.144   9.318
  454    HD2  PRO  64           HD2      PRO  64  30.389  11.190   8.225
  455    HD3  PRO  64           HD1      PRO  64  31.959  10.903   9.003
  456    H    LEU  65           HN       LEU  65  29.144  13.720  13.053
  457    HA   LEU  65           HA       LEU  65  26.540  12.566  13.044
  458    HB2  LEU  65           HB2      LEU  65  27.892  14.743  14.597
  459    HB3  LEU  65           HB1      LEU  65  26.145  14.534  14.725
  460    HG   LEU  65           HG       LEU  65  26.591  12.075  15.198
  461   HD11  LEU  65          HD11      LEU  65  28.935  11.685  16.148
  462   HD12  LEU  65          HD12      LEU  65  29.406  13.176  15.333
  463   HD13  LEU  65          HD13      LEU  65  28.824  11.802  14.390
  464   HD21  LEU  65          HD21      LEU  65  27.398  12.571  17.568
  465   HD22  LEU  65          HD22      LEU  65  25.985  13.485  17.037
  466   HD23  LEU  65          HD23      LEU  65  27.574  14.251  17.059
  467    H    LYS  66           HN       LYS  66  24.596  13.369  12.386
  468    HA   LYS  66           HA       LYS  66  24.630  15.255  10.255
  469    HB2  LYS  66           HB2      LYS  66  22.371  13.924  11.753
  470    HB3  LYS  66           HB1      LYS  66  22.114  15.019  10.395
  471    HG2  LYS  66           HG2      LYS  66  23.386  13.592   8.916
  472    HG3  LYS  66           HG1      LYS  66  23.872  12.556  10.259
  473    HD2  LYS  66           HD2      LYS  66  22.048  11.472   9.083
  474    HD3  LYS  66           HD1      LYS  66  21.450  12.026  10.646
  475    HE2  LYS  66           HE2      LYS  66  20.458  14.001   9.611
  476    HE3  LYS  66           HE1      LYS  66  21.139  13.557   8.047
  477    HZ1  LYS  66           HZ1      LYS  66  19.866  11.358   8.473
  478    HZ2  LYS  66           HZ2      LYS  66  19.023  12.718   7.900
  479    HZ3  LYS  66           HZ3      LYS  66  18.946  12.297   9.545
  480    HA   PRO  67           HA       PRO  67  23.988  19.028  12.467
  481    HB2  PRO  67           HB2      PRO  67  22.488  20.459  10.687
  482    HB3  PRO  67           HB1      PRO  67  24.218  20.133  10.459
  483    HG2  PRO  67           HG2      PRO  67  21.859  18.782   9.241
  484    HG3  PRO  67           HG1      PRO  67  23.408  19.230   8.508
  485    HD2  PRO  67           HD2      PRO  67  22.836  16.681   9.313
  486    HD3  PRO  67           HD1      PRO  67  24.485  17.344   9.296
  487    H    ALA  68           HN       ALA  68  22.435  20.277  13.637
  488    HA   ALA  68           HA       ALA  68  20.496  20.633  14.815
  489    HB1  ALA  68           HB1      ALA  68  19.594  20.699  12.399
  490    HB2  ALA  68           HB2      ALA  68  18.434  20.412  13.698
  491    HB3  ALA  68           HB3      ALA  68  19.011  19.066  12.716
  492    H    LYS  69           HN       LYS  69  21.714  18.960  16.181
  493    HA   LYS  69           HA       LYS  69  20.932  16.254  16.248
  494    HB2  LYS  69           HB2      LYS  69  21.985  18.090  18.405
  495    HB3  LYS  69           HB1      LYS  69  21.738  16.359  18.637
  496    HG2  LYS  69           HG2      LYS  69  23.260  15.882  16.760
  497    HG3  LYS  69           HG1      LYS  69  23.503  17.611  16.512
  498    HD2  LYS  69           HD2      LYS  69  24.452  17.820  18.769
  499    HD3  LYS  69           HD1      LYS  69  24.178  16.101  19.054
  500    HE2  LYS  69           HE2      LYS  69  26.513  16.492  18.394
  501    HE3  LYS  69           HE1      LYS  69  25.674  15.559  17.154
  502    HZ1  LYS  69           HZ1      LYS  69  25.720  18.492  16.974
  503    HZ2  LYS  69           HZ2      LYS  69  25.596  17.339  15.733
  504    HZ3  LYS  69           HZ3      LYS  69  27.089  17.613  16.496
  505    H    SER  70           HN       SER  70  19.596  19.131  17.816
  506    HA   SER  70           HA       SER  70  17.748  17.827  19.501
  507    HB2  SER  70           HB2      SER  70  16.616  19.986  19.619
  508    HB3  SER  70           HB1      SER  70  18.360  20.217  19.706
  509    HG   SER  70           HG       SER  70  16.794  21.404  18.074
  510    H    ALA  71           HN       ALA  71  17.742  18.432  16.084
  511    HA   ALA  71           HA       ALA  71  16.225  17.968  14.423
  512    HB1  ALA  71           HB1      ALA  71  15.219  15.995  16.487
  513    HB2  ALA  71           HB2      ALA  71  16.495  15.693  15.308
  514    HB3  ALA  71           HB3      ALA  71  14.839  15.963  14.766
  Start of MODEL   14
    1    H1   GLY   1           HT1      GLY   1  29.882 -19.839  16.619
    2    H2   GLY   1           HT2      GLY   1  29.856 -21.290  17.500
    3    H3   GLY   1           HT3      GLY   1  31.339 -20.587  17.058
    4    HA2  GLY   1           HA2      GLY   1  29.370 -19.297  18.863
    5    HA3  GLY   1           HA1      GLY   1  30.747 -20.244  19.426
    6    H    GLY   2           HN       GLY   2  32.095 -18.741  20.272
    7    HA2  GLY   2           HA2      GLY   2  33.642 -17.041  20.330
    8    HA3  GLY   2           HA1      GLY   2  33.631 -17.080  18.571
    9    HA   PRO   3           HA       PRO   3  30.088 -14.049  19.645
   10    HB2  PRO   3           HB2      PRO   3  29.540 -13.540  22.267
   11    HB3  PRO   3           HB1      PRO   3  28.777 -14.857  21.355
   12    HG2  PRO   3           HG2      PRO   3  31.056 -14.954  23.271
   13    HG3  PRO   3           HG1      PRO   3  29.703 -16.080  23.067
   14    HD2  PRO   3           HD2      PRO   3  32.202 -16.562  22.063
   15    HD3  PRO   3           HD1      PRO   3  30.720 -17.198  21.317
   16    H    GLU   4           HN       GLU   4  33.075 -14.113  21.181
   17    HA   GLU   4           HA       GLU   4  33.153 -11.258  21.733
   18    HB2  GLU   4           HB2      GLU   4  35.273 -13.385  22.091
   19    HB3  GLU   4           HB1      GLU   4  35.414 -11.706  22.611
   20    HG2  GLU   4           HG2      GLU   4  33.253 -13.615  23.547
   21    HG3  GLU   4           HG1      GLU   4  34.713 -13.232  24.459
   22    H    THR   5           HN       THR   5  33.521 -13.119  19.045
   23    HA   THR   5           HA       THR   5  35.520 -11.297  17.875
   24    HB   THR   5           HB       THR   5  34.786 -14.126  17.093
   25    HG1  THR   5           HG1      THR   5  36.581 -14.674  18.093
   26   HG21  THR   5          HG21      THR   5  36.760 -13.829  15.544
   27   HG22  THR   5          HG22      THR   5  36.687 -12.104  15.907
   28   HG23  THR   5          HG23      THR   5  35.325 -12.896  15.115
   29    H    LEU   6           HN       LEU   6  34.801  -9.946  16.356
   30    HA   LEU   6           HA       LEU   6  32.222 -10.565  15.040
   31    HB2  LEU   6           HB2      LEU   6  33.386  -7.834  15.637
   32    HB3  LEU   6           HB1      LEU   6  31.801  -8.175  14.941
   33    HG   LEU   6           HG       LEU   6  32.711  -9.073  17.691
   34   HD11  LEU   6          HD11      LEU   6  30.649  -6.970  16.999
   35   HD12  LEU   6          HD12      LEU   6  32.332  -6.575  17.351
   36   HD13  LEU   6          HD13      LEU   6  31.327  -7.338  18.584
   37   HD21  LEU   6          HD21      LEU   6  30.204  -9.513  17.906
   38   HD22  LEU   6          HD22      LEU   6  31.082 -10.614  16.846
   39   HD23  LEU   6          HD23      LEU   6  30.113  -9.312  16.156
   40    H    CYS   7           HN       CYS   7  32.765 -11.334  13.071
   41    HA   CYS   7           HA       CYS   7  34.535  -9.653  11.411
   42    HB2  CYS   7           HB2      CYS   7  34.505 -12.680  11.489
   43    HB3  CYS   7           HB1      CYS   7  35.458 -11.687  10.387
   44    H    GLY   8           HN       GLY   8  34.120  -9.801   9.120
   45    HA2  GLY   8           HA2      GLY   8  32.732  -9.819   7.285
   46    HA3  GLY   8           HA1      GLY   8  32.064 -11.307   7.947
   47    H    ALA   9           HN       ALA   9  29.937 -11.193   8.121
   48    HA   ALA   9           HA       ALA   9  28.422  -8.825   8.064
   49    HB1  ALA   9           HB1      ALA   9  27.178 -10.667   7.433
   50    HB2  ALA   9           HB2      ALA   9  26.622 -10.452   9.093
   51    HB3  ALA   9           HB3      ALA   9  27.830 -11.682   8.718
   52    H    GLU  10           HN       GLU  10  29.610 -10.782  10.761
   53    HA   GLU  10           HA       GLU  10  28.115  -9.602  12.823
   54    HB2  GLU  10           HB2      GLU  10  30.869 -10.846  12.785
   55    HB3  GLU  10           HB1      GLU  10  30.078 -10.317  14.271
   56    HG2  GLU  10           HG2      GLU  10  28.240 -11.840  13.917
   57    HG3  GLU  10           HG1      GLU  10  28.825 -12.252  12.305
   58    H    LEU  11           HN       LEU  11  31.255  -8.682  11.425
   59    HA   LEU  11           HA       LEU  11  31.758  -6.537  13.196
   60    HB2  LEU  11           HB2      LEU  11  33.540  -7.465  11.838
   61    HB3  LEU  11           HB1      LEU  11  32.699  -7.006  10.358
   62    HG   LEU  11           HG       LEU  11  32.884  -4.622  10.988
   63   HD11  LEU  11          HD11      LEU  11  32.863  -4.761  13.391
   64   HD12  LEU  11          HD12      LEU  11  34.418  -4.074  12.923
   65   HD13  LEU  11          HD13      LEU  11  34.311  -5.769  13.400
   66   HD21  LEU  11          HD21      LEU  11  34.660  -5.452   9.619
   67   HD22  LEU  11          HD22      LEU  11  35.430  -6.254  10.989
   68   HD23  LEU  11          HD23      LEU  11  35.424  -4.494  10.887
   69    H    VAL  12           HN       VAL  12  30.281  -6.630   9.962
   70    HA   VAL  12           HA       VAL  12  29.846  -3.879   9.701
   71    HB   VAL  12           HB       VAL  12  28.499  -6.294   8.506
   72   HG11  VAL  12          HG11      VAL  12  26.740  -4.633   8.547
   73   HG12  VAL  12          HG12      VAL  12  27.437  -4.577   6.928
   74   HG13  VAL  12          HG13      VAL  12  27.866  -3.347   8.117
   75   HG21  VAL  12          HG21      VAL  12  30.199  -4.068   7.341
   76   HG22  VAL  12          HG22      VAL  12  29.646  -5.513   6.497
   77   HG23  VAL  12          HG23      VAL  12  30.809  -5.653   7.815
   78    H    ASP  13           HN       ASP  13  27.749  -6.434  10.988
   79    HA   ASP  13           HA       ASP  13  25.505  -4.825  11.535
   80    HB2  ASP  13           HB2      ASP  13  26.501  -7.417  12.725
   81    HB3  ASP  13           HB1      ASP  13  24.979  -6.672  13.215
   82    H    ALA  14           HN       ALA  14  28.336  -5.684  13.494
   83    HA   ALA  14           HA       ALA  14  27.487  -4.452  15.887
   84    HB1  ALA  14           HB1      ALA  14  30.370  -4.608  15.050
   85    HB2  ALA  14           HB2      ALA  14  29.469  -6.060  15.485
   86    HB3  ALA  14           HB3      ALA  14  29.674  -4.762  16.664
   87    H    LEU  15           HN       LEU  15  29.309  -3.230  13.103
   88    HA   LEU  15           HA       LEU  15  29.972  -0.707  14.167
   89    HB2  LEU  15           HB2      LEU  15  29.535  -1.664  11.332
   90    HB3  LEU  15           HB1      LEU  15  30.091  -0.037  11.719
   91    HG   LEU  15           HG       LEU  15  31.484  -2.511  12.761
   92   HD11  LEU  15          HD11      LEU  15  32.324  -0.866  10.360
   93   HD12  LEU  15          HD12      LEU  15  31.402  -2.361  10.207
   94   HD13  LEU  15          HD13      LEU  15  33.013  -2.389  10.921
   95   HD21  LEU  15          HD21      LEU  15  33.378  -0.818  12.902
   96   HD22  LEU  15          HD22      LEU  15  32.028  -0.505  13.990
   97   HD23  LEU  15          HD23      LEU  15  32.194   0.427  12.504
   98    H    GLN  16           HN       GLN  16  27.143  -1.815  12.333
   99    HA   GLN  16           HA       GLN  16  25.880   0.719  12.150
  100    HB2  GLN  16           HB2      GLN  16  25.284  -1.252  10.749
  101    HB3  GLN  16           HB1      GLN  16  24.580  -2.014  12.175
  102    HG2  GLN  16           HG2      GLN  16  23.008  -0.150  12.424
  103    HG3  GLN  16           HG1      GLN  16  23.732   0.663  11.039
  104   HE21  GLN  16          HE21      GLN  16  21.105   0.240  10.656
  105   HE22  GLN  16          HE22      GLN  16  20.810  -1.102   9.659
  106    H    PHE  17           HN       PHE  17  25.703  -1.909  14.512
  107    HA   PHE  17           HA       PHE  17  23.601  -0.907  16.082
  108    HB2  PHE  17           HB2      PHE  17  24.333  -3.147  16.448
  109    HB3  PHE  17           HB1      PHE  17  25.985  -2.624  16.776
  110    HD1  PHE  17           HD1      PHE  17  22.504  -2.629  18.074
  111    HD2  PHE  17           HD2      PHE  17  26.637  -1.762  18.919
  112    HE1  PHE  17           HE1      PHE  17  21.956  -2.369  20.481
  113    HE2  PHE  17           HE2      PHE  17  26.080  -1.513  21.330
  114    HZ   PHE  17           HZ       PHE  17  23.744  -1.815  22.107
  115    H    VAL  18           HN       VAL  18  27.112  -0.447  16.405
  116    HA   VAL  18           HA       VAL  18  26.996   1.188  18.703
  117    HB   VAL  18           HB       VAL  18  29.092   1.008  16.526
  118   HG11  VAL  18          HG11      VAL  18  29.080   2.324  19.246
  119   HG12  VAL  18          HG12      VAL  18  29.410   3.081  17.688
  120   HG13  VAL  18          HG13      VAL  18  30.563   1.939  18.375
  121   HG21  VAL  18          HG21      VAL  18  28.546  -1.080  17.857
  122   HG22  VAL  18          HG22      VAL  18  29.050  -0.206  19.303
  123   HG23  VAL  18          HG23      VAL  18  30.211  -0.523  18.013
  124    H    CYS  19           HN       CYS  19  27.178   1.977  15.238
  125    HA   CYS  19           HA       CYS  19  26.268   4.709  15.911
  126    HB2  CYS  19           HB2      CYS  19  28.219   3.916  13.738
  127    HB3  CYS  19           HB1      CYS  19  27.605   5.544  14.022
  128    H    GLY  20           HN       GLY  20  24.176   3.456  15.561
  129    HA2  GLY  20           HA2      GLY  20  23.438   2.599  12.955
  130    HA3  GLY  20           HA1      GLY  20  22.327   2.998  14.260
  131    H    ASP  21           HN       ASP  21  22.159   5.437  14.703
  132    HA   ASP  21           HA       ASP  21  21.185   6.708  12.375
  133    HB2  ASP  21           HB2      ASP  21  20.410   7.189  14.698
  134    HB3  ASP  21           HB1      ASP  21  21.947   7.998  15.003
  135    H    ARG  22           HN       ARG  22  24.147   7.210  14.279
  136    HA   ARG  22           HA       ARG  22  25.169   9.343  12.731
  137    HB2  ARG  22           HB2      ARG  22  26.538   7.295  14.485
  138    HB3  ARG  22           HB1      ARG  22  27.378   8.657  13.742
  139    HG2  ARG  22           HG2      ARG  22  25.902  10.232  14.878
  140    HG3  ARG  22           HG1      ARG  22  24.969   8.903  15.564
  141    HD2  ARG  22           HD2      ARG  22  26.544   9.720  17.232
  142    HD3  ARG  22           HD1      ARG  22  27.019   8.104  16.722
  143    HE   ARG  22           HE       ARG  22  28.343  10.064  15.144
  144   HH11  ARG  22          HH11      ARG  22  28.287   8.634  18.323
  145   HH12  ARG  22          HH12      ARG  22  29.962   8.933  18.621
  146   HH21  ARG  22          HH21      ARG  22  30.540  10.445  15.559
  147   HH22  ARG  22          HH22      ARG  22  31.233   9.952  17.068
  148    H    GLY  23           HN       GLY  23  25.539   5.835  12.492
  149    HA2  GLY  23           HA2      GLY  23  26.003   4.572  10.589
  150    HA3  GLY  23           HA1      GLY  23  26.257   6.067   9.692
  151    H    PHE  24           HN       PHE  24  28.022   4.178   9.133
  152    HA   PHE  24           HA       PHE  24  30.491   5.204  10.312
  153    HB2  PHE  24           HB2      PHE  24  31.383   2.989  10.774
  154    HB3  PHE  24           HB1      PHE  24  29.873   3.201  11.661
  155    HD1  PHE  24           HD1      PHE  24  31.585   1.383   8.998
  156    HD2  PHE  24           HD2      PHE  24  27.776   2.139  10.835
  157    HE1  PHE  24           HE1      PHE  24  30.635  -0.592   7.848
  158    HE2  PHE  24           HE2      PHE  24  26.830   0.157   9.691
  159    HZ   PHE  24           HZ       PHE  24  28.260  -1.209   8.197
  160    H    TYR  25           HN       TYR  25  32.394   4.667   9.055
  161    HA   TYR  25           HA       TYR  25  31.991   3.481   6.430
  162    HB2  TYR  25           HB2      TYR  25  32.622   5.422   5.157
  163    HB3  TYR  25           HB1      TYR  25  31.273   5.884   6.196
  164    HD1  TYR  25           HD1      TYR  25  34.880   6.227   5.587
  165    HD2  TYR  25           HD2      TYR  25  31.615   7.330   8.151
  166    HE1  TYR  25           HE1      TYR  25  36.281   7.993   6.605
  167    HE2  TYR  25           HE2      TYR  25  33.018   9.105   9.169
  168    HH   TYR  25           HH       TYR  25  35.726  10.298   7.835
  169    H    PHE  26           HN       PHE  26  34.056   3.371   5.205
  170    HA   PHE  26           HA       PHE  26  36.341   3.201   7.075
  171    HB2  PHE  26           HB2      PHE  26  35.802   1.672   4.515
  172    HB3  PHE  26           HB1      PHE  26  37.245   1.500   5.516
  173    HD1  PHE  26           HD1      PHE  26  33.660   0.778   5.221
  174    HD2  PHE  26           HD2      PHE  26  37.106   0.519   7.774
  175    HE1  PHE  26           HE1      PHE  26  32.463  -0.837   6.674
  176    HE2  PHE  26           HE2      PHE  26  35.908  -1.096   9.226
  177    HZ   PHE  26           HZ       PHE  26  33.586  -1.773   8.676
  178    H    ASN  27           HN       ASN  27  35.193   4.491   4.050
  179    HA   ASN  27           HA       ASN  27  37.235   6.453   3.939
  180    HB2  ASN  27           HB2      ASN  27  38.426   4.283   3.177
  181    HB3  ASN  27           HB1      ASN  27  37.489   4.459   1.697
  182   HD21  ASN  27          HD21      ASN  27  39.186   5.116   0.286
  183   HD22  ASN  27          HD22      ASN  27  40.075   6.546   0.510
  184    H    LYS  28           HN       LYS  28  35.619   4.591   1.363
  185    HA   LYS  28           HA       LYS  28  33.829   6.854   0.855
  186    HB2  LYS  28           HB2      LYS  28  34.355   6.583  -1.630
  187    HB3  LYS  28           HB1      LYS  28  35.583   7.384  -0.649
  188    HG2  LYS  28           HG2      LYS  28  36.836   5.277  -0.463
  189    HG3  LYS  28           HG1      LYS  28  35.600   4.445  -1.405
  190    HD2  LYS  28           HD2      LYS  28  36.051   5.968  -3.309
  191    HD3  LYS  28           HD1      LYS  28  37.328   6.741  -2.366
  192    HE2  LYS  28           HE2      LYS  28  37.240   3.802  -3.102
  193    HE3  LYS  28           HE1      LYS  28  38.239   5.017  -3.898
  194    HZ1  LYS  28           HZ1      LYS  28  39.630   4.050  -2.321
  195    HZ2  LYS  28           HZ2      LYS  28  38.423   4.008  -1.127
  196    HZ3  LYS  28           HZ3      LYS  28  39.125   5.488  -1.578
  197    HA   PRO  29           HA       PRO  29  31.850   2.602   0.807
  198    HB2  PRO  29           HB2      PRO  29  29.669   4.356   1.850
  199    HB3  PRO  29           HB1      PRO  29  30.190   2.751   2.401
  200    HG2  PRO  29           HG2      PRO  29  30.797   4.919   3.791
  201    HG3  PRO  29           HG1      PRO  29  31.962   3.593   3.617
  202    HD2  PRO  29           HD2      PRO  29  31.924   6.263   2.252
  203    HD3  PRO  29           HD1      PRO  29  33.311   5.300   2.813
  204    H    THR  30           HN       THR  30  30.660   5.798  -0.183
  205    HA   THR  30           HA       THR  30  29.298   4.515  -2.473
  206    HB   THR  30           HB       THR  30  28.544   7.064  -1.025
  207    HG1  THR  30           HG1      THR  30  27.144   5.865  -0.010
  208   HG21  THR  30          HG21      THR  30  28.067   7.224  -3.405
  209   HG22  THR  30          HG22      THR  30  26.558   6.977  -2.527
  210   HG23  THR  30          HG23      THR  30  27.307   5.633  -3.389
  211    H    GLY  31           HN       GLY  31  30.012   5.082  -4.441
  212    HA2  GLY  31           HA2      GLY  31  30.559   7.321  -5.677
  213    HA3  GLY  31           HA1      GLY  31  31.976   7.258  -4.633
  214    H    TYR  32           HN       TYR  32  31.110   6.730  -7.669
  215    HA   TYR  32           HA       TYR  32  32.059   4.130  -8.266
  216    HB2  TYR  32           HB2      TYR  32  30.672   5.407  -9.840
  217    HB3  TYR  32           HB1      TYR  32  31.959   6.599 -10.022
  218    HD1  TYR  32           HD1      TYR  32  31.170   2.979 -10.472
  219    HD2  TYR  32           HD2      TYR  32  33.730   6.253 -11.555
  220    HE1  TYR  32           HE1      TYR  32  32.216   1.579 -12.231
  221    HE2  TYR  32           HE2      TYR  32  34.776   4.852 -13.313
  222    HH   TYR  32           HH       TYR  32  34.962   1.984 -13.509
  223    H    GLY  33           HN       GLY  33  34.078   3.353  -8.569
  224    HA2  GLY  33           HA2      GLY  33  36.323   5.020  -9.219
  225    HA3  GLY  33           HA1      GLY  33  36.341   4.513  -7.533
  226    H    SER  34           HN       SER  34  38.430   3.671  -8.877
  227    HA   SER  34           HA       SER  34  37.846   0.941  -9.823
  228    HB2  SER  34           HB2      SER  34  40.333   2.636 -10.141
  229    HB3  SER  34           HB1      SER  34  40.145   0.990 -10.739
  230    HG   SER  34           HG       SER  34  39.387   3.261 -11.880
  231    H    SER  35           HN       SER  35  38.505   2.409  -6.989
  232    HA   SER  35           HA       SER  35  40.709   0.967  -5.963
  233    HB2  SER  35           HB2      SER  35  40.059   1.847  -3.863
  234    HB3  SER  35           HB1      SER  35  39.605   3.074  -5.044
  235    HG   SER  35           HG       SER  35  37.545   2.642  -4.719
  236    H    SER  36           HN       SER  36  37.558  -0.022  -6.794
  237    HA   SER  36           HA       SER  36  36.956  -1.901  -4.816
  238    HB2  SER  36           HB2      SER  36  35.507  -2.927  -6.492
  239    HB3  SER  36           HB1      SER  36  35.398  -1.174  -6.613
  240    HG   SER  36           HG       SER  36  36.749  -3.012  -8.274
  241    H    ARG  37           HN       ARG  37  39.224  -1.988  -7.446
  242    HA   ARG  37           HA       ARG  37  39.616  -4.819  -7.492
  243    HB2  ARG  37           HB2      ARG  37  41.504  -4.375  -8.894
  244    HB3  ARG  37           HB1      ARG  37  40.282  -3.176  -9.317
  245    HG2  ARG  37           HG2      ARG  37  41.404  -1.582  -7.722
  246    HG3  ARG  37           HG1      ARG  37  42.689  -2.766  -7.526
  247    HD2  ARG  37           HD2      ARG  37  43.112  -2.708  -9.953
  248    HD3  ARG  37           HD1      ARG  37  41.846  -1.498 -10.141
  249    HE   ARG  37           HE       ARG  37  43.723  -0.595  -8.227
  250   HH11  ARG  37          HH11      ARG  37  43.388  -1.228 -11.638
  251   HH12  ARG  37          HH12      ARG  37  44.548  -0.032 -12.097
  252   HH21  ARG  37          HH21      ARG  37  45.238   0.969  -8.854
  253   HH22  ARG  37          HH22      ARG  37  45.590   1.205 -10.534
  254    H    ARG  38           HN       ARG  38  40.979  -2.159  -5.646
  255    HA   ARG  38           HA       ARG  38  43.168  -3.589  -4.527
  256    HB2  ARG  38           HB2      ARG  38  43.085  -1.134  -4.548
  257    HB3  ARG  38           HB1      ARG  38  41.696  -1.168  -3.459
  258    HG2  ARG  38           HG2      ARG  38  43.020  -2.228  -1.720
  259    HG3  ARG  38           HG1      ARG  38  44.398  -2.380  -2.812
  260    HD2  ARG  38           HD2      ARG  38  44.716  -0.449  -1.351
  261    HD3  ARG  38           HD1      ARG  38  44.491   0.086  -3.012
  262    HE   ARG  38           HE       ARG  38  42.005   0.018  -1.605
  263   HH11  ARG  38          HH11      ARG  38  44.961   1.822  -2.008
  264   HH12  ARG  38          HH12      ARG  38  44.245   3.331  -1.566
  265   HH21  ARG  38          HH21      ARG  38  41.089   2.010  -1.027
  266   HH22  ARG  38          HH22      ARG  38  42.066   3.440  -1.013
  267    H    ALA  39           HN       ALA  39  39.855  -2.962  -3.467
  268    HA   ALA  39           HA       ALA  39  38.601  -3.840  -1.746
  269    HB1  ALA  39           HB1      ALA  39  38.654  -5.843  -3.046
  270    HB2  ALA  39           HB2      ALA  39  38.986  -6.320  -1.380
  271    HB3  ALA  39           HB3      ALA  39  40.307  -6.204  -2.543
  272    HA   PRO  40           HA       PRO  40  42.148  -3.285   1.266
  273    HB2  PRO  40           HB2      PRO  40  41.290  -0.918   2.331
  274    HB3  PRO  40           HB1      PRO  40  42.340  -1.018   0.906
  275    HG2  PRO  40           HG2      PRO  40  39.408  -0.540   1.068
  276    HG3  PRO  40           HG1      PRO  40  40.614   0.186  -0.006
  277    HD2  PRO  40           HD2      PRO  40  38.923  -1.830  -0.791
  278    HD3  PRO  40           HD1      PRO  40  40.526  -1.562  -1.510
  279    H    GLN  41           HN       GLN  41  40.623  -5.185   1.928
  280    HA   GLN  41           HA       GLN  41  38.730  -4.461   4.037
  281    HB2  GLN  41           HB2      GLN  41  38.131  -6.817   4.045
  282    HB3  GLN  41           HB1      GLN  41  38.141  -6.222   2.384
  283    HG2  GLN  41           HG2      GLN  41  40.447  -7.114   2.107
  284    HG3  GLN  41           HG1      GLN  41  40.365  -7.774   3.739
  285   HE21  GLN  41          HE21      GLN  41  40.651  -9.936   2.617
  286   HE22  GLN  41          HE22      GLN  41  39.282 -10.690   1.955
  287    H    THR  42           HN       THR  42  41.585  -3.958   4.406
  288    HA   THR  42           HA       THR  42  42.033  -5.690   6.761
  289    HB   THR  42           HB       THR  42  44.442  -5.565   6.333
  290    HG1  THR  42           HG1      THR  42  43.695  -4.262   3.932
  291   HG21  THR  42          HG21      THR  42  44.517  -7.054   4.439
  292   HG22  THR  42          HG22      THR  42  42.993  -6.421   3.819
  293   HG23  THR  42          HG23      THR  42  43.012  -7.373   5.303
  294    H    GLY  43           HN       GLY  43  43.388  -4.672   8.432
  295    HA2  GLY  43           HA2      GLY  43  44.381  -2.671   9.370
  296    HA3  GLY  43           HA1      GLY  43  43.257  -1.720   8.402
  297    H    ILE  44           HN       ILE  44  41.351  -1.107   9.308
  298    HA   ILE  44           HA       ILE  44  40.900  -1.404  12.063
  299    HB   ILE  44           HB       ILE  44  39.086  -0.549   9.804
  300   HG12  ILE  44          HG12      ILE  44  40.384   1.076  12.004
  301   HG13  ILE  44          HG11      ILE  44  41.138   0.825  10.430
  302   HG21  ILE  44          HG21      ILE  44  37.686   0.409  11.653
  303   HG22  ILE  44          HG22      ILE  44  38.652  -0.529  12.793
  304   HG23  ILE  44          HG23      ILE  44  37.671  -1.351  11.579
  305   HD11  ILE  44          HD11      ILE  44  38.380   2.015  10.844
  306   HD12  ILE  44          HD12      ILE  44  39.229   1.850   9.307
  307   HD13  ILE  44          HD13      ILE  44  39.840   2.954  10.538
  308    H    VAL  45           HN       VAL  45  39.430  -3.010   9.257
  309    HA   VAL  45           HA       VAL  45  37.551  -4.559  10.667
  310    HB   VAL  45           HB       VAL  45  38.941  -4.991   8.023
  311   HG11  VAL  45          HG11      VAL  45  37.077  -6.689   7.665
  312   HG12  VAL  45          HG12      VAL  45  36.790  -6.623   9.404
  313   HG13  VAL  45          HG13      VAL  45  38.342  -7.196   8.788
  314   HG21  VAL  45          HG21      VAL  45  37.419  -3.124   8.000
  315   HG22  VAL  45          HG22      VAL  45  36.203  -4.029   8.901
  316   HG23  VAL  45          HG23      VAL  45  36.575  -4.470   7.235
  317    H    ASP  46           HN       ASP  46  40.872  -5.288   9.649
  318    HA   ASP  46           HA       ASP  46  40.923  -7.934  10.647
  319    HB2  ASP  46           HB2      ASP  46  43.117  -5.944  10.084
  320    HB3  ASP  46           HB1      ASP  46  43.427  -7.600  10.599
  321    H    GLU  47           HN       GLU  47  41.754  -4.811  12.130
  322    HA   GLU  47           HA       GLU  47  42.981  -5.815  14.444
  323    HB2  GLU  47           HB2      GLU  47  43.036  -3.446  13.806
  324    HB3  GLU  47           HB1      GLU  47  41.301  -3.318  14.094
  325    HG2  GLU  47           HG2      GLU  47  42.551  -2.469  16.025
  326    HG3  GLU  47           HG1      GLU  47  41.662  -3.923  16.471
  327    H    CYS  48           HN       CYS  48  39.571  -4.856  13.949
  328    HA   CYS  48           HA       CYS  48  38.723  -5.769  16.528
  329    HB2  CYS  48           HB2      CYS  48  37.147  -5.120  14.030
  330    HB3  CYS  48           HB1      CYS  48  36.447  -5.492  15.597
  331    H    CYS  49           HN       CYS  49  38.638  -7.143  13.269
  332    HA   CYS  49           HA       CYS  49  37.086  -9.403  13.824
  333    HB2  CYS  49           HB2      CYS  49  37.611  -8.686  11.529
  334    HB3  CYS  49           HB1      CYS  49  39.307  -9.088  11.788
  335    H    PHE  50           HN       PHE  50  40.617  -8.990  13.865
  336    HA   PHE  50           HA       PHE  50  40.994 -11.680  14.857
  337    HB2  PHE  50           HB2      PHE  50  42.831  -9.397  14.173
  338    HB3  PHE  50           HB1      PHE  50  43.438 -10.840  14.992
  339    HD1  PHE  50           HD1      PHE  50  41.587  -9.639  11.992
  340    HD2  PHE  50           HD2      PHE  50  43.844 -12.837  13.758
  341    HE1  PHE  50           HE1      PHE  50  41.655 -10.782   9.797
  342    HE2  PHE  50           HE2      PHE  50  43.917 -13.995  11.565
  343    HZ   PHE  50           HZ       PHE  50  42.824 -12.970   9.584
  344    H    ARG  51           HN       ARG  51  42.322  -8.595  16.065
  345    HA   ARG  51           HA       ARG  51  42.305  -9.585  18.779
  346    HB2  ARG  51           HB2      ARG  51  43.175  -6.993  17.516
  347    HB3  ARG  51           HB1      ARG  51  43.176  -7.236  19.264
  348    HG2  ARG  51           HG2      ARG  51  44.563  -9.315  18.885
  349    HG3  ARG  51           HG1      ARG  51  44.704  -8.836  17.193
  350    HD2  ARG  51           HD2      ARG  51  45.483  -7.039  19.496
  351    HD3  ARG  51           HD1      ARG  51  46.622  -8.103  18.677
  352    HE   ARG  51           HE       ARG  51  45.367  -6.583  16.704
  353   HH11  ARG  51          HH11      ARG  51  47.391  -6.095  19.502
  354   HH12  ARG  51          HH12      ARG  51  48.143  -4.676  18.863
  355   HH21  ARG  51          HH21      ARG  51  46.380  -4.724  15.886
  356   HH22  ARG  51          HH22      ARG  51  47.573  -3.901  16.832
  357    H    SER  52           HN       SER  52  41.364  -8.274  20.561
  358    HA   SER  52           HA       SER  52  38.615  -7.558  19.887
  359    HB2  SER  52           HB2      SER  52  38.931  -8.997  21.810
  360    HB3  SER  52           HB1      SER  52  40.056  -7.852  22.532
  361    HG   SER  52           HG       SER  52  37.434  -7.929  22.779
  362    H    CYS  53           HN       CYS  53  38.753  -5.556  18.885
  363    HA   CYS  53           HA       CYS  53  40.269  -3.384  20.013
  364    HB2  CYS  53           HB2      CYS  53  39.243  -2.047  18.245
  365    HB3  CYS  53           HB1      CYS  53  39.818  -3.573  17.585
  366    H    ASP  54           HN       ASP  54  39.488  -1.555  21.071
  367    HA   ASP  54           HA       ASP  54  37.324  -1.975  22.865
  368    HB2  ASP  54           HB2      ASP  54  38.956   0.463  22.155
  369    HB3  ASP  54           HB1      ASP  54  37.685   0.490  23.378
  370    H    LEU  55           HN       LEU  55  35.245  -1.232  22.857
  371    HA   LEU  55           HA       LEU  55  33.986  -0.731  20.371
  372    HB2  LEU  55           HB2      LEU  55  33.052  -0.389  23.227
  373    HB3  LEU  55           HB1      LEU  55  32.004  -0.134  21.832
  374    HG   LEU  55           HG       LEU  55  33.554  -2.698  22.270
  375   HD11  LEU  55          HD11      LEU  55  30.652  -2.126  22.949
  376   HD12  LEU  55          HD12      LEU  55  31.946  -2.268  24.138
  377   HD13  LEU  55          HD13      LEU  55  31.495  -3.660  23.155
  378   HD21  LEU  55          HD21      LEU  55  31.653  -3.504  20.721
  379   HD22  LEU  55          HD22      LEU  55  32.885  -2.478  19.990
  380   HD23  LEU  55          HD23      LEU  55  31.320  -1.796  20.432
  381    H    ARG  56           HN       ARG  56  35.017   1.404  23.009
  382    HA   ARG  56           HA       ARG  56  33.835   3.775  22.088
  383    HB2  ARG  56           HB2      ARG  56  34.839   3.554  24.321
  384    HB3  ARG  56           HB1      ARG  56  36.439   3.415  23.590
  385    HG2  ARG  56           HG2      ARG  56  36.269   5.655  22.664
  386    HG3  ARG  56           HG1      ARG  56  34.604   5.801  23.229
  387    HD2  ARG  56           HD2      ARG  56  36.977   5.356  25.052
  388    HD3  ARG  56           HD1      ARG  56  36.280   6.935  24.715
  389    HE   ARG  56           HE       ARG  56  34.187   5.306  25.569
  390   HH11  ARG  56          HH11      ARG  56  37.211   6.531  26.798
  391   HH12  ARG  56          HH12      ARG  56  36.677   6.549  28.442
  392   HH21  ARG  56          HH21      ARG  56  33.511   5.340  27.733
  393   HH22  ARG  56          HH22      ARG  56  34.595   5.879  28.971
  394    H    ARG  57           HN       ARG  57  37.115   2.465  21.471
  395    HA   ARG  57           HA       ARG  57  37.990   4.531  19.795
  396    HB2  ARG  57           HB2      ARG  57  39.366   2.695  20.881
  397    HB3  ARG  57           HB1      ARG  57  38.816   1.648  19.571
  398    HG2  ARG  57           HG2      ARG  57  39.782   3.089  17.909
  399    HG3  ARG  57           HG1      ARG  57  40.135   4.326  19.118
  400    HD2  ARG  57           HD2      ARG  57  42.186   3.124  18.694
  401    HD3  ARG  57           HD1      ARG  57  41.598   2.662  20.288
  402    HE   ARG  57           HE       ARG  57  41.128   0.535  19.476
  403   HH11  ARG  57          HH11      ARG  57  41.947   2.699  16.859
  404   HH12  ARG  57          HH12      ARG  57  42.105   1.429  15.700
  405   HH21  ARG  57          HH21      ARG  57  41.369  -1.111  17.924
  406   HH22  ARG  57          HH22      ARG  57  41.776  -0.705  16.290
  407    H    LEU  58           HN       LEU  58  36.153   1.590  19.184
  408    HA   LEU  58           HA       LEU  58  36.263   1.564  16.383
  409    HB2  LEU  58           HB2      LEU  58  35.325  -0.244  17.887
  410    HB3  LEU  58           HB1      LEU  58  33.870   0.742  18.035
  411    HG   LEU  58           HG       LEU  58  33.783   0.762  15.482
  412   HD11  LEU  58          HD11      LEU  58  36.023   0.097  14.947
  413   HD12  LEU  58          HD12      LEU  58  34.985  -1.235  14.460
  414   HD13  LEU  58          HD13      LEU  58  35.908  -1.334  15.961
  415   HD21  LEU  58          HD21      LEU  58  33.464  -1.769  17.104
  416   HD22  LEU  58          HD22      LEU  58  32.985  -1.682  15.409
  417   HD23  LEU  58          HD23      LEU  58  32.214  -0.632  16.598
  418    H    ASP  59           HN       ASP  59  34.230   3.380  18.615
  419    HA   ASP  59           HA       ASP  59  32.301   4.335  16.816
  420    HB2  ASP  59           HB2      ASP  59  32.275   4.571  19.327
  421    HB3  ASP  59           HB1      ASP  59  33.444   5.876  19.149
  422    H    MET  60           HN       MET  60  35.652   5.045  17.046
  423    HA   MET  60           HA       MET  60  35.749   7.687  16.110
  424    HB2  MET  60           HB2      MET  60  37.666   5.381  15.765
  425    HB3  MET  60           HB1      MET  60  38.024   7.033  15.274
  426    HG2  MET  60           HG2      MET  60  37.154   6.311  18.082
  427    HG3  MET  60           HG1      MET  60  38.848   6.409  17.597
  428    HE1  MET  60           HE1      MET  60  40.164   8.986  17.485
  429    HE2  MET  60           HE2      MET  60  39.281   9.888  16.256
  430    HE3  MET  60           HE3      MET  60  39.578   8.165  16.032
  431    H    TYR  61           HN       TYR  61  35.450   4.607  14.404
  432    HA   TYR  61           HA       TYR  61  35.681   5.835  11.795
  433    HB2  TYR  61           HB2      TYR  61  34.575   3.087  12.277
  434    HB3  TYR  61           HB1      TYR  61  35.541   3.684  10.929
  435    HD1  TYR  61           HD1      TYR  61  35.804   1.460  13.438
  436    HD2  TYR  61           HD2      TYR  61  37.780   5.039  12.105
  437    HE1  TYR  61           HE1      TYR  61  37.882   0.740  14.581
  438    HE2  TYR  61           HE2      TYR  61  39.856   4.325  13.262
  439    HH   TYR  61           HH       TYR  61  39.917   1.745  15.501
  440    H    CYS  62           HN       CYS  62  33.495   6.779  13.623
  441    HA   CYS  62           HA       CYS  62  31.139   6.014  12.050
  442    HB2  CYS  62           HB2      CYS  62  31.374   7.314  14.765
  443    HB3  CYS  62           HB1      CYS  62  29.853   7.020  13.927
  444    H    ALA  63           HN       ALA  63  29.838   7.612  11.131
  445    HA   ALA  63           HA       ALA  63  31.160   9.859  10.128
  446    HB1  ALA  63           HB1      ALA  63  28.170   9.747  10.250
  447    HB2  ALA  63           HB2      ALA  63  29.040   8.572   9.263
  448    HB3  ALA  63           HB3      ALA  63  29.213  10.297   8.940
  449    HA   PRO  64           HA       PRO  64  30.554  12.796  13.387
  450    HB2  PRO  64           HB2      PRO  64  30.614  15.127  11.972
  451    HB3  PRO  64           HB1      PRO  64  32.056  14.137  12.267
  452    HG2  PRO  64           HG2      PRO  64  30.364  14.340   9.829
  453    HG3  PRO  64           HG1      PRO  64  32.121  14.180   9.977
  454    HD2  PRO  64           HD2      PRO  64  30.453  12.075   9.369
  455    HD3  PRO  64           HD1      PRO  64  32.029  11.876  10.162
  456    H    LEU  65           HN       LEU  65  29.040  14.278  14.303
  457    HA   LEU  65           HA       LEU  65  26.324  13.851  13.438
  458    HB2  LEU  65           HB2      LEU  65  27.506  15.522  15.665
  459    HB3  LEU  65           HB1      LEU  65  25.776  15.307  15.396
  460    HG   LEU  65           HG       LEU  65  27.687  12.987  15.764
  461   HD11  LEU  65          HD11      LEU  65  27.752  14.186  17.834
  462   HD12  LEU  65          HD12      LEU  65  26.590  12.881  18.067
  463   HD13  LEU  65          HD13      LEU  65  26.022  14.524  17.771
  464   HD21  LEU  65          HD21      LEU  65  25.458  11.880  16.371
  465   HD22  LEU  65          HD22      LEU  65  25.667  12.302  14.672
  466   HD23  LEU  65          HD23      LEU  65  24.676  13.318  15.718
  467    H    LYS  66           HN       LYS  66  24.885  15.346  12.627
  468    HA   LYS  66           HA       LYS  66  26.010  17.384  10.991
  469    HB2  LYS  66           HB2      LYS  66  23.144  16.721  11.679
  470    HB3  LYS  66           HB1      LYS  66  23.612  17.952  10.507
  471    HG2  LYS  66           HG2      LYS  66  24.850  16.250   9.215
  472    HG3  LYS  66           HG1      LYS  66  24.362  15.017  10.380
  473    HD2  LYS  66           HD2      LYS  66  21.993  15.459   9.857
  474    HD3  LYS  66           HD1      LYS  66  22.480  16.685   8.687
  475    HE2  LYS  66           HE2      LYS  66  23.709  14.970   7.400
  476    HE3  LYS  66           HE1      LYS  66  23.210  13.744   8.566
  477    HZ1  LYS  66           HZ1      LYS  66  21.201  15.420   7.211
  478    HZ2  LYS  66           HZ2      LYS  66  21.019  13.882   7.908
  479    HZ3  LYS  66           HZ3      LYS  66  21.842  14.056   6.432
  480    HA   PRO  67           HA       PRO  67  26.017  20.988  13.523
  481    HB2  PRO  67           HB2      PRO  67  24.280  22.335  11.504
  482    HB3  PRO  67           HB1      PRO  67  25.867  22.822  12.131
  483    HG2  PRO  67           HG2      PRO  67  25.619  21.817   9.694
  484    HG3  PRO  67           HG1      PRO  67  27.009  21.405  10.716
  485    HD2  PRO  67           HD2      PRO  67  24.595  19.757  10.062
  486    HD3  PRO  67           HD1      PRO  67  26.288  19.258  10.270
  487    H    ALA  68           HN       ALA  68  24.814  21.863  15.173
  488    HA   ALA  68           HA       ALA  68  21.898  21.877  15.027
  489    HB1  ALA  68           HB1      ALA  68  21.496  20.413  16.794
  490    HB2  ALA  68           HB2      ALA  68  23.144  20.541  17.409
  491    HB3  ALA  68           HB3      ALA  68  22.817  19.607  15.949
  492    H    LYS  69           HN       LYS  69  20.923  23.209  16.613
  493    HA   LYS  69           HA       LYS  69  22.624  24.641  18.490
  494    HB2  LYS  69           HB2      LYS  69  22.078  26.849  17.613
  495    HB3  LYS  69           HB1      LYS  69  22.886  25.898  16.366
  496    HG2  LYS  69           HG2      LYS  69  20.689  25.313  15.392
  497    HG3  LYS  69           HG1      LYS  69  19.889  26.293  16.622
  498    HD2  LYS  69           HD2      LYS  69  21.139  28.285  15.816
  499    HD3  LYS  69           HD1      LYS  69  21.855  27.295  14.543
  500    HE2  LYS  69           HE2      LYS  69  18.879  27.744  14.931
  501    HE3  LYS  69           HE1      LYS  69  19.878  28.560  13.727
  502    HZ1  LYS  69           HZ1      LYS  69  20.487  26.290  12.910
  503    HZ2  LYS  69           HZ2      LYS  69  18.867  26.734  12.657
  504    HZ3  LYS  69           HZ3      LYS  69  19.271  25.665  13.914
  505    H    SER  70           HN       SER  70  21.388  25.990  19.963
  506    HA   SER  70           HA       SER  70  18.484  25.681  19.920
  507    HB2  SER  70           HB2      SER  70  19.223  23.665  21.092
  508    HB3  SER  70           HB1      SER  70  20.193  24.642  22.192
  509    HG   SER  70           HG       SER  70  17.874  23.954  22.732
  510    H    ALA  71           HN       ALA  71  17.406  27.242  21.111
  511    HA   ALA  71           HA       ALA  71  19.006  29.565  21.831
  512    HB1  ALA  71           HB1      ALA  71  16.992  29.946  20.535
  513    HB2  ALA  71           HB2      ALA  71  16.782  30.651  22.137
  514    HB3  ALA  71           HB3      ALA  71  16.014  29.113  21.744
  Start of MODEL   15
    1    H1   GLY   1           HT1      GLY   1  34.361 -12.531  21.533
    2    H2   GLY   1           HT2      GLY   1  33.502 -12.903  22.950
    3    H3   GLY   1           HT3      GLY   1  34.765 -13.912  22.431
    4    HA2  GLY   1           HA2      GLY   1  35.279 -11.079  23.059
    5    HA3  GLY   1           HA1      GLY   1  35.222 -12.287  24.342
    6    H    GLY   2           HN       GLY   2  37.522 -10.743  23.429
    7    HA2  GLY   2           HA2      GLY   2  39.793 -11.235  23.349
    8    HA3  GLY   2           HA1      GLY   2  39.388 -12.936  23.141
    9    HA   PRO   3           HA       PRO   3  40.969 -11.181  19.109
   10    HB2  PRO   3           HB2      PRO   3  42.548 -13.684  19.148
   11    HB3  PRO   3           HB1      PRO   3  43.087 -12.018  18.873
   12    HG2  PRO   3           HG2      PRO   3  43.657 -13.320  21.132
   13    HG3  PRO   3           HG1      PRO   3  43.319 -11.579  21.114
   14    HD2  PRO   3           HD2      PRO   3  41.508 -13.840  21.906
   15    HD3  PRO   3           HD1      PRO   3  41.729 -12.252  22.681
   16    H    GLU   4           HN       GLU   4  40.772 -12.171  16.952
   17    HA   GLU   4           HA       GLU   4  39.637 -13.384  15.356
   18    HB2  GLU   4           HB2      GLU   4  39.648 -15.530  17.494
   19    HB3  GLU   4           HB1      GLU   4  39.272 -15.772  15.791
   20    HG2  GLU   4           HG2      GLU   4  41.526 -14.967  15.178
   21    HG3  GLU   4           HG1      GLU   4  41.905 -14.748  16.886
   22    H    THR   5           HN       THR   5  38.132 -11.574  16.720
   23    HA   THR   5           HA       THR   5  35.526 -12.963  16.914
   24    HB   THR   5           HB       THR   5  34.866 -11.394  18.704
   25    HG1  THR   5           HG1      THR   5  37.593 -10.636  18.545
   26   HG21  THR   5          HG21      THR   5  35.660 -13.531  19.434
   27   HG22  THR   5          HG22      THR   5  36.438 -12.331  20.466
   28   HG23  THR   5          HG23      THR   5  37.340 -13.077  19.148
   29    H    LEU   6           HN       LEU   6  33.672 -11.604  16.424
   30    HA   LEU   6           HA       LEU   6  32.579 -10.253  14.909
   31    HB2  LEU   6           HB2      LEU   6  34.682  -8.272  15.823
   32    HB3  LEU   6           HB1      LEU   6  33.126  -7.880  15.090
   33    HG   LEU   6           HG       LEU   6  33.488  -9.373  17.705
   34   HD11  LEU   6          HD11      LEU   6  32.532  -6.541  17.182
   35   HD12  LEU   6          HD12      LEU   6  34.126  -6.965  17.809
   36   HD13  LEU   6          HD13      LEU   6  32.682  -7.319  18.759
   37   HD21  LEU   6          HD21      LEU   6  31.438 -10.059  16.668
   38   HD22  LEU   6          HD22      LEU   6  31.069  -8.414  16.156
   39   HD23  LEU   6          HD23      LEU   6  30.993  -8.843  17.864
   40    H    CYS   7           HN       CYS   7  33.692 -11.792  13.301
   41    HA   CYS   7           HA       CYS   7  35.262 -10.140  11.414
   42    HB2  CYS   7           HB2      CYS   7  36.426 -12.132  12.749
   43    HB3  CYS   7           HB1      CYS   7  35.679 -13.094  11.479
   44    H    GLY   8           HN       GLY   8  33.262  -9.664  10.352
   45    HA2  GLY   8           HA2      GLY   8  32.616 -10.743   8.049
   46    HA3  GLY   8           HA1      GLY   8  31.849 -11.918   9.112
   47    H    ALA   9           HN       ALA   9  29.733 -11.517   8.715
   48    HA   ALA   9           HA       ALA   9  28.556  -9.001   8.306
   49    HB1  ALA   9           HB1      ALA   9  27.115 -10.655   7.647
   50    HB2  ALA   9           HB2      ALA   9  26.463 -10.371   9.263
   51    HB3  ALA   9           HB3      ALA   9  27.562 -11.724   8.977
   52    H    GLU  10           HN       GLU  10  29.205 -10.830  11.247
   53    HA   GLU  10           HA       GLU  10  27.628  -9.356  13.037
   54    HB2  GLU  10           HB2      GLU  10  30.237 -10.836  13.417
   55    HB3  GLU  10           HB1      GLU  10  29.321 -10.138  14.752
   56    HG2  GLU  10           HG2      GLU  10  27.401 -11.520  14.244
   57    HG3  GLU  10           HG1      GLU  10  28.159 -12.107  12.765
   58    H    LEU  11           HN       LEU  11  30.956  -8.825  11.910
   59    HA   LEU  11           HA       LEU  11  31.524  -6.625  13.588
   60    HB2  LEU  11           HB2      LEU  11  33.283  -7.815  12.402
   61    HB3  LEU  11           HB1      LEU  11  32.610  -7.322  10.850
   62    HG   LEU  11           HG       LEU  11  32.995  -4.945  11.458
   63   HD11  LEU  11          HD11      LEU  11  34.134  -6.209  13.960
   64   HD12  LEU  11          HD12      LEU  11  32.849  -5.005  13.848
   65   HD13  LEU  11          HD13      LEU  11  34.512  -4.558  13.467
   66   HD21  LEU  11          HD21      LEU  11  35.322  -4.951  11.046
   67   HD22  LEU  11          HD22      LEU  11  34.746  -6.451  10.318
   68   HD23  LEU  11          HD23      LEU  11  35.559  -6.484  11.885
   69    H    VAL  12           HN       VAL  12  30.298  -6.785  10.248
   70    HA   VAL  12           HA       VAL  12  30.119  -4.027   9.812
   71    HB   VAL  12           HB       VAL  12  28.666  -6.393   8.645
   72   HG11  VAL  12          HG11      VAL  12  27.865  -4.691   6.901
   73   HG12  VAL  12          HG12      VAL  12  28.313  -3.431   8.049
   74   HG13  VAL  12          HG13      VAL  12  27.054  -4.593   8.463
   75   HG21  VAL  12          HG21      VAL  12  30.697  -4.405   7.581
   76   HG22  VAL  12          HG22      VAL  12  29.989  -5.731   6.655
   77   HG23  VAL  12          HG23      VAL  12  31.018  -6.076   8.045
   78    H    ASP  13           HN       ASP  13  27.735  -6.342  11.052
   79    HA   ASP  13           HA       ASP  13  25.592  -4.536  11.350
   80    HB2  ASP  13           HB2      ASP  13  26.252  -7.150  12.714
   81    HB3  ASP  13           HB1      ASP  13  24.766  -6.254  13.032
   82    H    ALA  14           HN       ALA  14  28.234  -5.480  13.505
   83    HA   ALA  14           HA       ALA  14  27.326  -4.178  15.830
   84    HB1  ALA  14           HB1      ALA  14  29.325  -5.825  15.454
   85    HB2  ALA  14           HB2      ALA  14  29.430  -4.595  16.715
   86    HB3  ALA  14           HB3      ALA  14  30.244  -4.347  15.169
   87    H    LEU  15           HN       LEU  15  29.275  -3.040  13.097
   88    HA   LEU  15           HA       LEU  15  29.941  -0.507  14.142
   89    HB2  LEU  15           HB2      LEU  15  29.624  -1.540  11.323
   90    HB3  LEU  15           HB1      LEU  15  30.137   0.113  11.668
   91    HG   LEU  15           HG       LEU  15  31.527  -2.273  12.899
   92   HD11  LEU  15          HD11      LEU  15  31.598  -2.454  10.412
   93   HD12  LEU  15          HD12      LEU  15  33.186  -2.111  11.101
   94   HD13  LEU  15          HD13      LEU  15  32.262  -0.821  10.334
   95   HD21  LEU  15          HD21      LEU  15  31.953  -0.109  13.952
   96   HD22  LEU  15          HD22      LEU  15  32.276   0.626  12.384
   97   HD23  LEU  15          HD23      LEU  15  33.382  -0.582  13.036
   98    H    GLN  16           HN       GLN  16  27.171  -1.598  12.209
   99    HA   GLN  16           HA       GLN  16  25.961   0.962  11.960
  100    HB2  GLN  16           HB2      GLN  16  25.412  -0.979  10.509
  101    HB3  GLN  16           HB1      GLN  16  24.641  -1.759  11.890
  102    HG2  GLN  16           HG2      GLN  16  23.080   0.135  12.099
  103    HG3  GLN  16           HG1      GLN  16  23.856   0.925  10.728
  104   HE21  GLN  16          HE21      GLN  16  22.591   0.668   8.887
  105   HE22  GLN  16          HE22      GLN  16  21.741  -0.743   8.479
  106    H    PHE  17           HN       PHE  17  25.609  -1.682  14.290
  107    HA   PHE  17           HA       PHE  17  23.447  -0.636  15.752
  108    HB2  PHE  17           HB2      PHE  17  24.090  -2.905  16.129
  109    HB3  PHE  17           HB1      PHE  17  25.738  -2.442  16.552
  110    HD1  PHE  17           HD1      PHE  17  22.206  -2.432  17.676
  111    HD2  PHE  17           HD2      PHE  17  26.288  -1.544  18.728
  112    HE1  PHE  17           HE1      PHE  17  21.540  -2.183  20.053
  113    HE2  PHE  17           HE2      PHE  17  25.611  -1.305  21.107
  114    HZ   PHE  17           HZ       PHE  17  23.243  -1.623  21.768
  115    H    VAL  18           HN       VAL  18  26.956  -0.319  16.292
  116    HA   VAL  18           HA       VAL  18  26.773   1.295  18.591
  117    HB   VAL  18           HB       VAL  18  28.955   1.075  16.506
  118   HG11  VAL  18          HG11      VAL  18  29.214   3.177  17.690
  119   HG12  VAL  18          HG12      VAL  18  30.392   2.032  18.325
  120   HG13  VAL  18          HG13      VAL  18  28.923   2.380  19.236
  121   HG21  VAL  18          HG21      VAL  18  29.964  -0.488  18.009
  122   HG22  VAL  18          HG22      VAL  18  28.272  -0.970  17.883
  123   HG23  VAL  18          HG23      VAL  18  28.833  -0.085  19.300
  124    H    CYS  19           HN       CYS  19  27.141   2.163  15.162
  125    HA   CYS  19           HA       CYS  19  26.360   4.926  15.874
  126    HB2  CYS  19           HB2      CYS  19  28.185   4.013  13.638
  127    HB3  CYS  19           HB1      CYS  19  27.711   5.680  13.964
  128    H    GLY  20           HN       GLY  20  24.212   3.605  15.550
  129    HA2  GLY  20           HA2      GLY  20  23.378   2.953  12.924
  130    HA3  GLY  20           HA1      GLY  20  22.315   3.268  14.291
  131    H    ASP  21           HN       ASP  21  23.010   5.892  14.873
  132    HA   ASP  21           HA       ASP  21  21.572   7.280  12.792
  133    HB2  ASP  21           HB2      ASP  21  21.861   9.251  14.334
  134    HB3  ASP  21           HB1      ASP  21  21.039   7.868  15.050
  135    H    ARG  22           HN       ARG  22  24.791   7.633  14.285
  136    HA   ARG  22           HA       ARG  22  25.686   9.665  12.536
  137    HB2  ARG  22           HB2      ARG  22  27.165   7.665  14.249
  138    HB3  ARG  22           HB1      ARG  22  27.977   8.935  13.331
  139    HG2  ARG  22           HG2      ARG  22  26.781  10.656  14.535
  140    HG3  ARG  22           HG1      ARG  22  25.768   9.454  15.335
  141    HD2  ARG  22           HD2      ARG  22  28.775   9.570  15.622
  142    HD3  ARG  22           HD1      ARG  22  27.656  10.320  16.756
  143    HE   ARG  22           HE       ARG  22  26.917   7.624  16.454
  144   HH11  ARG  22          HH11      ARG  22  29.534   9.574  17.677
  145   HH12  ARG  22          HH12      ARG  22  29.996   8.417  18.876
  146   HH21  ARG  22          HH21      ARG  22  27.545   6.119  18.032
  147   HH22  ARG  22          HH22      ARG  22  28.881   6.470  19.078
  148    H    GLY  23           HN       GLY  23  25.928   6.143  12.431
  149    HA2  GLY  23           HA2      GLY  23  26.204   4.751  10.596
  150    HA3  GLY  23           HA1      GLY  23  26.277   6.181   9.569
  151    H    PHE  24           HN       PHE  24  28.015   4.547   8.709
  152    HA   PHE  24           HA       PHE  24  30.589   5.607   9.563
  153    HB2  PHE  24           HB2      PHE  24  31.607   3.392   9.838
  154    HB3  PHE  24           HB1      PHE  24  30.299   3.619  10.998
  155    HD1  PHE  24           HD1      PHE  24  31.489   1.724   8.123
  156    HD2  PHE  24           HD2      PHE  24  28.068   2.567  10.578
  157    HE1  PHE  24           HE1      PHE  24  30.349  -0.281   7.225
  158    HE2  PHE  24           HE2      PHE  24  26.930   0.556   9.683
  159    HZ   PHE  24           HZ       PHE  24  28.070  -0.869   8.007
  160    H    TYR  25           HN       TYR  25  32.301   5.100   8.045
  161    HA   TYR  25           HA       TYR  25  31.239   4.725   5.326
  162    HB2  TYR  25           HB2      TYR  25  33.472   5.671   4.638
  163    HB3  TYR  25           HB1      TYR  25  32.454   6.778   5.556
  164    HD1  TYR  25           HD1      TYR  25  35.277   4.362   5.874
  165    HD2  TYR  25           HD2      TYR  25  33.169   7.665   7.629
  166    HE1  TYR  25           HE1      TYR  25  37.054   4.585   7.586
  167    HE2  TYR  25           HE2      TYR  25  34.947   7.891   9.343
  168    HH   TYR  25           HH       TYR  25  37.194   7.310   9.746
  169    H    PHE  26           HN       PHE  26  32.884   3.034   7.742
  170    HA   PHE  26           HA       PHE  26  33.954   1.027   7.787
  171    HB2  PHE  26           HB2      PHE  26  32.074   0.239   6.440
  172    HB3  PHE  26           HB1      PHE  26  32.861   0.801   4.971
  173    HD1  PHE  26           HD1      PHE  26  33.395  -1.445   7.900
  174    HD2  PHE  26           HD2      PHE  26  34.339  -0.599   3.797
  175    HE1  PHE  26           HE1      PHE  26  34.627  -3.586   7.740
  176    HE2  PHE  26           HE2      PHE  26  35.578  -2.742   3.638
  177    HZ   PHE  26           HZ       PHE  26  35.722  -4.237   5.611
  178    H    ASN  27           HN       ASN  27  34.506   1.410   4.318
  179    HA   ASN  27           HA       ASN  27  37.357   1.844   4.888
  180    HB2  ASN  27           HB2      ASN  27  37.861   0.527   2.932
  181    HB3  ASN  27           HB1      ASN  27  36.800  -0.414   3.975
  182   HD21  ASN  27          HD21      ASN  27  36.880  -1.107   1.269
  183   HD22  ASN  27          HD22      ASN  27  35.437  -0.633   0.511
  184    H    LYS  28           HN       LYS  28  34.870   3.618   4.140
  185    HA   LYS  28           HA       LYS  28  34.426   5.426   2.799
  186    HB2  LYS  28           HB2      LYS  28  36.627   5.963   4.073
  187    HB3  LYS  28           HB1      LYS  28  37.386   5.765   2.493
  188    HG2  LYS  28           HG2      LYS  28  35.790   7.422   1.546
  189    HG3  LYS  28           HG1      LYS  28  35.115   7.662   3.157
  190    HD2  LYS  28           HD2      LYS  28  38.044   8.067   2.506
  191    HD3  LYS  28           HD1      LYS  28  36.856   9.371   2.484
  192    HE2  LYS  28           HE2      LYS  28  36.289   8.838   4.858
  193    HE3  LYS  28           HE1      LYS  28  37.577   7.635   4.864
  194    HZ1  LYS  28           HZ1      LYS  28  37.849  10.560   4.479
  195    HZ2  LYS  28           HZ2      LYS  28  39.111   9.460   4.194
  196    HZ3  LYS  28           HZ3      LYS  28  38.460   9.624   5.755
  197    HA   PRO  29           HA       PRO  29  35.336   2.974  -1.058
  198    HB2  PRO  29           HB2      PRO  29  32.730   3.022  -1.933
  199    HB3  PRO  29           HB1      PRO  29  33.402   1.749  -0.896
  200    HG2  PRO  29           HG2      PRO  29  31.745   4.114  -0.170
  201    HG3  PRO  29           HG1      PRO  29  31.682   2.454   0.450
  202    HD2  PRO  29           HD2      PRO  29  32.859   4.471   1.827
  203    HD3  PRO  29           HD1      PRO  29  33.437   2.795   1.926
  204    H    THR  30           HN       THR  30  33.911   6.020  -0.301
  205    HA   THR  30           HA       THR  30  34.221   6.939  -3.091
  206    HB   THR  30           HB       THR  30  32.792   8.845  -2.403
  207    HG1  THR  30           HG1      THR  30  31.844   8.779  -0.375
  208   HG21  THR  30          HG21      THR  30  31.710   6.067  -1.877
  209   HG22  THR  30          HG22      THR  30  31.713   6.930  -3.415
  210   HG23  THR  30          HG23      THR  30  30.698   7.495  -2.089
  211    H    GLY  31           HN       GLY  31  36.298   6.588  -0.860
  212    HA2  GLY  31           HA2      GLY  31  37.195   9.383  -0.627
  213    HA3  GLY  31           HA1      GLY  31  37.712   8.055   0.408
  214    H    TYR  32           HN       TYR  32  37.478   7.245  -2.905
  215    HA   TYR  32           HA       TYR  32  40.193   6.599  -3.108
  216    HB2  TYR  32           HB2      TYR  32  37.984   6.864  -5.124
  217    HB3  TYR  32           HB1      TYR  32  39.629   6.469  -5.619
  218    HD1  TYR  32           HD1      TYR  32  36.620   5.285  -3.926
  219    HD2  TYR  32           HD2      TYR  32  40.719   4.387  -4.816
  220    HE1  TYR  32           HE1      TYR  32  36.242   2.921  -3.272
  221    HE2  TYR  32           HE2      TYR  32  40.344   2.024  -4.166
  222    HH   TYR  32           HH       TYR  32  37.423   0.625  -3.925
  223    H    GLY  33           HN       GLY  33  38.343   9.384  -4.200
  224    HA2  GLY  33           HA2      GLY  33  40.352  10.647  -5.724
  225    HA3  GLY  33           HA1      GLY  33  38.967  11.449  -4.995
  226    H    SER  34           HN       SER  34  39.580  10.738  -2.284
  227    HA   SER  34           HA       SER  34  41.712  12.695  -1.803
  228    HB2  SER  34           HB2      SER  34  39.639  11.489   0.040
  229    HB3  SER  34           HB1      SER  34  40.847  12.675   0.530
  230    HG   SER  34           HG       SER  34  38.751  12.955  -1.359
  231    H    SER  35           HN       SER  35  41.510   9.414  -2.145
  232    HA   SER  35           HA       SER  35  42.933   8.433   0.075
  233    HB2  SER  35           HB2      SER  35  43.107   6.436  -1.155
  234    HB3  SER  35           HB1      SER  35  41.613   7.181  -1.726
  235    HG   SER  35           HG       SER  35  42.661   6.720  -3.563
  236    H    SER  36           HN       SER  36  43.902  10.230  -2.716
  237    HA   SER  36           HA       SER  36  45.936  11.053  -3.380
  238    HB2  SER  36           HB2      SER  36  47.407  11.639  -1.723
  239    HB3  SER  36           HB1      SER  36  46.014  11.255  -0.719
  240    HG   SER  36           HG       SER  36  46.952   9.444  -0.086
  241    H    ARG  37           HN       ARG  37  48.514  10.158  -3.030
  242    HA   ARG  37           HA       ARG  37  48.654   7.990  -4.832
  243    HB2  ARG  37           HB2      ARG  37  50.723   9.222  -3.005
  244    HB3  ARG  37           HB1      ARG  37  51.094   7.970  -4.191
  245    HG2  ARG  37           HG2      ARG  37  50.266   9.389  -6.001
  246    HG3  ARG  37           HG1      ARG  37  49.804  10.637  -4.841
  247    HD2  ARG  37           HD2      ARG  37  52.156  10.866  -4.152
  248    HD3  ARG  37           HD1      ARG  37  52.620   9.623  -5.309
  249    HE   ARG  37           HE       ARG  37  51.219  11.670  -6.663
  250   HH11  ARG  37          HH11      ARG  37  54.222  11.054  -5.009
  251   HH12  ARG  37          HH12      ARG  37  55.112  12.211  -5.938
  252   HH21  ARG  37          HH21      ARG  37  52.405  13.185  -7.868
  253   HH22  ARG  37          HH22      ARG  37  54.092  13.412  -7.546
  254    H    ARG  38           HN       ARG  38  48.915   8.176  -1.314
  255    HA   ARG  38           HA       ARG  38  48.638   5.243  -1.202
  256    HB2  ARG  38           HB2      ARG  38  50.251   5.180   0.668
  257    HB3  ARG  38           HB1      ARG  38  51.003   5.748  -0.823
  258    HG2  ARG  38           HG2      ARG  38  50.495   8.121  -0.008
  259    HG3  ARG  38           HG1      ARG  38  50.120   7.394   1.553
  260    HD2  ARG  38           HD2      ARG  38  52.741   7.001   0.094
  261    HD3  ARG  38           HD1      ARG  38  52.491   8.194   1.363
  262    HE   ARG  38           HE       ARG  38  52.737   5.321   1.707
  263   HH11  ARG  38          HH11      ARG  38  51.643   8.356   3.043
  264   HH12  ARG  38          HH12      ARG  38  51.708   7.796   4.677
  265   HH21  ARG  38          HH21      ARG  38  52.803   4.613   3.864
  266   HH22  ARG  38          HH22      ARG  38  52.355   5.695   5.142
  267    H    ALA  39           HN       ALA  39  47.798   4.463   0.849
  268    HA   ALA  39           HA       ALA  39  46.266   6.512   2.326
  269    HB1  ALA  39           HB1      ALA  39  44.463   4.757   2.533
  270    HB2  ALA  39           HB2      ALA  39  45.313   3.855   1.276
  271    HB3  ALA  39           HB3      ALA  39  44.671   5.462   0.931
  272    HA   PRO  40           HA       PRO  40  48.749   3.959   5.286
  273    HB2  PRO  40           HB2      PRO  40  49.344   6.047   6.956
  274    HB3  PRO  40           HB1      PRO  40  50.304   5.643   5.521
  275    HG2  PRO  40           HG2      PRO  40  48.248   7.763   5.890
  276    HG3  PRO  40           HG1      PRO  40  49.778   7.816   5.000
  277    HD2  PRO  40           HD2      PRO  40  47.355   7.501   3.784
  278    HD3  PRO  40           HD1      PRO  40  48.867   6.858   3.115
  279    H    GLN  41           HN       GLN  41  46.415   3.172   5.621
  280    HA   GLN  41           HA       GLN  41  45.549   3.957   8.294
  281    HB2  GLN  41           HB2      GLN  41  44.145   5.273   6.765
  282    HB3  GLN  41           HB1      GLN  41  43.700   3.802   5.898
  283    HG2  GLN  41           HG2      GLN  41  42.673   2.888   7.919
  284    HG3  GLN  41           HG1      GLN  41  43.165   4.311   8.835
  285   HE21  GLN  41          HE21      GLN  41  40.466   3.863   8.854
  286   HE22  GLN  41          HE22      GLN  41  39.659   4.934   7.813
  287    H    THR  42           HN       THR  42  45.853   2.095   9.318
  288    HA   THR  42           HA       THR  42  45.936  -0.479   8.349
  289    HB   THR  42           HB       THR  42  46.487   0.261  10.700
  290    HG1  THR  42           HG1      THR  42  46.516  -1.838  10.739
  291   HG21  THR  42          HG21      THR  42  43.543  -0.180  11.215
  292   HG22  THR  42          HG22      THR  42  44.220   1.428  10.956
  293   HG23  THR  42          HG23      THR  42  44.758   0.453  12.325
  294    H    GLY  43           HN       GLY  43  44.317  -2.268   8.794
  295    HA2  GLY  43           HA2      GLY  43  41.771  -1.505   7.618
  296    HA3  GLY  43           HA1      GLY  43  42.381  -3.142   7.833
  297    H    ILE  44           HN       ILE  44  40.108  -1.021   8.876
  298    HA   ILE  44           HA       ILE  44  39.976  -1.325  11.649
  299    HB   ILE  44           HB       ILE  44  38.553   0.254  10.441
  300   HG12  ILE  44          HG12      ILE  44  36.963  -1.902  11.862
  301   HG13  ILE  44          HG11      ILE  44  37.797  -0.554  12.634
  302   HG21  ILE  44          HG21      ILE  44  36.977  -2.129   9.455
  303   HG22  ILE  44          HG22      ILE  44  38.195  -1.314   8.473
  304   HG23  ILE  44          HG23      ILE  44  36.763  -0.435   9.012
  305   HD11  ILE  44          HD11      ILE  44  35.427  -0.434  10.761
  306   HD12  ILE  44          HD12      ILE  44  36.376   0.989  11.189
  307   HD13  ILE  44          HD13      ILE  44  35.503   0.101  12.438
  308    H    VAL  45           HN       VAL  45  38.774  -3.392   9.038
  309    HA   VAL  45           HA       VAL  45  37.347  -5.214  10.643
  310    HB   VAL  45           HB       VAL  45  38.660  -5.507   7.940
  311   HG11  VAL  45          HG11      VAL  45  38.562  -7.733   8.887
  312   HG12  VAL  45          HG12      VAL  45  37.204  -7.570   7.771
  313   HG13  VAL  45          HG13      VAL  45  36.932  -7.446   9.507
  314   HG21  VAL  45          HG21      VAL  45  35.742  -5.339   8.762
  315   HG22  VAL  45          HG22      VAL  45  36.384  -5.300   7.121
  316   HG23  VAL  45          HG23      VAL  45  36.692  -3.956   8.218
  317    H    ASP  46           HN       ASP  46  40.684  -5.252   9.460
  318    HA   ASP  46           HA       ASP  46  41.383  -7.760  10.528
  319    HB2  ASP  46           HB2      ASP  46  43.037  -5.326   9.843
  320    HB3  ASP  46           HB1      ASP  46  43.743  -6.852  10.374
  321    H    GLU  47           HN       GLU  47  41.490  -4.494  11.905
  322    HA   GLU  47           HA       GLU  47  42.964  -5.131  14.217
  323    HB2  GLU  47           HB2      GLU  47  42.500  -2.823  13.456
  324    HB3  GLU  47           HB1      GLU  47  40.798  -3.041  13.866
  325    HG2  GLU  47           HG2      GLU  47  41.938  -1.875  15.687
  326    HG3  GLU  47           HG1      GLU  47  41.445  -3.480  16.226
  327    H    CYS  48           HN       CYS  48  39.426  -4.881  13.783
  328    HA   CYS  48           HA       CYS  48  38.824  -5.826  16.418
  329    HB2  CYS  48           HB2      CYS  48  37.125  -5.620  13.925
  330    HB3  CYS  48           HB1      CYS  48  36.524  -6.062  15.515
  331    H    CYS  49           HN       CYS  49  38.967  -7.362  13.232
  332    HA   CYS  49           HA       CYS  49  37.915  -9.851  13.956
  333    HB2  CYS  49           HB2      CYS  49  38.241  -9.133  11.617
  334    HB3  CYS  49           HB1      CYS  49  39.987  -9.237  11.834
  335    H    PHE  50           HN       PHE  50  41.315  -8.786  13.755
  336    HA   PHE  50           HA       PHE  50  42.232 -11.255  14.927
  337    HB2  PHE  50           HB2      PHE  50  43.595  -8.740  13.990
  338    HB3  PHE  50           HB1      PHE  50  44.486  -9.996  14.857
  339    HD1  PHE  50           HD1      PHE  50  42.425  -9.256  11.854
  340    HD2  PHE  50           HD2      PHE  50  45.061 -12.056  13.769
  341    HE1  PHE  50           HE1      PHE  50  42.591 -10.531   9.734
  342    HE2  PHE  50           HE2      PHE  50  45.234 -13.337  11.651
  343    HZ   PHE  50           HZ       PHE  50  44.005 -12.580   9.635
  344    H    ARG  51           HN       ARG  51  42.834  -7.853  15.829
  345    HA   ARG  51           HA       ARG  51  43.263  -8.580  18.591
  346    HB2  ARG  51           HB2      ARG  51  43.226  -5.919  17.160
  347    HB3  ARG  51           HB1      ARG  51  43.549  -6.101  18.885
  348    HG2  ARG  51           HG2      ARG  51  45.445  -7.592  18.381
  349    HG3  ARG  51           HG1      ARG  51  45.123  -7.422  16.655
  350    HD2  ARG  51           HD2      ARG  51  45.514  -5.000  16.814
  351    HD3  ARG  51           HD1      ARG  51  45.819  -5.156  18.540
  352    HE   ARG  51           HE       ARG  51  47.563  -6.891  17.172
  353   HH11  ARG  51          HH11      ARG  51  46.922  -3.494  17.598
  354   HH12  ARG  51          HH12      ARG  51  48.568  -3.027  17.347
  355   HH21  ARG  51          HH21      ARG  51  49.718  -6.256  16.845
  356   HH22  ARG  51          HH22      ARG  51  50.144  -4.579  16.923
  357    H    SER  52           HN       SER  52  42.088  -7.456  20.356
  358    HA   SER  52           HA       SER  52  39.209  -7.512  19.829
  359    HB2  SER  52           HB2      SER  52  40.858  -7.462  22.356
  360    HB3  SER  52           HB1      SER  52  39.105  -7.288  22.366
  361    HG   SER  52           HG       SER  52  38.888  -9.322  21.717
  362    H    CYS  53           HN       CYS  53  39.115  -5.514  18.635
  363    HA   CYS  53           HA       CYS  53  39.981  -3.032  19.722
  364    HB2  CYS  53           HB2      CYS  53  38.678  -2.019  17.944
  365    HB3  CYS  53           HB1      CYS  53  39.507  -3.437  17.303
  366    H    ASP  54           HN       ASP  54  39.020  -1.648  21.089
  367    HA   ASP  54           HA       ASP  54  36.755  -2.512  22.615
  368    HB2  ASP  54           HB2      ASP  54  38.353   0.047  22.570
  369    HB3  ASP  54           HB1      ASP  54  36.983  -0.205  23.650
  370    H    LEU  55           HN       LEU  55  34.713  -1.500  22.782
  371    HA   LEU  55           HA       LEU  55  33.503  -0.807  20.329
  372    HB2  LEU  55           HB2      LEU  55  32.599  -0.438  23.194
  373    HB3  LEU  55           HB1      LEU  55  31.574  -0.097  21.799
  374    HG   LEU  55           HG       LEU  55  32.927  -2.770  22.231
  375   HD11  LEU  55          HD11      LEU  55  30.065  -1.992  22.872
  376   HD12  LEU  55          HD12      LEU  55  31.328  -2.226  24.080
  377   HD13  LEU  55          HD13      LEU  55  30.794  -3.582  23.086
  378   HD21  LEU  55          HD21      LEU  55  30.763  -1.717  20.390
  379   HD22  LEU  55          HD22      LEU  55  31.024  -3.442  20.649
  380   HD23  LEU  55          HD23      LEU  55  32.299  -2.453  19.939
  381    H    ARG  56           HN       ARG  56  34.702   1.163  23.022
  382    HA   ARG  56           HA       ARG  56  33.738   3.656  22.138
  383    HB2  ARG  56           HB2      ARG  56  34.651   3.305  24.388
  384    HB3  ARG  56           HB1      ARG  56  36.253   3.033  23.702
  385    HG2  ARG  56           HG2      ARG  56  36.272   5.304  22.778
  386    HG3  ARG  56           HG1      ARG  56  34.642   5.584  23.392
  387    HD2  ARG  56           HD2      ARG  56  35.445   5.250  25.693
  388    HD3  ARG  56           HD1      ARG  56  37.070   4.950  25.086
  389    HE   ARG  56           HE       ARG  56  36.242   7.447  24.113
  390   HH11  ARG  56          HH11      ARG  56  36.957   5.858  27.131
  391   HH12  ARG  56          HH12      ARG  56  37.482   7.309  27.911
  392   HH21  ARG  56          HH21      ARG  56  36.934   9.339  25.158
  393   HH22  ARG  56          HH22      ARG  56  37.470   9.270  26.803
  394    H    ARG  57           HN       ARG  57  36.893   2.048  21.540
  395    HA   ARG  57           HA       ARG  57  37.976   4.081  19.943
  396    HB2  ARG  57           HB2      ARG  57  39.221   2.161  21.014
  397    HB3  ARG  57           HB1      ARG  57  38.558   1.121  19.750
  398    HG2  ARG  57           HG2      ARG  57  39.599   2.466  18.026
  399    HG3  ARG  57           HG1      ARG  57  40.152   3.633  19.225
  400    HD2  ARG  57           HD2      ARG  57  42.027   2.225  18.760
  401    HD3  ARG  57           HD1      ARG  57  41.400   1.743  20.334
  402    HE   ARG  57           HE       ARG  57  40.172   0.157  18.357
  403   HH11  ARG  57          HH11      ARG  57  43.286   0.724  19.820
  404   HH12  ARG  57          HH12      ARG  57  43.839  -0.895  19.558
  405   HH21  ARG  57          HH21      ARG  57  40.923  -1.956  18.021
  406   HH22  ARG  57          HH22      ARG  57  42.511  -2.405  18.546
  407    H    LEU  58           HN       LEU  58  35.932   1.297  19.230
  408    HA   LEU  58           HA       LEU  58  36.145   1.299  16.442
  409    HB2  LEU  58           HB2      LEU  58  35.019  -0.448  17.885
  410    HB3  LEU  58           HB1      LEU  58  33.635   0.641  17.977
  411    HG   LEU  58           HG       LEU  58  33.707   0.687  15.409
  412   HD11  LEU  58          HD11      LEU  58  35.489  -1.699  15.982
  413   HD12  LEU  58          HD12      LEU  58  35.929  -0.251  15.084
  414   HD13  LEU  58          HD13      LEU  58  34.749  -1.373  14.417
  415   HD21  LEU  58          HD21      LEU  58  32.595  -1.602  15.290
  416   HD22  LEU  58          HD22      LEU  58  31.936  -0.500  16.497
  417   HD23  LEU  58          HD23      LEU  58  33.021  -1.801  16.989
  418    H    ASP  59           HN       ASP  59  34.114   3.193  18.601
  419    HA   ASP  59           HA       ASP  59  32.371   4.309  16.720
  420    HB2  ASP  59           HB2      ASP  59  32.239   4.476  19.251
  421    HB3  ASP  59           HB1      ASP  59  33.432   5.769  19.138
  422    H    MET  60           HN       MET  60  35.728   4.819  17.165
  423    HA   MET  60           HA       MET  60  35.967   7.482  16.269
  424    HB2  MET  60           HB2      MET  60  37.881   5.151  16.154
  425    HB3  MET  60           HB1      MET  60  38.315   6.792  15.698
  426    HG2  MET  60           HG2      MET  60  37.782   7.613  17.925
  427    HG3  MET  60           HG1      MET  60  37.198   6.020  18.408
  428    HE1  MET  60           HE1      MET  60  41.456   7.449  17.641
  429    HE2  MET  60           HE2      MET  60  39.922   8.241  17.282
  430    HE3  MET  60           HE3      MET  60  40.511   6.958  16.228
  431    H    TYR  61           HN       TYR  61  35.756   4.408  14.575
  432    HA   TYR  61           HA       TYR  61  36.395   5.496  11.974
  433    HB2  TYR  61           HB2      TYR  61  34.896   2.932  12.491
  434    HB3  TYR  61           HB1      TYR  61  35.956   3.338  11.151
  435    HD1  TYR  61           HD1      TYR  61  35.838   1.483  14.078
  436    HD2  TYR  61           HD2      TYR  61  38.404   4.209  11.979
  437    HE1  TYR  61           HE1      TYR  61  37.792   0.573  15.293
  438    HE2  TYR  61           HE2      TYR  61  40.366   3.302  13.194
  439    HH   TYR  61           HH       TYR  61  40.568   0.562  14.565
  440    H    CYS  62           HN       CYS  62  33.670   5.742  13.939
  441    HA   CYS  62           HA       CYS  62  31.633   5.593  11.948
  442    HB2  CYS  62           HB2      CYS  62  31.711   6.934  14.652
  443    HB3  CYS  62           HB1      CYS  62  30.270   6.813  13.655
  444    H    ALA  63           HN       ALA  63  30.484   7.335  10.989
  445    HA   ALA  63           HA       ALA  63  32.101   9.373   9.975
  446    HB1  ALA  63           HB1      ALA  63  29.982   8.339   8.948
  447    HB2  ALA  63           HB2      ALA  63  30.209  10.077   8.751
  448    HB3  ALA  63           HB3      ALA  63  29.090   9.466   9.971
  449    HA   PRO  64           HA       PRO  64  31.677  12.484  13.093
  450    HB2  PRO  64           HB2      PRO  64  32.039  14.738  11.602
  451    HB3  PRO  64           HB1      PRO  64  33.356  13.617  11.997
  452    HG2  PRO  64           HG2      PRO  64  31.800  13.902   9.477
  453    HG3  PRO  64           HG1      PRO  64  33.523  13.560   9.711
  454    HD2  PRO  64           HD2      PRO  64  31.655  11.625   9.102
  455    HD3  PRO  64           HD1      PRO  64  33.169  11.288   9.967
  456    H    LEU  65           HN       LEU  65  30.342  14.281  13.815
  457    HA   LEU  65           HA       LEU  65  27.600  13.983  13.107
  458    HB2  LEU  65           HB2      LEU  65  28.963  16.158  14.719
  459    HB3  LEU  65           HB1      LEU  65  27.229  15.842  14.676
  460    HG   LEU  65           HG       LEU  65  29.309  13.821  15.556
  461   HD11  LEU  65          HD11      LEU  65  29.292  15.509  17.234
  462   HD12  LEU  65          HD12      LEU  65  28.197  14.262  17.831
  463   HD13  LEU  65          HD13      LEU  65  27.546  15.732  17.104
  464   HD21  LEU  65          HD21      LEU  65  27.187  12.736  16.506
  465   HD22  LEU  65          HD22      LEU  65  27.365  12.684  14.750
  466   HD23  LEU  65          HD23      LEU  65  26.282  13.862  15.493
  467    H    LYS  66           HN       LYS  66  26.234  15.355  12.003
  468    HA   LYS  66           HA       LYS  66  27.391  16.774   9.834
  469    HB2  LYS  66           HB2      LYS  66  25.104  17.269   9.171
  470    HB3  LYS  66           HB1      LYS  66  25.205  15.592   9.699
  471    HG2  LYS  66           HG2      LYS  66  24.354  16.239  11.925
  472    HG3  LYS  66           HG1      LYS  66  24.247  17.918  11.397
  473    HD2  LYS  66           HD2      LYS  66  22.655  17.262   9.632
  474    HD3  LYS  66           HD1      LYS  66  22.752  15.585  10.174
  475    HE2  LYS  66           HE2      LYS  66  21.901  16.241  12.390
  476    HE3  LYS  66           HE1      LYS  66  21.815  17.922  11.865
  477    HZ1  LYS  66           HZ1      LYS  66  20.099  17.473  10.412
  478    HZ2  LYS  66           HZ2      LYS  66  19.716  16.474  11.732
  479    HZ3  LYS  66           HZ3      LYS  66  20.436  15.812  10.342
  480    HA   PRO  67           HA       PRO  67  27.808  20.904  11.286
  481    HB2  PRO  67           HB2      PRO  67  26.051  21.841   9.068
  482    HB3  PRO  67           HB1      PRO  67  27.725  22.288   9.448
  483    HG2  PRO  67           HG2      PRO  67  27.169  20.707   7.394
  484    HG3  PRO  67           HG1      PRO  67  28.599  20.429   8.403
  485    HD2  PRO  67           HD2      PRO  67  25.986  18.968   8.390
  486    HD3  PRO  67           HD1      PRO  67  27.637  18.339   8.587
  487    H    ALA  68           HN       ALA  68  26.797  22.303  12.682
  488    HA   ALA  68           HA       ALA  68  23.879  22.504  12.695
  489    HB1  ALA  68           HB1      ALA  68  25.350  21.750  15.223
  490    HB2  ALA  68           HB2      ALA  68  24.586  20.553  14.176
  491    HB3  ALA  68           HB3      ALA  68  23.607  21.799  14.950
  492    H    LYS  69           HN       LYS  69  23.097  24.274  13.969
  493    HA   LYS  69           HA       LYS  69  23.153  26.474  14.641
  494    HB2  LYS  69           HB2      LYS  69  25.807  25.598  15.809
  495    HB3  LYS  69           HB1      LYS  69  24.938  27.073  16.232
  496    HG2  LYS  69           HG2      LYS  69  23.049  25.774  17.061
  497    HG3  LYS  69           HG1      LYS  69  23.816  24.273  16.540
  498    HD2  LYS  69           HD2      LYS  69  24.238  24.496  18.900
  499    HD3  LYS  69           HD1      LYS  69  25.753  24.848  18.068
  500    HE2  LYS  69           HE2      LYS  69  25.350  27.250  18.273
  501    HE3  LYS  69           HE1      LYS  69  23.777  26.946  19.011
  502    HZ1  LYS  69           HZ1      LYS  69  24.862  25.863  20.851
  503    HZ2  LYS  69           HZ2      LYS  69  25.506  27.423  20.653
  504    HZ3  LYS  69           HZ3      LYS  69  26.383  26.066  20.127
  505    H    SER  70           HN       SER  70  24.053  25.932  12.006
  506    HA   SER  70           HA       SER  70  26.095  28.050  11.669
  507    HB2  SER  70           HB2      SER  70  25.622  25.590   9.973
  508    HB3  SER  70           HB1      SER  70  26.740  26.888   9.566
  509    HG   SER  70           HG       SER  70  28.085  25.780  10.744
  510    H    ALA  71           HN       ALA  71  25.784  29.541  10.016
  511    HA   ALA  71           HA       ALA  71  23.005  29.846   9.164
  512    HB1  ALA  71           HB1      ALA  71  23.688  32.091   8.471
  513    HB2  ALA  71           HB2      ALA  71  25.375  31.698   8.806
  514    HB3  ALA  71           HB3      ALA  71  24.209  31.781  10.128
  Start of MODEL   16
    1    H1   GLY   1           HT1      GLY   1  41.640 -22.355  15.758
    2    H2   GLY   1           HT2      GLY   1  41.990 -21.918  14.154
    3    H3   GLY   1           HT3      GLY   1  40.446 -22.500  14.562
    4    HA2  GLY   1           HA2      GLY   1  41.629 -19.858  15.019
    5    HA3  GLY   1           HA1      GLY   1  39.996 -20.282  14.502
    6    H    GLY   2           HN       GLY   2  38.830 -19.219  16.058
    7    HA2  GLY   2           HA2      GLY   2  37.738 -20.012  18.207
    8    HA3  GLY   2           HA1      GLY   2  39.363 -19.933  18.880
    9    HA   PRO   3           HA       PRO   3  38.846 -15.643  19.709
   10    HB2  PRO   3           HB2      PRO   3  41.212 -14.504  18.984
   11    HB3  PRO   3           HB1      PRO   3  41.058 -15.603  20.366
   12    HG2  PRO   3           HG2      PRO   3  42.113 -16.128  17.638
   13    HG3  PRO   3           HG1      PRO   3  42.661 -16.748  19.203
   14    HD2  PRO   3           HD2      PRO   3  41.091 -18.181  17.427
   15    HD3  PRO   3           HD1      PRO   3  41.173 -18.499  19.172
   16    H    GLU   4           HN       GLU   4  37.293 -15.889  17.646
   17    HA   GLU   4           HA       GLU   4  38.014 -13.693  15.818
   18    HB2  GLU   4           HB2      GLU   4  36.717 -16.336  15.139
   19    HB3  GLU   4           HB1      GLU   4  36.688 -14.942  14.060
   20    HG2  GLU   4           HG2      GLU   4  39.107 -14.901  13.949
   21    HG3  GLU   4           HG1      GLU   4  39.227 -16.161  15.177
   22    H    THR   5           HN       THR   5  36.671 -12.070  16.114
   23    HA   THR   5           HA       THR   5  33.798 -12.563  16.323
   24    HB   THR   5           HB       THR   5  34.615 -12.548  18.672
   25    HG1  THR   5           HG1      THR   5  32.933 -11.393  19.251
   26   HG21  THR   5          HG21      THR   5  35.353  -9.663  18.151
   27   HG22  THR   5          HG22      THR   5  36.539 -10.969  18.145
   28   HG23  THR   5          HG23      THR   5  35.637 -10.601  19.617
   29    H    LEU   6           HN       LEU   6  32.524 -10.703  15.854
   30    HA   LEU   6           HA       LEU   6  32.020  -8.794  14.683
   31    HB2  LEU   6           HB2      LEU   6  34.730  -7.862  15.662
   32    HB3  LEU   6           HB1      LEU   6  33.406  -6.848  15.098
   33    HG   LEU   6           HG       LEU   6  33.255  -8.691  17.497
   34   HD11  LEU   6          HD11      LEU   6  34.771  -6.638  17.689
   35   HD12  LEU   6          HD12      LEU   6  33.462  -6.742  18.867
   36   HD13  LEU   6          HD13      LEU   6  33.316  -5.664  17.478
   37   HD21  LEU   6          HD21      LEU   6  31.155  -7.345  17.916
   38   HD22  LEU   6          HD22      LEU   6  31.073  -8.381  16.495
   39   HD23  LEU   6          HD23      LEU   6  31.355  -6.654  16.309
   40    H    CYS   7           HN       CYS   7  32.950 -10.828  13.118
   41    HA   CYS   7           HA       CYS   7  34.696  -9.437  11.172
   42    HB2  CYS   7           HB2      CYS   7  34.413 -12.419  11.626
   43    HB3  CYS   7           HB1      CYS   7  35.475 -11.643  10.452
   44    H    GLY   8           HN       GLY   8  34.126  -9.544   8.992
   45    HA2  GLY   8           HA2      GLY   8  32.711  -9.659   7.182
   46    HA3  GLY   8           HA1      GLY   8  32.101 -11.152   7.888
   47    H    ALA   9           HN       ALA   9  29.979 -11.112   8.136
   48    HA   ALA   9           HA       ALA   9  28.366  -8.817   8.007
   49    HB1  ALA   9           HB1      ALA   9  26.686 -10.484   9.217
   50    HB2  ALA   9           HB2      ALA   9  27.932 -11.663   8.795
   51    HB3  ALA   9           HB3      ALA   9  27.152 -10.715   7.530
   52    H    GLU  10           HN       GLU  10  29.743 -10.555  10.747
   53    HA   GLU  10           HA       GLU  10  28.286  -9.315  12.805
   54    HB2  GLU  10           HB2      GLU  10  31.091 -10.446  12.736
   55    HB3  GLU  10           HB1      GLU  10  30.300  -9.903  14.214
   56    HG2  GLU  10           HG2      GLU  10  29.238 -12.041  12.345
   57    HG3  GLU  10           HG1      GLU  10  30.034 -12.343  13.888
   58    H    LEU  11           HN       LEU  11  31.275  -8.355  11.143
   59    HA   LEU  11           HA       LEU  11  31.879  -6.134  12.779
   60    HB2  LEU  11           HB2      LEU  11  33.510  -7.067  11.209
   61    HB3  LEU  11           HB1      LEU  11  32.493  -6.601   9.851
   62    HG   LEU  11           HG       LEU  11  32.715  -4.220  10.514
   63   HD11  LEU  11          HD11      LEU  11  34.564  -3.727  12.207
   64   HD12  LEU  11          HD12      LEU  11  34.451  -5.422  12.680
   65   HD13  LEU  11          HD13      LEU  11  33.058  -4.357  12.875
   66   HD21  LEU  11          HD21      LEU  11  35.399  -5.612  10.271
   67   HD22  LEU  11          HD22      LEU  11  35.034  -3.946   9.817
   68   HD23  LEU  11          HD23      LEU  11  34.317  -5.283   8.916
   69    H    VAL  12           HN       VAL  12  30.071  -6.373   9.718
   70    HA   VAL  12           HA       VAL  12  29.475  -3.644   9.486
   71    HB   VAL  12           HB       VAL  12  28.143  -6.125   8.413
   72   HG11  VAL  12          HG11      VAL  12  26.909  -4.460   6.908
   73   HG12  VAL  12          HG12      VAL  12  27.387  -3.204   8.052
   74   HG13  VAL  12          HG13      VAL  12  26.337  -4.519   8.575
   75   HG21  VAL  12          HG21      VAL  12  29.843  -3.898   7.268
   76   HG22  VAL  12          HG22      VAL  12  29.033  -5.110   6.279
   77   HG23  VAL  12          HG23      VAL  12  30.274  -5.602   7.431
   78    H    ASP  13           HN       ASP  13  27.630  -6.306  10.928
   79    HA   ASP  13           HA       ASP  13  25.359  -4.815  11.671
   80    HB2  ASP  13           HB2      ASP  13  26.567  -7.369  12.735
   81    HB3  ASP  13           HB1      ASP  13  25.055  -6.704  13.356
   82    H    ALA  14           HN       ALA  14  28.361  -5.562  13.414
   83    HA   ALA  14           HA       ALA  14  27.615  -4.395  15.873
   84    HB1  ALA  14           HB1      ALA  14  30.414  -4.543  14.756
   85    HB2  ALA  14           HB2      ALA  14  29.580  -5.923  15.469
   86    HB3  ALA  14           HB3      ALA  14  29.930  -4.498  16.453
   87    H    LEU  15           HN       LEU  15  29.270  -3.075  13.025
   88    HA   LEU  15           HA       LEU  15  29.837  -0.530  14.105
   89    HB2  LEU  15           HB2      LEU  15  29.425  -1.482  11.266
   90    HB3  LEU  15           HB1      LEU  15  29.913   0.163  11.667
   91    HG   LEU  15           HG       LEU  15  31.417  -2.274  12.644
   92   HD11  LEU  15          HD11      LEU  15  32.188  -0.500  10.314
   93   HD12  LEU  15          HD12      LEU  15  31.329  -2.023  10.099
   94   HD13  LEU  15          HD13      LEU  15  32.940  -2.015  10.816
   95   HD21  LEU  15          HD21      LEU  15  31.935   0.709  12.570
   96   HD22  LEU  15          HD22      LEU  15  33.236  -0.459  12.806
   97   HD23  LEU  15          HD23      LEU  15  31.921  -0.358  13.975
   98    H    GLN  16           HN       GLN  16  27.050  -1.775  12.293
   99    HA   GLN  16           HA       GLN  16  25.664   0.693  12.118
  100    HB2  GLN  16           HB2      GLN  16  25.156  -1.296  10.717
  101    HB3  GLN  16           HB1      GLN  16  24.506  -2.103  12.147
  102    HG2  GLN  16           HG2      GLN  16  22.834  -0.345  12.416
  103    HG3  GLN  16           HG1      GLN  16  23.511   0.542  11.055
  104   HE21  GLN  16          HE21      GLN  16  20.922  -0.000  10.635
  105   HE22  GLN  16          HE22      GLN  16  20.696  -1.336   9.612
  106    H    PHE  17           HN       PHE  17  25.627  -1.933  14.489
  107    HA   PHE  17           HA       PHE  17  23.495  -1.037  16.079
  108    HB2  PHE  17           HB2      PHE  17  24.319  -3.220  16.481
  109    HB3  PHE  17           HB1      PHE  17  25.971  -2.643  16.698
  110    HD1  PHE  17           HD1      PHE  17  22.572  -2.698  18.214
  111    HD2  PHE  17           HD2      PHE  17  26.732  -1.746  18.777
  112    HE1  PHE  17           HE1      PHE  17  22.178  -2.408  20.648
  113    HE2  PHE  17           HE2      PHE  17  26.333  -1.467  21.210
  114    HZ   PHE  17           HZ       PHE  17  24.059  -1.796  22.145
  115    H    VAL  18           HN       VAL  18  26.988  -0.419  16.390
  116    HA   VAL  18           HA       VAL  18  26.791   1.250  18.659
  117    HB   VAL  18           HB       VAL  18  28.885   1.080  16.484
  118   HG11  VAL  18          HG11      VAL  18  28.863   2.553  19.126
  119   HG12  VAL  18          HG12      VAL  18  29.046   3.260  17.520
  120   HG13  VAL  18          HG13      VAL  18  30.324   2.246  18.187
  121   HG21  VAL  18          HG21      VAL  18  28.976   0.096  19.348
  122   HG22  VAL  18          HG22      VAL  18  30.081  -0.306  18.030
  123   HG23  VAL  18          HG23      VAL  18  28.427  -0.920  18.014
  124    H    CYS  19           HN       CYS  19  26.848   1.958  15.184
  125    HA   CYS  19           HA       CYS  19  25.960   4.718  15.803
  126    HB2  CYS  19           HB2      CYS  19  27.652   3.745  13.492
  127    HB3  CYS  19           HB1      CYS  19  27.059   5.381  13.691
  128    H    GLY  20           HN       GLY  20  23.871   3.309  15.766
  129    HA2  GLY  20           HA2      GLY  20  22.805   2.383  13.323
  130    HA3  GLY  20           HA1      GLY  20  21.868   2.854  14.739
  131    H    ASP  21           HN       ASP  21  22.666   5.548  14.913
  132    HA   ASP  21           HA       ASP  21  21.069   6.647  12.729
  133    HB2  ASP  21           HB2      ASP  21  22.090   7.781  15.331
  134    HB3  ASP  21           HB1      ASP  21  21.214   8.741  14.137
  135    H    ARG  22           HN       ARG  22  24.255   7.195  14.245
  136    HA   ARG  22           HA       ARG  22  25.083   9.221  12.447
  137    HB2  ARG  22           HB2      ARG  22  26.646   7.310  14.183
  138    HB3  ARG  22           HB1      ARG  22  27.401   8.586  13.239
  139    HG2  ARG  22           HG2      ARG  22  25.847  10.217  14.392
  140    HG3  ARG  22           HG1      ARG  22  25.361   8.895  15.454
  141    HD2  ARG  22           HD2      ARG  22  28.218   9.828  15.088
  142    HD3  ARG  22           HD1      ARG  22  27.183  10.309  16.426
  143    HE   ARG  22           HE       ARG  22  28.451   7.723  16.054
  144   HH11  ARG  22          HH11      ARG  22  25.891   9.510  17.617
  145   HH12  ARG  22          HH12      ARG  22  25.740   8.388  18.915
  146   HH21  ARG  22          HH21      ARG  22  28.221   6.269  17.770
  147   HH22  ARG  22          HH22      ARG  22  27.043   6.564  19.005
  148    H    GLY  23           HN       GLY  23  25.480   5.702  12.426
  149    HA2  GLY  23           HA2      GLY  23  25.819   4.271  10.640
  150    HA3  GLY  23           HA1      GLY  23  25.729   5.661   9.562
  151    H    PHE  24           HN       PHE  24  27.552   3.902   8.846
  152    HA   PHE  24           HA       PHE  24  30.069   5.286   9.375
  153    HB2  PHE  24           HB2      PHE  24  31.282   3.257   9.930
  154    HB3  PHE  24           HB1      PHE  24  29.949   3.458  11.066
  155    HD1  PHE  24           HD1      PHE  24  31.440   1.332   8.548
  156    HD2  PHE  24           HD2      PHE  24  27.785   2.186  10.641
  157    HE1  PHE  24           HE1      PHE  24  30.538  -0.871   7.876
  158    HE2  PHE  24           HE2      PHE  24  26.885  -0.027   9.975
  159    HZ   PHE  24           HZ       PHE  24  28.265  -1.552   8.590
  160    H    TYR  25           HN       TYR  25  31.749   4.704   7.828
  161    HA   TYR  25           HA       TYR  25  30.699   3.420   5.384
  162    HB2  TYR  25           HB2      TYR  25  31.831   5.148   4.040
  163    HB3  TYR  25           HB1      TYR  25  30.599   5.854   5.086
  164    HD1  TYR  25           HD1      TYR  25  34.205   5.516   4.457
  165    HD2  TYR  25           HD2      TYR  25  31.221   7.144   7.082
  166    HE1  TYR  25           HE1      TYR  25  35.921   6.966   5.507
  167    HE2  TYR  25           HE2      TYR  25  32.937   8.594   8.129
  168    HH   TYR  25           HH       TYR  25  35.063   9.480   7.787
  169    H    PHE  26           HN       PHE  26  33.442   4.260   7.404
  170    HA   PHE  26           HA       PHE  26  35.539   3.353   7.608
  171    HB2  PHE  26           HB2      PHE  26  34.264   1.237   7.789
  172    HB3  PHE  26           HB1      PHE  26  34.349   1.051   6.041
  173    HD1  PHE  26           HD1      PHE  26  36.433   1.351   9.112
  174    HD2  PHE  26           HD2      PHE  26  36.277   0.161   4.989
  175    HE1  PHE  26           HE1      PHE  26  38.679   0.320   9.325
  176    HE2  PHE  26           HE2      PHE  26  38.521  -0.869   5.201
  177    HZ   PHE  26           HZ       PHE  26  39.724  -0.789   7.369
  178    H    ASN  27           HN       ASN  27  37.522   2.963   6.425
  179    HA   ASN  27           HA       ASN  27  37.481   4.272   3.823
  180    HB2  ASN  27           HB2      ASN  27  39.170   4.813   5.607
  181    HB3  ASN  27           HB1      ASN  27  39.853   3.206   5.364
  182   HD21  ASN  27          HD21      ASN  27  41.861   3.944   4.444
  183   HD22  ASN  27          HD22      ASN  27  41.935   4.717   2.935
  184    H    LYS  28           HN       LYS  28  36.687   2.847   2.330
  185    HA   LYS  28           HA       LYS  28  37.424   0.096   2.246
  186    HB2  LYS  28           HB2      LYS  28  36.101   1.898   0.215
  187    HB3  LYS  28           HB1      LYS  28  36.340   0.173  -0.029
  188    HG2  LYS  28           HG2      LYS  28  35.059  -0.304   2.022
  189    HG3  LYS  28           HG1      LYS  28  34.814   1.426   2.268
  190    HD2  LYS  28           HD2      LYS  28  33.631   1.571   0.108
  191    HD3  LYS  28           HD1      LYS  28  33.873  -0.159  -0.140
  192    HE2  LYS  28           HE2      LYS  28  32.585  -0.643   1.902
  193    HE3  LYS  28           HE1      LYS  28  32.350   1.086   2.168
  194    HZ1  LYS  28           HZ1      LYS  28  31.259  -0.614   0.014
  195    HZ2  LYS  28           HZ2      LYS  28  31.369   1.071  -0.171
  196    HZ3  LYS  28           HZ3      LYS  28  30.429   0.412   1.081
  197    HA   PRO  29           HA       PRO  29  41.255   0.262   0.059
  198    HB2  PRO  29           HB2      PRO  29  41.025  -1.922  -1.597
  199    HB3  PRO  29           HB1      PRO  29  41.389  -2.030   0.134
  200    HG2  PRO  29           HG2      PRO  29  38.802  -2.412  -1.294
  201    HG3  PRO  29           HG1      PRO  29  39.489  -3.318   0.067
  202    HD2  PRO  29           HD2      PRO  29  37.559  -1.451   0.411
  203    HD3  PRO  29           HD1      PRO  29  38.810  -1.745   1.636
  204    H    THR  30           HN       THR  30  38.268   0.180  -1.749
  205    HA   THR  30           HA       THR  30  39.581   1.673  -3.932
  206    HB   THR  30           HB       THR  30  38.202   0.491  -5.571
  207    HG1  THR  30           HG1      THR  30  37.326  -0.921  -3.277
  208   HG21  THR  30          HG21      THR  30  39.636  -1.468  -3.759
  209   HG22  THR  30          HG22      THR  30  40.444  -0.408  -4.915
  210   HG23  THR  30          HG23      THR  30  39.336  -1.656  -5.487
  211    H    GLY  31           HN       GLY  31  38.052   2.986  -5.209
  212    HA2  GLY  31           HA2      GLY  31  35.474   3.552  -3.953
  213    HA3  GLY  31           HA1      GLY  31  36.653   4.861  -3.952
  214    H    TYR  32           HN       TYR  32  34.230   3.299  -5.715
  215    HA   TYR  32           HA       TYR  32  35.092   3.943  -8.362
  216    HB2  TYR  32           HB2      TYR  32  32.386   3.249  -7.213
  217    HB3  TYR  32           HB1      TYR  32  32.669   3.525  -8.932
  218    HD1  TYR  32           HD1      TYR  32  33.300   1.294  -6.080
  219    HD2  TYR  32           HD2      TYR  32  34.048   1.984 -10.253
  220    HE1  TYR  32           HE1      TYR  32  34.124  -1.032  -6.316
  221    HE2  TYR  32           HE2      TYR  32  34.872  -0.343 -10.489
  222    HH   TYR  32           HH       TYR  32  34.408  -2.709  -8.074
  223    H    GLY  33           HN       GLY  33  33.412   5.655  -5.836
  224    HA2  GLY  33           HA2      GLY  33  32.122   7.645  -7.337
  225    HA3  GLY  33           HA1      GLY  33  32.668   7.827  -5.674
  226    H    SER  34           HN       SER  34  35.436   7.477  -6.073
  227    HA   SER  34           HA       SER  34  36.479   9.118  -8.138
  228    HB2  SER  34           HB2      SER  34  35.344  10.911  -6.896
  229    HB3  SER  34           HB1      SER  34  36.203  10.445  -5.430
  230    HG   SER  34           HG       SER  34  37.043  12.187  -7.024
  231    H    SER  35           HN       SER  35  37.417   6.788  -7.566
  232    HA   SER  35           HA       SER  35  40.091   7.236  -6.695
  233    HB2  SER  35           HB2      SER  35  38.836   7.138  -4.490
  234    HB3  SER  35           HB1      SER  35  38.477   5.456  -4.865
  235    HG   SER  35           HG       SER  35  40.360   5.176  -3.934
  236    H    SER  36           HN       SER  36  40.160   6.308  -8.873
  237    HA   SER  36           HA       SER  36  39.319   3.628  -9.366
  238    HB2  SER  36           HB2      SER  36  40.491   3.829 -11.452
  239    HB3  SER  36           HB1      SER  36  39.730   5.384 -11.125
  240    HG   SER  36           HG       SER  36  42.437   4.620 -10.786
  241    H    ARG  37           HN       ARG  37  42.023   5.000  -7.770
  242    HA   ARG  37           HA       ARG  37  43.907   2.906  -8.212
  243    HB2  ARG  37           HB2      ARG  37  43.709   4.928  -5.968
  244    HB3  ARG  37           HB1      ARG  37  45.116   3.925  -6.319
  245    HG2  ARG  37           HG2      ARG  37  43.891   5.860  -8.304
  246    HG3  ARG  37           HG1      ARG  37  45.261   6.253  -7.268
  247    HD2  ARG  37           HD2      ARG  37  45.168   4.030  -9.329
  248    HD3  ARG  37           HD1      ARG  37  46.057   5.536  -9.468
  249    HE   ARG  37           HE       ARG  37  46.814   3.230  -7.898
  250   HH11  ARG  37          HH11      ARG  37  47.126   6.679  -8.313
  251   HH12  ARG  37          HH12      ARG  37  48.650   6.758  -7.514
  252   HH21  ARG  37          HH21      ARG  37  48.810   3.367  -6.846
  253   HH22  ARG  37          HH22      ARG  37  49.602   4.900  -6.685
  254    H    ARG  38           HN       ARG  38  44.538   1.241  -6.824
  255    HA   ARG  38           HA       ARG  38  42.415   0.369  -4.961
  256    HB2  ARG  38           HB2      ARG  38  44.464  -1.239  -6.506
  257    HB3  ARG  38           HB1      ARG  38  43.323  -1.915  -5.342
  258    HG2  ARG  38           HG2      ARG  38  41.439  -1.057  -6.689
  259    HG3  ARG  38           HG1      ARG  38  42.581  -0.400  -7.862
  260    HD2  ARG  38           HD2      ARG  38  43.459  -2.683  -8.259
  261    HD3  ARG  38           HD1      ARG  38  42.272  -3.325  -7.129
  262    HE   ARG  38           HE       ARG  38  41.778  -2.440  -9.840
  263   HH11  ARG  38          HH11      ARG  38  40.402  -3.012  -6.685
  264   HH12  ARG  38          HH12      ARG  38  38.803  -3.227  -7.291
  265   HH21  ARG  38          HH21      ARG  38  39.672  -2.723 -10.600
  266   HH22  ARG  38          HH22      ARG  38  38.386  -3.065  -9.492
  267    H    ALA  39           HN       ALA  39  42.901  -0.034  -2.874
  268    HA   ALA  39           HA       ALA  39  45.741  -0.020  -2.074
  269    HB1  ALA  39           HB1      ALA  39  45.041   1.293  -0.046
  270    HB2  ALA  39           HB2      ALA  39  43.473   1.534  -0.816
  271    HB3  ALA  39           HB3      ALA  39  44.931   2.186  -1.562
  272    HA   PRO  40           HA       PRO  40  43.398  -3.580  -0.223
  273    HB2  PRO  40           HB2      PRO  40  45.115  -5.533  -1.044
  274    HB3  PRO  40           HB1      PRO  40  43.780  -4.937  -2.047
  275    HG2  PRO  40           HG2      PRO  40  46.681  -4.300  -2.181
  276    HG3  PRO  40           HG1      PRO  40  45.510  -4.522  -3.491
  277    HD2  PRO  40           HD2      PRO  40  46.354  -2.051  -2.597
  278    HD3  PRO  40           HD1      PRO  40  44.794  -2.334  -3.400
  279    H    GLN  41           HN       GLN  41  44.422  -2.160   1.594
  280    HA   GLN  41           HA       GLN  41  46.561  -3.744   2.875
  281    HB2  GLN  41           HB2      GLN  41  46.220  -0.740   2.814
  282    HB3  GLN  41           HB1      GLN  41  47.290  -1.572   3.943
  283    HG2  GLN  41           HG2      GLN  41  48.588  -2.506   2.128
  284    HG3  GLN  41           HG1      GLN  41  47.442  -1.896   0.936
  285   HE21  GLN  41          HE21      GLN  41  50.364  -1.236   1.227
  286   HE22  GLN  41          HE22      GLN  41  50.426   0.449   1.412
  287    H    THR  42           HN       THR  42  45.151  -4.922   4.147
  288    HA   THR  42           HA       THR  42  43.045  -3.707   5.670
  289    HB   THR  42           HB       THR  42  42.826  -5.907   6.721
  290    HG1  THR  42           HG1      THR  42  45.249  -6.419   5.342
  291   HG21  THR  42          HG21      THR  42  41.887  -5.572   4.467
  292   HG22  THR  42          HG22      THR  42  42.441  -7.232   4.685
  293   HG23  THR  42          HG23      THR  42  43.414  -6.093   3.755
  294    H    GLY  43           HN       GLY  43  42.952  -3.839   8.060
  295    HA2  GLY  43           HA2      GLY  43  45.191  -4.121   9.718
  296    HA3  GLY  43           HA1      GLY  43  45.088  -2.426   9.250
  297    H    ILE  44           HN       ILE  44  42.740  -1.516   9.470
  298    HA   ILE  44           HA       ILE  44  42.032  -1.574  12.182
  299    HB   ILE  44           HB       ILE  44  40.549  -0.636   9.727
  300   HG12  ILE  44          HG12      ILE  44  41.873   0.935  11.950
  301   HG13  ILE  44          HG11      ILE  44  42.701   0.506  10.452
  302   HG21  ILE  44          HG21      ILE  44  38.883  -1.118  11.368
  303   HG22  ILE  44          HG22      ILE  44  39.149   0.621  11.393
  304   HG23  ILE  44          HG23      ILE  44  39.856  -0.397  12.647
  305   HD11  ILE  44          HD11      ILE  44  41.796   2.724  10.161
  306   HD12  ILE  44          HD12      ILE  44  40.213   2.210  10.745
  307   HD13  ILE  44          HD13      ILE  44  40.812   1.624   9.194
  308    H    VAL  45           HN       VAL  45  40.497  -3.097   9.352
  309    HA   VAL  45           HA       VAL  45  38.361  -4.309  10.740
  310    HB   VAL  45           HB       VAL  45  39.748  -5.020   8.153
  311   HG11  VAL  45          HG11      VAL  45  37.334  -6.254   9.511
  312   HG12  VAL  45          HG12      VAL  45  38.798  -7.081   8.963
  313   HG13  VAL  45          HG13      VAL  45  37.658  -6.425   7.784
  314   HG21  VAL  45          HG21      VAL  45  37.123  -3.681   8.883
  315   HG22  VAL  45          HG22      VAL  45  37.579  -4.129   7.239
  316   HG23  VAL  45          HG23      VAL  45  38.516  -2.920   8.117
  317    H    ASP  46           HN       ASP  46  41.568  -5.523   9.843
  318    HA   ASP  46           HA       ASP  46  41.239  -8.122  10.879
  319    HB2  ASP  46           HB2      ASP  46  43.693  -6.441  10.381
  320    HB3  ASP  46           HB1      ASP  46  43.772  -8.106  10.956
  321    H    GLU  47           HN       GLU  47  42.302  -5.087  12.376
  322    HA   GLU  47           HA       GLU  47  43.297  -6.167  14.772
  323    HB2  GLU  47           HB2      GLU  47  43.615  -3.824  14.103
  324    HB3  GLU  47           HB1      GLU  47  41.886  -3.530  14.295
  325    HG2  GLU  47           HG2      GLU  47  43.112  -2.775  16.283
  326    HG3  GLU  47           HG1      GLU  47  42.057  -4.124  16.690
  327    H    CYS  48           HN       CYS  48  40.012  -4.882  14.070
  328    HA   CYS  48           HA       CYS  48  38.952  -5.678  16.613
  329    HB2  CYS  48           HB2      CYS  48  37.588  -4.912  14.030
  330    HB3  CYS  48           HB1      CYS  48  36.761  -5.208  15.545
  331    H    CYS  49           HN       CYS  49  38.924  -7.092  13.372
  332    HA   CYS  49           HA       CYS  49  37.128  -9.181  13.856
  333    HB2  CYS  49           HB2      CYS  49  37.836  -8.540  11.592
  334    HB3  CYS  49           HB1      CYS  49  39.472  -9.095  11.945
  335    H    PHE  50           HN       PHE  50  40.681  -9.157  14.033
  336    HA   PHE  50           HA       PHE  50  40.693 -11.842  15.112
  337    HB2  PHE  50           HB2      PHE  50  42.829  -9.851  14.380
  338    HB3  PHE  50           HB1      PHE  50  43.225 -11.357  15.228
  339    HD1  PHE  50           HD1      PHE  50  41.740  -9.879  12.177
  340    HD2  PHE  50           HD2      PHE  50  43.178 -13.467  14.046
  341    HE1  PHE  50           HE1      PHE  50  41.644 -11.040   9.994
  342    HE2  PHE  50           HE2      PHE  50  43.088 -14.641  11.860
  343    HZ   PHE  50           HZ       PHE  50  42.323 -13.428   9.834
  344    H    ARG  51           HN       ARG  51  42.250  -8.818  16.189
  345    HA   ARG  51           HA       ARG  51  42.246  -9.683  18.944
  346    HB2  ARG  51           HB2      ARG  51  43.061  -7.055  17.687
  347    HB3  ARG  51           HB1      ARG  51  43.322  -7.500  19.373
  348    HG2  ARG  51           HG2      ARG  51  44.686  -9.420  18.676
  349    HG3  ARG  51           HG1      ARG  51  44.400  -9.022  16.982
  350    HD2  ARG  51           HD2      ARG  51  46.563  -8.132  17.616
  351    HD3  ARG  51           HD1      ARG  51  45.452  -6.787  17.383
  352    HE   ARG  51           HE       ARG  51  45.452  -7.603  20.108
  353   HH11  ARG  51          HH11      ARG  51  47.374  -5.947  17.716
  354   HH12  ARG  51          HH12      ARG  51  48.188  -4.962  18.875
  355   HH21  ARG  51          HH21      ARG  51  46.536  -6.297  21.607
  356   HH22  ARG  51          HH22      ARG  51  47.718  -5.155  21.065
  357    H    SER  52           HN       SER  52  41.368  -8.289  20.684
  358    HA   SER  52           HA       SER  52  38.652  -7.452  19.991
  359    HB2  SER  52           HB2      SER  52  40.042  -7.849  22.648
  360    HB3  SER  52           HB1      SER  52  38.372  -7.316  22.475
  361    HG   SER  52           HG       SER  52  39.545  -9.764  21.657
  362    H    CYS  53           HN       CYS  53  39.180  -5.495  18.888
  363    HA   CYS  53           HA       CYS  53  40.724  -3.423  20.072
  364    HB2  CYS  53           HB2      CYS  53  39.791  -2.007  18.305
  365    HB3  CYS  53           HB1      CYS  53  40.282  -3.559  17.645
  366    H    ASP  54           HN       ASP  54  40.035  -1.478  21.042
  367    HA   ASP  54           HA       ASP  54  37.991  -1.743  22.965
  368    HB2  ASP  54           HB2      ASP  54  39.462   0.677  21.909
  369    HB3  ASP  54           HB1      ASP  54  38.318   0.751  23.248
  370    H    LEU  55           HN       LEU  55  35.892  -1.099  23.029
  371    HA   LEU  55           HA       LEU  55  34.445  -0.824  20.611
  372    HB2  LEU  55           HB2      LEU  55  33.697  -0.300  23.496
  373    HB3  LEU  55           HB1      LEU  55  32.547  -0.186  22.163
  374    HG   LEU  55           HG       LEU  55  34.219  -2.658  22.676
  375   HD11  LEU  55          HD11      LEU  55  31.347  -2.147  23.507
  376   HD12  LEU  55          HD12      LEU  55  32.719  -2.116  24.614
  377   HD13  LEU  55          HD13      LEU  55  32.282  -3.615  23.794
  378   HD21  LEU  55          HD21      LEU  55  31.816  -1.985  20.958
  379   HD22  LEU  55          HD22      LEU  55  32.263  -3.649  21.333
  380   HD23  LEU  55          HD23      LEU  55  33.378  -2.619  20.438
  381    H    ARG  56           HN       ARG  56  35.592   1.519  22.996
  382    HA   ARG  56           HA       ARG  56  34.257   3.782  22.008
  383    HB2  ARG  56           HB2      ARG  56  35.425   3.743  24.175
  384    HB3  ARG  56           HB1      ARG  56  36.974   3.630  23.339
  385    HG2  ARG  56           HG2      ARG  56  36.603   5.790  22.271
  386    HG3  ARG  56           HG1      ARG  56  34.995   5.899  22.988
  387    HD2  ARG  56           HD2      ARG  56  37.545   5.677  24.602
  388    HD3  ARG  56           HD1      ARG  56  36.761   7.206  24.221
  389    HE   ARG  56           HE       ARG  56  34.830   5.552  25.388
  390   HH11  ARG  56          HH11      ARG  56  37.863   7.055  26.229
  391   HH12  ARG  56          HH12      ARG  56  37.467   7.198  27.901
  392   HH21  ARG  56          HH21      ARG  56  34.337   5.757  27.589
  393   HH22  ARG  56          HH22      ARG  56  35.484   6.470  28.671
  394    H    ARG  57           HN       ARG  57  37.458   2.432  21.171
  395    HA   ARG  57           HA       ARG  57  38.214   4.431  19.368
  396    HB2  ARG  57           HB2      ARG  57  39.690   2.656  20.341
  397    HB3  ARG  57           HB1      ARG  57  38.937   1.506  19.232
  398    HG2  ARG  57           HG2      ARG  57  39.705   2.720  17.322
  399    HG3  ARG  57           HG1      ARG  57  40.222   4.074  18.323
  400    HD2  ARG  57           HD2      ARG  57  42.202   2.832  17.805
  401    HD3  ARG  57           HD1      ARG  57  41.799   2.486  19.486
  402    HE   ARG  57           HE       ARG  57  40.590   0.538  17.844
  403   HH11  ARG  57          HH11      ARG  57  43.738   1.607  18.901
  404   HH12  ARG  57          HH12      ARG  57  44.448   0.040  18.769
  405   HH21  ARG  57          HH21      ARG  57  41.553  -1.504  17.675
  406   HH22  ARG  57          HH22      ARG  57  43.223  -1.712  18.082
  407    H    LEU  58           HN       LEU  58  36.357   1.463  18.951
  408    HA   LEU  58           HA       LEU  58  36.190   1.448  16.149
  409    HB2  LEU  58           HB2      LEU  58  35.459  -0.391  17.746
  410    HB3  LEU  58           HB1      LEU  58  33.991   0.552  18.017
  411    HG   LEU  58           HG       LEU  58  33.871   0.598  15.392
  412   HD11  LEU  58          HD11      LEU  58  35.237  -2.071  15.675
  413   HD12  LEU  58          HD12      LEU  58  36.198  -0.630  15.394
  414   HD13  LEU  58          HD13      LEU  58  34.968  -1.102  14.226
  415   HD21  LEU  58          HD21      LEU  58  32.156  -0.458  16.681
  416   HD22  LEU  58          HD22      LEU  58  33.231  -1.776  17.148
  417   HD23  LEU  58          HD23      LEU  58  32.673  -1.642  15.480
  418    H    ASP  59           HN       ASP  59  34.325   3.187  18.590
  419    HA   ASP  59           HA       ASP  59  32.199   4.066  17.003
  420    HB2  ASP  59           HB2      ASP  59  32.410   4.343  19.487
  421    HB3  ASP  59           HB1      ASP  59  33.556   5.647  19.191
  422    H    MET  60           HN       MET  60  35.479   5.343  17.350
  423    HA   MET  60           HA       MET  60  35.091   7.767  15.969
  424    HB2  MET  60           HB2      MET  60  37.538   6.038  16.355
  425    HB3  MET  60           HB1      MET  60  37.589   7.611  15.559
  426    HG2  MET  60           HG2      MET  60  36.472   8.577  17.622
  427    HG3  MET  60           HG1      MET  60  36.739   7.021  18.405
  428    HE1  MET  60           HE1      MET  60  39.224   6.363  19.536
  429    HE2  MET  60           HE2      MET  60  40.495   6.520  18.325
  430    HE3  MET  60           HE3      MET  60  38.949   5.806  17.880
  431    H    TYR  61           HN       TYR  61  35.011   4.561  14.819
  432    HA   TYR  61           HA       TYR  61  36.047   5.040  12.196
  433    HB2  TYR  61           HB2      TYR  61  34.357   2.816  13.356
  434    HB3  TYR  61           HB1      TYR  61  34.966   2.798  11.709
  435    HD1  TYR  61           HD1      TYR  61  37.435   4.527  13.445
  436    HD2  TYR  61           HD2      TYR  61  35.792   0.563  13.142
  437    HE1  TYR  61           HE1      TYR  61  39.539   3.586  14.325
  438    HE2  TYR  61           HE2      TYR  61  37.908  -0.371  14.021
  439    HH   TYR  61           HH       TYR  61  40.691   1.079  13.998
  440    H    CYS  62           HN       CYS  62  33.006   5.478  13.769
  441    HA   CYS  62           HA       CYS  62  31.314   5.458  11.495
  442    HB2  CYS  62           HB2      CYS  62  30.984   6.944  14.110
  443    HB3  CYS  62           HB1      CYS  62  29.711   6.603  12.938
  444    H    ALA  63           HN       ALA  63  30.110   7.510  10.823
  445    HA   ALA  63           HA       ALA  63  32.001   9.305   9.729
  446    HB1  ALA  63           HB1      ALA  63  29.884  10.544   8.993
  447    HB2  ALA  63           HB2      ALA  63  28.990   9.237   9.768
  448    HB3  ALA  63           HB3      ALA  63  30.073   8.888   8.420
  449    HA   PRO  64           HA       PRO  64  32.070  12.417  12.864
  450    HB2  PRO  64           HB2      PRO  64  32.647  14.627  11.392
  451    HB3  PRO  64           HB1      PRO  64  33.822  13.325  11.666
  452    HG2  PRO  64           HG2      PRO  64  32.149  13.896   9.274
  453    HG3  PRO  64           HG1      PRO  64  33.822  13.321   9.374
  454    HD2  PRO  64           HD2      PRO  64  31.651  11.672   8.876
  455    HD3  PRO  64           HD1      PRO  64  33.180  11.105   9.576
  456    H    LEU  65           HN       LEU  65  30.984  14.306  13.689
  457    HA   LEU  65           HA       LEU  65  28.592  15.184  12.235
  458    HB2  LEU  65           HB2      LEU  65  27.180  14.856  14.222
  459    HB3  LEU  65           HB1      LEU  65  27.832  13.325  13.642
  460    HG   LEU  65           HG       LEU  65  29.795  14.032  15.368
  461   HD11  LEU  65          HD11      LEU  65  28.452  14.768  17.465
  462   HD12  LEU  65          HD12      LEU  65  27.248  15.346  16.311
  463   HD13  LEU  65          HD13      LEU  65  28.890  15.997  16.281
  464   HD21  LEU  65          HD21      LEU  65  27.191  12.615  15.986
  465   HD22  LEU  65          HD22      LEU  65  28.632  12.527  16.998
  466   HD23  LEU  65          HD23      LEU  65  28.666  11.881  15.356
  467    H    LYS  66           HN       LYS  66  27.645  17.123  13.134
  468    HA   LYS  66           HA       LYS  66  29.690  18.929  14.052
  469    HB2  LYS  66           HB2      LYS  66  28.051  20.678  13.739
  470    HB3  LYS  66           HB1      LYS  66  27.979  19.583  12.362
  471    HG2  LYS  66           HG2      LYS  66  26.048  18.425  13.390
  472    HG3  LYS  66           HG1      LYS  66  26.120  19.527  14.761
  473    HD2  LYS  66           HD2      LYS  66  25.720  21.438  13.259
  474    HD3  LYS  66           HD1      LYS  66  25.648  20.338  11.880
  475    HE2  LYS  66           HE2      LYS  66  23.731  19.175  12.896
  476    HE3  LYS  66           HE1      LYS  66  23.802  20.262  14.283
  477    HZ1  LYS  66           HZ1      LYS  66  23.304  22.109  12.892
  478    HZ2  LYS  66           HZ2      LYS  66  22.149  20.905  12.577
  479    HZ3  LYS  66           HZ3      LYS  66  23.424  21.169  11.486
  480    HA   PRO  67           HA       PRO  67  28.947  19.028  18.396
  481    HB2  PRO  67           HB2      PRO  67  28.531  21.975  18.225
  482    HB3  PRO  67           HB1      PRO  67  29.705  21.054  19.186
  483    HG2  PRO  67           HG2      PRO  67  30.474  22.403  17.044
  484    HG3  PRO  67           HG1      PRO  67  31.164  20.809  17.413
  485    HD2  PRO  67           HD2      PRO  67  29.079  21.533  15.366
  486    HD3  PRO  67           HD1      PRO  67  30.431  20.381  15.249
  487    H    ALA  68           HN       ALA  68  27.239  18.886  19.821
  488    HA   ALA  68           HA       ALA  68  24.598  18.953  18.848
  489    HB1  ALA  68           HB1      ALA  68  25.783  18.777  21.607
  490    HB2  ALA  68           HB2      ALA  68  24.969  17.521  20.675
  491    HB3  ALA  68           HB3      ALA  68  24.037  18.848  21.368
  492    H    LYS  69           HN       LYS  69  26.446  21.260  20.779
  493    HA   LYS  69           HA       LYS  69  24.327  23.041  21.331
  494    HB2  LYS  69           HB2      LYS  69  26.466  23.123  22.535
  495    HB3  LYS  69           HB1      LYS  69  27.288  23.617  21.056
  496    HG2  LYS  69           HG2      LYS  69  26.847  25.597  22.395
  497    HG3  LYS  69           HG1      LYS  69  25.806  25.643  20.978
  498    HD2  LYS  69           HD2      LYS  69  23.919  24.820  22.276
  499    HD3  LYS  69           HD1      LYS  69  24.949  24.598  23.689
  500    HE2  LYS  69           HE2      LYS  69  25.393  27.028  23.740
  501    HE3  LYS  69           HE1      LYS  69  24.355  27.245  22.331
  502    HZ1  LYS  69           HZ1      LYS  69  23.419  25.987  24.844
  503    HZ2  LYS  69           HZ2      LYS  69  22.478  26.537  23.541
  504    HZ3  LYS  69           HZ3      LYS  69  23.281  27.649  24.543
  505    H    SER  70           HN       SER  70  23.370  24.595  20.156
  506    HA   SER  70           HA       SER  70  24.539  25.251  17.519
  507    HB2  SER  70           HB2      SER  70  21.615  24.879  18.209
  508    HB3  SER  70           HB1      SER  70  22.224  25.458  16.661
  509    HG   SER  70           HG       SER  70  22.085  23.328  16.344
  510    H    ALA  71           HN       ALA  71  24.343  27.381  16.826
  511    HA   ALA  71           HA       ALA  71  24.290  29.370  18.855
  512    HB1  ALA  71           HB1      ALA  71  25.635  29.743  16.900
  513    HB2  ALA  71           HB2      ALA  71  24.360  30.961  16.901
  514    HB3  ALA  71           HB3      ALA  71  24.240  29.558  15.838
  Start of MODEL   17
    1    H1   GLY   1           HT1      GLY   1  33.892 -19.514  30.810
    2    H2   GLY   1           HT2      GLY   1  32.227 -19.605  31.132
    3    H3   GLY   1           HT3      GLY   1  33.016 -18.101  31.141
    4    HA2  GLY   1           HA2      GLY   1  31.967 -19.618  28.928
    5    HA3  GLY   1           HA1      GLY   1  32.290 -17.887  29.057
    6    H    GLY   2           HN       GLY   2  33.754 -17.235  27.626
    7    HA2  GLY   2           HA2      GLY   2  36.382 -18.261  27.494
    8    HA3  GLY   2           HA1      GLY   2  35.450 -18.898  26.143
    9    HA   PRO   3           HA       PRO   3  37.253 -14.646  25.127
   10    HB2  PRO   3           HB2      PRO   3  38.257 -16.160  22.779
   11    HB3  PRO   3           HB1      PRO   3  39.115 -15.025  23.838
   12    HG2  PRO   3           HG2      PRO   3  39.587 -17.635  23.956
   13    HG3  PRO   3           HG1      PRO   3  39.561 -16.638  25.424
   14    HD2  PRO   3           HD2      PRO   3  37.425 -18.447  24.338
   15    HD3  PRO   3           HD1      PRO   3  37.989 -18.266  26.017
   16    H    GLU   4           HN       GLU   4  36.506 -13.286  23.475
   17    HA   GLU   4           HA       GLU   4  34.688 -14.358  21.459
   18    HB2  GLU   4           HB2      GLU   4  33.234 -13.908  23.389
   19    HB3  GLU   4           HB1      GLU   4  33.848 -12.256  23.472
   20    HG2  GLU   4           HG2      GLU   4  31.674 -12.382  22.274
   21    HG3  GLU   4           HG1      GLU   4  32.967 -11.782  21.238
   22    H    THR   5           HN       THR   5  34.982 -13.363  19.595
   23    HA   THR   5           HA       THR   5  36.043 -10.603  19.572
   24    HB   THR   5           HB       THR   5  37.454 -11.192  17.649
   25    HG1  THR   5           HG1      THR   5  36.696 -13.862  18.205
   26   HG21  THR   5          HG21      THR   5  38.385 -11.341  19.927
   27   HG22  THR   5          HG22      THR   5  39.099 -12.558  18.869
   28   HG23  THR   5          HG23      THR   5  37.856 -13.020  20.033
   29    H    LEU   6           HN       LEU   6  35.634  -9.439  17.545
   30    HA   LEU   6           HA       LEU   6  33.082 -10.309  16.331
   31    HB2  LEU   6           HB2      LEU   6  34.272  -7.531  16.549
   32    HB3  LEU   6           HB1      LEU   6  32.704  -7.930  15.850
   33    HG   LEU   6           HG       LEU   6  33.497  -8.530  18.714
   34   HD11  LEU   6          HD11      LEU   6  32.181  -6.630  19.358
   35   HD12  LEU   6          HD12      LEU   6  31.590  -6.400  17.712
   36   HD13  LEU   6          HD13      LEU   6  33.279  -6.066  18.097
   37   HD21  LEU   6          HD21      LEU   6  30.968  -8.808  18.895
   38   HD22  LEU   6          HD22      LEU   6  31.797 -10.055  17.967
   39   HD23  LEU   6          HD23      LEU   6  30.923  -8.771  17.133
   40    H    CYS   7           HN       CYS   7  33.245 -11.075  14.328
   41    HA   CYS   7           HA       CYS   7  34.814  -9.685  12.336
   42    HB2  CYS   7           HB2      CYS   7  36.452 -11.244  13.486
   43    HB3  CYS   7           HB1      CYS   7  35.483 -12.583  12.875
   44    H    GLY   8           HN       GLY   8  33.985  -9.988  10.315
   45    HA2  GLY   8           HA2      GLY   8  32.851 -11.216   8.616
   46    HA3  GLY   8           HA1      GLY   8  32.116 -12.215   9.866
   47    H    ALA   9           HN       ALA   9  30.011 -11.889   9.130
   48    HA   ALA   9           HA       ALA   9  28.841  -9.408   8.519
   49    HB1  ALA   9           HB1      ALA   9  27.784 -12.084   9.332
   50    HB2  ALA   9           HB2      ALA   9  27.524 -11.182   7.838
   51    HB3  ALA   9           HB3      ALA   9  26.685 -10.702   9.317
   52    H    GLU  10           HN       GLU  10  29.212 -11.130  11.587
   53    HA   GLU  10           HA       GLU  10  27.525  -9.528  13.160
   54    HB2  GLU  10           HB2      GLU  10  30.029 -11.077  13.841
   55    HB3  GLU  10           HB1      GLU  10  29.022 -10.291  15.057
   56    HG2  GLU  10           HG2      GLU  10  27.094 -11.619  14.377
   57    HG3  GLU  10           HG1      GLU  10  28.019 -12.338  13.059
   58    H    LEU  11           HN       LEU  11  30.962  -9.168  12.324
   59    HA   LEU  11           HA       LEU  11  31.465  -6.924  13.966
   60    HB2  LEU  11           HB2      LEU  11  33.268  -8.249  12.960
   61    HB3  LEU  11           HB1      LEU  11  32.765  -7.735  11.350
   62    HG   LEU  11           HG       LEU  11  33.202  -5.369  11.998
   63   HD11  LEU  11          HD11      LEU  11  32.887  -5.413  14.364
   64   HD12  LEU  11          HD12      LEU  11  34.598  -5.067  14.111
   65   HD13  LEU  11          HD13      LEU  11  34.084  -6.690  14.568
   66   HD21  LEU  11          HD21      LEU  11  35.744  -5.667  12.242
   67   HD22  LEU  11          HD22      LEU  11  34.980  -6.418  10.842
   68   HD23  LEU  11          HD23      LEU  11  35.426  -7.403  12.236
   69    H    VAL  12           HN       VAL  12  30.511  -7.181  10.545
   70    HA   VAL  12           HA       VAL  12  30.496  -4.433   9.997
   71    HB   VAL  12           HB       VAL  12  29.062  -6.779   8.763
   72   HG11  VAL  12          HG11      VAL  12  27.561  -4.934   8.336
   73   HG12  VAL  12          HG12      VAL  12  28.552  -5.088   6.885
   74   HG13  VAL  12          HG13      VAL  12  28.902  -3.824   8.063
   75   HG21  VAL  12          HG21      VAL  12  31.241  -4.908   7.788
   76   HG22  VAL  12          HG22      VAL  12  30.629  -6.328   6.938
   77   HG23  VAL  12          HG23      VAL  12  31.510  -6.520   8.454
   78    H    ASP  13           HN       ASP  13  27.901  -6.604  11.059
   79    HA   ASP  13           HA       ASP  13  25.819  -4.706  11.090
   80    HB2  ASP  13           HB2      ASP  13  26.249  -7.302  12.573
   81    HB3  ASP  13           HB1      ASP  13  24.782  -6.342  12.761
   82    H    ALA  14           HN       ALA  14  28.184  -5.684  13.531
   83    HA   ALA  14           HA       ALA  14  27.116  -4.226  15.692
   84    HB1  ALA  14           HB1      ALA  14  29.111  -4.679  16.809
   85    HB2  ALA  14           HB2      ALA  14  30.069  -4.623  15.328
   86    HB3  ALA  14           HB3      ALA  14  29.015  -6.002  15.646
   87    H    LEU  15           HN       LEU  15  29.382  -3.337  13.121
   88    HA   LEU  15           HA       LEU  15  30.132  -0.816  14.120
   89    HB2  LEU  15           HB2      LEU  15  29.944  -1.905  11.308
   90    HB3  LEU  15           HB1      LEU  15  30.595  -0.307  11.673
   91    HG   LEU  15           HG       LEU  15  31.634  -2.818  13.005
   92   HD11  LEU  15          HD11      LEU  15  33.401  -2.887  11.364
   93   HD12  LEU  15          HD12      LEU  15  32.837  -1.395  10.613
   94   HD13  LEU  15          HD13      LEU  15  31.877  -2.867  10.476
   95   HD21  LEU  15          HD21      LEU  15  33.638  -1.287  13.289
   96   HD22  LEU  15          HD22      LEU  15  32.200  -0.774  14.169
   97   HD23  LEU  15          HD23      LEU  15  32.638   0.024  12.662
   98    H    GLN  16           HN       GLN  16  27.434  -1.799  12.039
   99    HA   GLN  16           HA       GLN  16  26.462   0.809  11.520
  100    HB2  GLN  16           HB2      GLN  16  25.092  -1.884  11.545
  101    HB3  GLN  16           HB1      GLN  16  24.304  -0.395  11.021
  102    HG2  GLN  16           HG2      GLN  16  26.047  -0.061   9.314
  103    HG3  GLN  16           HG1      GLN  16  26.847  -1.542   9.842
  104   HE21  GLN  16          HE21      GLN  16  26.511  -2.795   7.942
  105   HE22  GLN  16          HE22      GLN  16  24.965  -3.231   7.387
  106    H    PHE  17           HN       PHE  17  25.741  -1.566  14.053
  107    HA   PHE  17           HA       PHE  17  23.656  -0.129  15.311
  108    HB2  PHE  17           HB2      PHE  17  23.923  -2.428  15.856
  109    HB3  PHE  17           HB1      PHE  17  25.603  -2.189  16.337
  110    HD1  PHE  17           HD1      PHE  17  22.069  -1.529  17.267
  111    HD2  PHE  17           HD2      PHE  17  26.190  -1.278  18.489
  112    HE1  PHE  17           HE1      PHE  17  21.350  -1.025  19.587
  113    HE2  PHE  17           HE2      PHE  17  25.462  -0.782  20.811
  114    HZ   PHE  17           HZ       PHE  17  23.047  -0.655  21.358
  115    H    VAL  18           HN       VAL  18  27.130  -0.312  16.078
  116    HA   VAL  18           HA       VAL  18  27.058   1.463  18.264
  117    HB   VAL  18           HB       VAL  18  29.305   0.735  16.373
  118   HG11  VAL  18          HG11      VAL  18  29.322   2.246  18.996
  119   HG12  VAL  18          HG12      VAL  18  29.842   2.857  17.424
  120   HG13  VAL  18          HG13      VAL  18  30.766   1.590  18.228
  121   HG21  VAL  18          HG21      VAL  18  28.468  -1.163  17.641
  122   HG22  VAL  18          HG22      VAL  18  28.487  -0.223  19.133
  123   HG23  VAL  18          HG23      VAL  18  30.003  -0.656  18.345
  124    H    CYS  19           HN       CYS  19  27.915   2.037  14.855
  125    HA   CYS  19           HA       CYS  19  28.362   4.837  15.179
  126    HB2  CYS  19           HB2      CYS  19  27.727   3.209  12.699
  127    HB3  CYS  19           HB1      CYS  19  28.276   4.877  12.702
  128    H    GLY  20           HN       GLY  20  25.577   2.896  14.279
  129    HA2  GLY  20           HA2      GLY  20  23.341   3.400  14.113
  130    HA3  GLY  20           HA1      GLY  20  23.686   4.796  15.131
  131    H    ASP  21           HN       ASP  21  22.819   6.520  14.177
  132    HA   ASP  21           HA       ASP  21  22.296   6.824  11.442
  133    HB2  ASP  21           HB2      ASP  21  22.621   8.855  13.655
  134    HB3  ASP  21           HB1      ASP  21  22.136   9.291  12.016
  135    H    ARG  22           HN       ARG  22  25.136   7.632  13.370
  136    HA   ARG  22           HA       ARG  22  26.443   9.272  11.488
  137    HB2  ARG  22           HB2      ARG  22  27.515   7.448  13.645
  138    HB3  ARG  22           HB1      ARG  22  28.523   8.555  12.715
  139    HG2  ARG  22           HG2      ARG  22  27.280  10.466  13.515
  140    HG3  ARG  22           HG1      ARG  22  26.088   9.424  14.295
  141    HD2  ARG  22           HD2      ARG  22  29.029   9.441  15.003
  142    HD3  ARG  22           HD1      ARG  22  27.812  10.370  15.868
  143    HE   ARG  22           HE       ARG  22  26.914   7.736  15.821
  144   HH11  ARG  22          HH11      ARG  22  29.645   9.545  17.030
  145   HH12  ARG  22          HH12      ARG  22  29.909   8.483  18.368
  146   HH21  ARG  22          HH21      ARG  22  27.284   6.364  17.587
  147   HH22  ARG  22          HH22      ARG  22  28.585   6.696  18.683
  148    H    GLY  23           HN       GLY  23  26.377   5.754  11.919
  149    HA2  GLY  23           HA2      GLY  23  26.999   4.043  10.507
  150    HA3  GLY  23           HA1      GLY  23  26.906   5.213   9.194
  151    H    PHE  24           HN       PHE  24  28.778   3.967   8.370
  152    HA   PHE  24           HA       PHE  24  31.244   5.294   9.112
  153    HB2  PHE  24           HB2      PHE  24  32.508   3.227   9.513
  154    HB3  PHE  24           HB1      PHE  24  31.218   3.412  10.702
  155    HD1  PHE  24           HD1      PHE  24  32.450   1.492   7.841
  156    HD2  PHE  24           HD2      PHE  24  29.180   2.046  10.565
  157    HE1  PHE  24           HE1      PHE  24  31.495  -0.688   7.145
  158    HE2  PHE  24           HE2      PHE  24  28.234  -0.131   9.881
  159    HZ   PHE  24           HZ       PHE  24  29.388  -1.500   8.170
  160    H    TYR  25           HN       TYR  25  33.016   4.745   7.604
  161    HA   TYR  25           HA       TYR  25  32.181   3.458   5.110
  162    HB2  TYR  25           HB2      TYR  25  32.741   5.349   3.728
  163    HB3  TYR  25           HB1      TYR  25  31.584   5.897   4.941
  164    HD1  TYR  25           HD1      TYR  25  35.087   6.010   3.829
  165    HD2  TYR  25           HD2      TYR  25  32.283   7.338   6.799
  166    HE1  TYR  25           HE1      TYR  25  36.723   7.690   4.616
  167    HE2  TYR  25           HE2      TYR  25  33.920   9.030   7.585
  168    HH   TYR  25           HH       TYR  25  36.115  10.253   6.176
  169    H    PHE  26           HN       PHE  26  34.040   3.265   3.575
  170    HA   PHE  26           HA       PHE  26  36.573   2.988   5.081
  171    HB2  PHE  26           HB2      PHE  26  35.541   1.375   2.731
  172    HB3  PHE  26           HB1      PHE  26  37.118   1.163   3.493
  173    HD1  PHE  26           HD1      PHE  26  33.497   0.673   3.839
  174    HD2  PHE  26           HD2      PHE  26  37.307   0.268   5.779
  175    HE1  PHE  26           HE1      PHE  26  32.469  -0.797   5.550
  176    HE2  PHE  26           HE2      PHE  26  36.278  -1.203   7.487
  177    HZ   PHE  26           HZ       PHE  26  33.860  -1.735   7.376
  178    H    ASN  27           HN       ASN  27  38.358   3.961   4.305
  179    HA   ASN  27           HA       ASN  27  38.053   5.685   1.965
  180    HB2  ASN  27           HB2      ASN  27  39.026   6.628   4.017
  181    HB3  ASN  27           HB1      ASN  27  40.319   5.432   3.958
  182   HD21  ASN  27          HD21      ASN  27  39.009   8.306   2.317
  183   HD22  ASN  27          HD22      ASN  27  40.412   8.634   1.419
  184    H    LYS  28           HN       LYS  28  38.348   4.620   0.091
  185    HA   LYS  28           HA       LYS  28  39.298   3.268  -1.516
  186    HB2  LYS  28           HB2      LYS  28  41.831   4.184  -0.137
  187    HB3  LYS  28           HB1      LYS  28  41.713   3.546  -1.776
  188    HG2  LYS  28           HG2      LYS  28  40.271   6.029  -0.803
  189    HG3  LYS  28           HG1      LYS  28  41.789   6.050  -1.700
  190    HD2  LYS  28           HD2      LYS  28  40.661   4.816  -3.558
  191    HD3  LYS  28           HD1      LYS  28  39.143   4.932  -2.672
  192    HE2  LYS  28           HE2      LYS  28  39.311   7.393  -2.702
  193    HE3  LYS  28           HE1      LYS  28  40.815   7.272  -3.616
  194    HZ1  LYS  28           HZ1      LYS  28  38.078   6.584  -4.464
  195    HZ2  LYS  28           HZ2      LYS  28  39.419   5.869  -5.224
  196    HZ3  LYS  28           HZ3      LYS  28  39.224   7.557  -5.248
  197    HA   PRO  29           HA       PRO  29  39.991  -0.145   1.636
  198    HB2  PRO  29           HB2      PRO  29  37.835  -1.650   0.838
  199    HB3  PRO  29           HB1      PRO  29  37.759  -0.426   2.118
  200    HG2  PRO  29           HG2      PRO  29  36.931  -0.241  -0.734
  201    HG3  PRO  29           HG1      PRO  29  36.139   0.401   0.716
  202    HD2  PRO  29           HD2      PRO  29  37.616   1.962  -0.942
  203    HD3  PRO  29           HD1      PRO  29  37.507   2.267   0.806
  204    H    THR  30           HN       THR  30  39.437   0.077  -1.792
  205    HA   THR  30           HA       THR  30  41.142  -2.301  -2.195
  206    HB   THR  30           HB       THR  30  39.789  -2.935  -4.135
  207    HG1  THR  30           HG1      THR  30  38.842  -1.166  -4.877
  208   HG21  THR  30          HG21      THR  30  39.175  -3.941  -2.015
  209   HG22  THR  30          HG22      THR  30  37.698  -3.564  -2.903
  210   HG23  THR  30          HG23      THR  30  38.219  -2.525  -1.578
  211    H    GLY  31           HN       GLY  31  42.280  -2.302  -4.263
  212    HA2  GLY  31           HA2      GLY  31  42.782  -1.003  -6.320
  213    HA3  GLY  31           HA1      GLY  31  42.722   0.435  -5.305
  214    H    TYR  32           HN       TYR  32  44.631  -2.212  -6.389
  215    HA   TYR  32           HA       TYR  32  46.691  -2.188  -4.467
  216    HB2  TYR  32           HB2      TYR  32  46.470  -3.994  -6.099
  217    HB3  TYR  32           HB1      TYR  32  46.814  -2.872  -7.415
  218    HD1  TYR  32           HD1      TYR  32  48.251  -4.219  -4.234
  219    HD2  TYR  32           HD2      TYR  32  49.037  -2.454  -8.071
  220    HE1  TYR  32           HE1      TYR  32  50.682  -4.578  -3.902
  221    HE2  TYR  32           HE2      TYR  32  51.467  -2.812  -7.738
  222    HH   TYR  32           HH       TYR  32  52.843  -4.693  -6.115
  223    H    GLY  33           HN       GLY  33  48.431  -0.906  -4.163
  224    HA2  GLY  33           HA2      GLY  33  48.733   1.404  -5.984
  225    HA3  GLY  33           HA1      GLY  33  49.151   1.414  -4.275
  226    H    SER  34           HN       SER  34  50.675   1.842  -6.909
  227    HA   SER  34           HA       SER  34  52.815  -0.144  -6.487
  228    HB2  SER  34           HB2      SER  34  52.278   1.702  -8.823
  229    HB3  SER  34           HB1      SER  34  53.649   0.602  -8.702
  230    HG   SER  34           HG       SER  34  52.373  -1.005  -9.172
  231    H    SER  35           HN       SER  35  51.994   2.899  -5.479
  232    HA   SER  35           HA       SER  35  54.360   4.380  -5.875
  233    HB2  SER  35           HB2      SER  35  53.444   5.895  -4.298
  234    HB3  SER  35           HB1      SER  35  52.061   5.195  -5.135
  235    HG   SER  35           HG       SER  35  52.298   5.273  -2.625
  236    H    SER  36           HN       SER  36  53.542   1.788  -3.733
  237    HA   SER  36           HA       SER  36  56.248   1.735  -2.704
  238    HB2  SER  36           HB2      SER  36  55.631   1.836  -0.354
  239    HB3  SER  36           HB1      SER  36  55.105   3.311  -1.161
  240    HG   SER  36           HG       SER  36  53.256   2.770  -0.289
  241    H    ARG  37           HN       ARG  37  56.653  -0.222  -1.415
  242    HA   ARG  37           HA       ARG  37  55.529  -2.520  -2.609
  243    HB2  ARG  37           HB2      ARG  37  57.181  -2.155  -0.106
  244    HB3  ARG  37           HB1      ARG  37  56.725  -3.735  -0.742
  245    HG2  ARG  37           HG2      ARG  37  57.826  -3.202  -2.879
  246    HG3  ARG  37           HG1      ARG  37  58.279  -1.614  -2.254
  247    HD2  ARG  37           HD2      ARG  37  60.166  -3.158  -2.032
  248    HD3  ARG  37           HD1      ARG  37  59.560  -2.723  -0.435
  249    HE   ARG  37           HE       ARG  37  58.886  -4.928  -0.138
  250   HH11  ARG  37          HH11      ARG  37  59.622  -4.322  -3.500
  251   HH12  ARG  37          HH12      ARG  37  59.519  -5.991  -3.945
  252   HH21  ARG  37          HH21      ARG  37  58.754  -7.103  -0.760
  253   HH22  ARG  37          HH22      ARG  37  59.030  -7.552  -2.410
  254    H    ARG  38           HN       ARG  38  54.907  -0.903   0.475
  255    HA   ARG  38           HA       ARG  38  53.135  -2.871   1.510
  256    HB2  ARG  38           HB2      ARG  38  53.427   0.075   2.131
  257    HB3  ARG  38           HB1      ARG  38  52.424  -1.045   3.056
  258    HG2  ARG  38           HG2      ARG  38  54.340  -2.373   3.668
  259    HG3  ARG  38           HG1      ARG  38  55.385  -1.464   2.573
  260    HD2  ARG  38           HD2      ARG  38  53.920  -0.253   4.928
  261    HD3  ARG  38           HD1      ARG  38  55.603  -0.768   4.971
  262    HE   ARG  38           HE       ARG  38  55.341   0.966   2.801
  263   HH11  ARG  38          HH11      ARG  38  54.974   1.034   6.271
  264   HH12  ARG  38          HH12      ARG  38  55.405   2.704   6.403
  265   HH21  ARG  38          HH21      ARG  38  55.903   3.152   3.007
  266   HH22  ARG  38          HH22      ARG  38  55.927   3.895   4.571
  267    H    ALA  39           HN       ALA  39  50.884  -2.909   1.577
  268    HA   ALA  39           HA       ALA  39  49.532  -1.148  -0.369
  269    HB1  ALA  39           HB1      ALA  39  48.376  -3.844  -0.001
  270    HB2  ALA  39           HB2      ALA  39  49.948  -3.810  -0.797
  271    HB3  ALA  39           HB3      ALA  39  48.599  -2.899  -1.473
  272    HA   PRO  40           HA       PRO  40  46.587  -0.377   2.814
  273    HB2  PRO  40           HB2      PRO  40  44.284  -0.021   1.398
  274    HB3  PRO  40           HB1      PRO  40  45.622   1.142   1.372
  275    HG2  PRO  40           HG2      PRO  40  44.859  -0.910  -0.636
  276    HG3  PRO  40           HG1      PRO  40  45.494   0.726  -0.873
  277    HD2  PRO  40           HD2      PRO  40  47.020  -1.566  -1.068
  278    HD3  PRO  40           HD1      PRO  40  47.677   0.043  -0.700
  279    H    GLN  41           HN       GLN  41  47.028  -2.887   3.205
  280    HA   GLN  41           HA       GLN  41  44.555  -4.426   2.832
  281    HB2  GLN  41           HB2      GLN  41  47.338  -5.241   3.688
  282    HB3  GLN  41           HB1      GLN  41  45.957  -6.340   3.661
  283    HG2  GLN  41           HG2      GLN  41  45.683  -6.060   1.284
  284    HG3  GLN  41           HG1      GLN  41  46.868  -4.755   1.247
  285   HE21  GLN  41          HE21      GLN  41  46.955  -7.398  -0.194
  286   HE22  GLN  41          HE22      GLN  41  48.403  -8.129   0.308
  287    H    THR  42           HN       THR  42  45.414  -2.225   4.929
  288    HA   THR  42           HA       THR  42  44.554  -3.737   7.315
  289    HB   THR  42           HB       THR  42  46.166  -1.183   7.146
  290    HG1  THR  42           HG1      THR  42  47.722  -2.561   6.927
  291   HG21  THR  42          HG21      THR  42  45.326  -2.883   9.505
  292   HG22  THR  42          HG22      THR  42  44.733  -1.264   9.132
  293   HG23  THR  42          HG23      THR  42  46.422  -1.503   9.586
  294    H    GLY  43           HN       GLY  43  42.717  -3.135   8.306
  295    HA2  GLY  43           HA2      GLY  43  41.591  -0.484   7.926
  296    HA3  GLY  43           HA1      GLY  43  40.649  -1.816   7.263
  297    H    ILE  44           HN       ILE  44  39.293  -0.537   9.035
  298    HA   ILE  44           HA       ILE  44  39.719  -1.112  11.771
  299    HB   ILE  44           HB       ILE  44  37.419  -0.400  12.100
  300   HG12  ILE  44          HG12      ILE  44  37.161  -0.575   9.077
  301   HG13  ILE  44          HG11      ILE  44  36.429  -1.705  10.216
  302   HG21  ILE  44          HG21      ILE  44  37.524   1.785  10.960
  303   HG22  ILE  44          HG22      ILE  44  38.732   1.150   9.847
  304   HG23  ILE  44          HG23      ILE  44  39.118   1.324  11.558
  305   HD11  ILE  44          HD11      ILE  44  35.225   0.212  11.270
  306   HD12  ILE  44          HD12      ILE  44  34.763  -0.067   9.590
  307   HD13  ILE  44          HD13      ILE  44  35.856   1.256   9.997
  308    H    VAL  45           HN       VAL  45  38.231  -2.894   9.162
  309    HA   VAL  45           HA       VAL  45  36.804  -4.793  10.678
  310    HB   VAL  45           HB       VAL  45  38.012  -4.911   7.916
  311   HG11  VAL  45          HG11      VAL  45  37.936  -7.199   8.625
  312   HG12  VAL  45          HG12      VAL  45  36.460  -6.941   7.689
  313   HG13  VAL  45          HG13      VAL  45  36.396  -6.963   9.449
  314   HG21  VAL  45          HG21      VAL  45  35.547  -4.838   7.330
  315   HG22  VAL  45          HG22      VAL  45  36.149  -3.378   8.113
  316   HG23  VAL  45          HG23      VAL  45  35.215  -4.554   9.040
  317    H    ASP  46           HN       ASP  46  40.083  -4.849   9.343
  318    HA   ASP  46           HA       ASP  46  40.757  -7.425  10.304
  319    HB2  ASP  46           HB2      ASP  46  42.448  -5.055   9.516
  320    HB3  ASP  46           HB1      ASP  46  43.127  -6.609   9.991
  321    H    GLU  47           HN       GLU  47  41.086  -4.176  11.704
  322    HA   GLU  47           HA       GLU  47  42.715  -4.881  13.885
  323    HB2  GLU  47           HB2      GLU  47  42.244  -2.561  13.228
  324    HB3  GLU  47           HB1      GLU  47  40.563  -2.764  13.718
  325    HG2  GLU  47           HG2      GLU  47  41.234  -3.164  16.024
  326    HG3  GLU  47           HG1      GLU  47  42.935  -3.097  15.571
  327    H    CYS  48           HN       CYS  48  39.147  -4.615  13.733
  328    HA   CYS  48           HA       CYS  48  38.750  -5.613  16.391
  329    HB2  CYS  48           HB2      CYS  48  36.852  -5.349  14.057
  330    HB3  CYS  48           HB1      CYS  48  36.392  -5.828  15.685
  331    H    CYS  49           HN       CYS  49  38.626  -7.059  13.160
  332    HA   CYS  49           HA       CYS  49  37.619  -9.573  13.880
  333    HB2  CYS  49           HB2      CYS  49  37.753  -8.808  11.545
  334    HB3  CYS  49           HB1      CYS  49  39.513  -8.878  11.620
  335    H    PHE  50           HN       PHE  50  40.986  -8.467  13.545
  336    HA   PHE  50           HA       PHE  50  41.965 -11.004  14.533
  337    HB2  PHE  50           HB2      PHE  50  43.263  -8.460  13.577
  338    HB3  PHE  50           HB1      PHE  50  44.215  -9.741  14.336
  339    HD1  PHE  50           HD1      PHE  50  41.876  -8.953  11.561
  340    HD2  PHE  50           HD2      PHE  50  44.768 -11.725  13.110
  341    HE1  PHE  50           HE1      PHE  50  41.877 -10.144   9.390
  342    HE2  PHE  50           HE2      PHE  50  44.775 -12.926  10.940
  343    HZ   PHE  50           HZ       PHE  50  43.332 -12.137   9.079
  344    H    ARG  51           HN       ARG  51  42.705  -7.646  15.489
  345    HA   ARG  51           HA       ARG  51  43.299  -8.450  18.199
  346    HB2  ARG  51           HB2      ARG  51  43.175  -5.721  16.898
  347    HB3  ARG  51           HB1      ARG  51  43.726  -6.030  18.545
  348    HG2  ARG  51           HG2      ARG  51  45.532  -7.434  17.742
  349    HG3  ARG  51           HG1      ARG  51  44.937  -7.318  16.085
  350    HD2  ARG  51           HD2      ARG  51  46.774  -5.761  16.350
  351    HD3  ARG  51           HD1      ARG  51  45.278  -4.850  16.182
  352    HE   ARG  51           HE       ARG  51  45.813  -5.306  18.929
  353   HH11  ARG  51          HH11      ARG  51  46.935  -3.479  16.173
  354   HH12  ARG  51          HH12      ARG  51  47.550  -2.179  17.134
  355   HH21  ARG  51          HH21      ARG  51  46.629  -3.587  20.160
  356   HH22  ARG  51          HH22      ARG  51  47.378  -2.238  19.374
  357    H    SER  52           HN       SER  52  42.268  -7.410  20.080
  358    HA   SER  52           HA       SER  52  39.367  -7.393  19.753
  359    HB2  SER  52           HB2      SER  52  40.299  -8.685  21.600
  360    HB3  SER  52           HB1      SER  52  41.126  -7.258  22.214
  361    HG   SER  52           HG       SER  52  39.284  -6.500  22.959
  362    H    CYS  53           HN       CYS  53  38.726  -5.460  18.902
  363    HA   CYS  53           HA       CYS  53  39.823  -2.966  19.941
  364    HB2  CYS  53           HB2      CYS  53  38.531  -1.898  18.193
  365    HB3  CYS  53           HB1      CYS  53  39.367  -3.284  17.504
  366    H    ASP  54           HN       ASP  54  38.825  -1.633  21.336
  367    HA   ASP  54           HA       ASP  54  36.537  -2.599  22.792
  368    HB2  ASP  54           HB2      ASP  54  38.190  -0.082  22.972
  369    HB3  ASP  54           HB1      ASP  54  36.789  -0.378  24.000
  370    H    LEU  55           HN       LEU  55  34.572  -1.367  23.131
  371    HA   LEU  55           HA       LEU  55  33.310  -0.616  20.724
  372    HB2  LEU  55           HB2      LEU  55  32.568  -0.146  23.620
  373    HB3  LEU  55           HB1      LEU  55  31.509   0.264  22.269
  374    HG   LEU  55           HG       LEU  55  32.661  -2.506  22.691
  375   HD11  LEU  55          HD11      LEU  55  30.405  -3.097  23.546
  376   HD12  LEU  55          HD12      LEU  55  29.954  -1.393  23.491
  377   HD13  LEU  55          HD13      LEU  55  31.220  -1.936  24.593
  378   HD21  LEU  55          HD21      LEU  55  31.986  -2.210  20.419
  379   HD22  LEU  55          HD22      LEU  55  30.547  -1.302  20.885
  380   HD23  LEU  55          HD23      LEU  55  30.635  -3.036  21.191
  381    H    ARG  56           HN       ARG  56  34.792   1.289  23.317
  382    HA   ARG  56           HA       ARG  56  33.982   3.834  22.452
  383    HB2  ARG  56           HB2      ARG  56  35.024   3.426  24.643
  384    HB3  ARG  56           HB1      ARG  56  36.548   3.033  23.848
  385    HG2  ARG  56           HG2      ARG  56  36.681   5.288  22.914
  386    HG3  ARG  56           HG1      ARG  56  35.112   5.692  23.612
  387    HD2  ARG  56           HD2      ARG  56  36.002   5.350  25.871
  388    HD3  ARG  56           HD1      ARG  56  37.563   4.883  25.200
  389    HE   ARG  56           HE       ARG  56  38.019   7.128  24.808
  390   HH11  ARG  56          HH11      ARG  56  34.626   6.679  25.517
  391   HH12  ARG  56          HH12      ARG  56  34.308   8.375  25.643
  392   HH21  ARG  56          HH21      ARG  56  37.563   9.339  24.972
  393   HH22  ARG  56          HH22      ARG  56  35.954   9.868  25.333
  394    H    ARG  57           HN       ARG  57  36.917   1.932  21.627
  395    HA   ARG  57           HA       ARG  57  38.018   3.870  19.905
  396    HB2  ARG  57           HB2      ARG  57  39.334   2.049  20.873
  397    HB3  ARG  57           HB1      ARG  57  38.371   0.868  19.979
  398    HG2  ARG  57           HG2      ARG  57  39.103   1.797  17.869
  399    HG3  ARG  57           HG1      ARG  57  39.969   3.091  18.701
  400    HD2  ARG  57           HD2      ARG  57  40.538   0.180  19.199
  401    HD3  ARG  57           HD1      ARG  57  41.375   1.090  17.946
  402    HE   ARG  57           HE       ARG  57  41.601   2.532  20.339
  403   HH11  ARG  57          HH11      ARG  57  42.592  -0.538  18.989
  404   HH12  ARG  57          HH12      ARG  57  44.025  -0.634  19.954
  405   HH21  ARG  57          HH21      ARG  57  43.492   2.376  21.578
  406   HH22  ARG  57          HH22      ARG  57  44.531   1.001  21.408
  407    H    LEU  58           HN       LEU  58  35.805   1.151  19.435
  408    HA   LEU  58           HA       LEU  58  35.770   1.060  16.649
  409    HB2  LEU  58           HB2      LEU  58  34.602  -0.464  18.402
  410    HB3  LEU  58           HB1      LEU  58  33.265   0.676  18.252
  411    HG   LEU  58           HG       LEU  58  33.450   0.336  15.719
  412   HD11  LEU  58          HD11      LEU  58  35.256  -1.864  16.743
  413   HD12  LEU  58          HD12      LEU  58  35.589  -0.673  15.490
  414   HD13  LEU  58          HD13      LEU  58  34.448  -1.973  15.178
  415   HD21  LEU  58          HD21      LEU  58  32.607  -1.860  17.622
  416   HD22  LEU  58          HD22      LEU  58  32.305  -1.958  15.888
  417   HD23  LEU  58          HD23      LEU  58  31.591  -0.652  16.835
  418    H    ASP  59           HN       ASP  59  34.194   3.259  18.870
  419    HA   ASP  59           HA       ASP  59  32.352   4.428  17.074
  420    HB2  ASP  59           HB2      ASP  59  33.685   5.496  19.562
  421    HB3  ASP  59           HB1      ASP  59  32.437   6.372  18.682
  422    H    MET  60           HN       MET  60  35.779   4.755  17.402
  423    HA   MET  60           HA       MET  60  36.127   7.344  16.323
  424    HB2  MET  60           HB2      MET  60  37.932   4.924  16.289
  425    HB3  MET  60           HB1      MET  60  38.421   6.528  15.756
  426    HG2  MET  60           HG2      MET  60  37.965   7.458  17.958
  427    HG3  MET  60           HG1      MET  60  37.331   5.910  18.516
  428    HE1  MET  60           HE1      MET  60  40.488   6.800  16.252
  429    HE2  MET  60           HE2      MET  60  41.659   7.038  17.546
  430    HE3  MET  60           HE3      MET  60  40.219   8.050  17.472
  431    H    TYR  61           HN       TYR  61  35.693   4.181  14.845
  432    HA   TYR  61           HA       TYR  61  36.308   5.060  12.168
  433    HB2  TYR  61           HB2      TYR  61  34.674   2.623  12.841
  434    HB3  TYR  61           HB1      TYR  61  35.781   2.878  11.496
  435    HD1  TYR  61           HD1      TYR  61  35.602   0.827  14.096
  436    HD2  TYR  61           HD2      TYR  61  38.141   4.039  12.783
  437    HE1  TYR  61           HE1      TYR  61  37.484  -0.116  15.406
  438    HE2  TYR  61           HE2      TYR  61  40.019   3.091  14.097
  439    HH   TYR  61           HH       TYR  61  40.733   1.086  15.105
  440    H    CYS  62           HN       CYS  62  33.580   5.377  14.208
  441    HA   CYS  62           HA       CYS  62  31.543   5.340  12.206
  442    HB2  CYS  62           HB2      CYS  62  31.623   6.660  14.931
  443    HB3  CYS  62           HB1      CYS  62  30.181   6.488  13.936
  444    H    ALA  63           HN       ALA  63  30.467   7.149  11.280
  445    HA   ALA  63           HA       ALA  63  32.176   9.199  10.385
  446    HB1  ALA  63           HB1      ALA  63  29.236   9.572  10.143
  447    HB2  ALA  63           HB2      ALA  63  29.906   8.112   9.414
  448    HB3  ALA  63           HB3      ALA  63  30.495   9.698   8.914
  449    HA   PRO  64           HA       PRO  64  31.531  12.289  13.459
  450    HB2  PRO  64           HB2      PRO  64  31.736  14.573  11.991
  451    HB3  PRO  64           HB1      PRO  64  33.123  13.522  12.331
  452    HG2  PRO  64           HG2      PRO  64  31.484  13.753   9.862
  453    HG3  PRO  64           HG1      PRO  64  33.228  13.508  10.043
  454    HD2  PRO  64           HD2      PRO  64  31.447  11.485   9.460
  455    HD3  PRO  64           HD1      PRO  64  33.012  11.215  10.252
  456    H    LEU  65           HN       LEU  65  30.038  13.822  14.305
  457    HA   LEU  65           HA       LEU  65  27.336  13.441  13.467
  458    HB2  LEU  65           HB2      LEU  65  28.594  15.334  15.460
  459    HB3  LEU  65           HB1      LEU  65  26.855  15.185  15.218
  460    HG   LEU  65           HG       LEU  65  28.646  12.838  15.899
  461   HD11  LEU  65          HD11      LEU  65  26.861  14.470  17.728
  462   HD12  LEU  65          HD12      LEU  65  28.625  14.539  17.721
  463   HD13  LEU  65          HD13      LEU  65  27.800  13.049  18.183
  464   HD21  LEU  65          HD21      LEU  65  26.344  11.939  16.628
  465   HD22  LEU  65          HD22      LEU  65  26.626  12.073  14.893
  466   HD23  LEU  65          HD23      LEU  65  25.658  13.290  15.727
  467    H    LYS  66           HN       LYS  66  25.929  14.846  12.462
  468    HA   LYS  66           HA       LYS  66  25.350  16.361  10.828
  469    HB2  LYS  66           HB2      LYS  66  27.063  18.099  12.617
  470    HB3  LYS  66           HB1      LYS  66  25.931  18.694  11.401
  471    HG2  LYS  66           HG2      LYS  66  24.083  18.123  12.636
  472    HG3  LYS  66           HG1      LYS  66  24.866  16.722  13.366
  473    HD2  LYS  66           HD2      LYS  66  24.552  18.405  15.080
  474    HD3  LYS  66           HD1      LYS  66  26.272  18.282  14.717
  475    HE2  LYS  66           HE2      LYS  66  26.133  20.250  13.258
  476    HE3  LYS  66           HE1      LYS  66  24.397  20.361  13.545
  477    HZ1  LYS  66           HZ1      LYS  66  25.803  21.856  14.943
  478    HZ2  LYS  66           HZ2      LYS  66  26.413  20.470  15.717
  479    HZ3  LYS  66           HZ3      LYS  66  24.758  20.845  15.817
  480    HA   PRO  67           HA       PRO  67  29.564  15.972   8.781
  481    HB2  PRO  67           HB2      PRO  67  28.777  14.242   6.809
  482    HB3  PRO  67           HB1      PRO  67  29.392  13.711   8.385
  483    HG2  PRO  67           HG2      PRO  67  26.584  13.900   7.413
  484    HG3  PRO  67           HG1      PRO  67  27.351  12.661   8.421
  485    HD2  PRO  67           HD2      PRO  67  25.758  14.629   9.453
  486    HD3  PRO  67           HD1      PRO  67  27.085  13.884  10.366
  487    H    ALA  68           HN       ALA  68  30.183  16.929   6.800
  488    HA   ALA  68           HA       ALA  68  28.516  18.974   5.826
  489    HB1  ALA  68           HB1      ALA  68  30.819  17.803   4.274
  490    HB2  ALA  68           HB2      ALA  68  31.073  18.798   5.709
  491    HB3  ALA  68           HB3      ALA  68  30.253  19.472   4.302
  492    H    LYS  69           HN       LYS  69  29.228  15.747   4.596
  493    HA   LYS  69           HA       LYS  69  28.260  14.483   2.936
  494    HB2  LYS  69           HB2      LYS  69  25.881  16.246   3.569
  495    HB3  LYS  69           HB1      LYS  69  25.824  14.716   2.692
  496    HG2  LYS  69           HG2      LYS  69  26.839  13.603   4.704
  497    HG3  LYS  69           HG1      LYS  69  26.680  15.131   5.570
  498    HD2  LYS  69           HD2      LYS  69  24.361  13.685   4.259
  499    HD3  LYS  69           HD1      LYS  69  24.773  13.537   5.968
  500    HE2  LYS  69           HE2      LYS  69  24.532  16.005   6.208
  501    HE3  LYS  69           HE1      LYS  69  24.027  16.094   4.522
  502    HZ1  LYS  69           HZ1      LYS  69  22.641  14.796   6.785
  503    HZ2  LYS  69           HZ2      LYS  69  22.277  14.400   5.173
  504    HZ3  LYS  69           HZ3      LYS  69  22.054  15.989   5.732
  505    H    SER  70           HN       SER  70  29.818  16.602   2.007
  506    HA   SER  70           HA       SER  70  28.458  18.182   0.056
  507    HB2  SER  70           HB2      SER  70  30.656  18.841  -0.675
  508    HB3  SER  70           HB1      SER  70  30.689  18.733   1.083
  509    HG   SER  70           HG       SER  70  32.063  17.313  -0.782
  510    H    ALA  71           HN       ALA  71  28.806  18.027  -2.280
  511    HA   ALA  71           HA       ALA  71  28.550  16.882  -4.256
  512    HB1  ALA  71           HB1      ALA  71  30.818  16.380  -4.298
  513    HB2  ALA  71           HB2      ALA  71  30.101  14.770  -4.366
  514    HB3  ALA  71           HB3      ALA  71  30.731  15.392  -2.841
  Start of MODEL   18
    1    H1   GLY   1           HT1      GLY   1  34.446 -17.896  31.813
    2    H2   GLY   1           HT2      GLY   1  32.888 -17.553  32.395
    3    H3   GLY   1           HT3      GLY   1  33.990 -16.291  32.114
    4    HA2  GLY   1           HA2      GLY   1  32.238 -17.649  30.278
    5    HA3  GLY   1           HA1      GLY   1  32.988 -16.058  30.150
    6    H    GLY   2           HN       GLY   2  34.361 -15.888  28.504
    7    HA2  GLY   2           HA2      GLY   2  36.567 -17.573  28.068
    8    HA3  GLY   2           HA1      GLY   2  35.285 -18.049  26.958
    9    HA   PRO   3           HA       PRO   3  37.868 -14.568  25.112
   10    HB2  PRO   3           HB2      PRO   3  37.730 -16.412  22.782
   11    HB3  PRO   3           HB1      PRO   3  39.126 -15.551  23.457
   12    HG2  PRO   3           HG2      PRO   3  38.856 -18.164  23.782
   13    HG3  PRO   3           HG1      PRO   3  39.488 -17.142  25.088
   14    HD2  PRO   3           HD2      PRO   3  36.719 -18.265  24.758
   15    HD3  PRO   3           HD1      PRO   3  37.722 -18.185  26.226
   16    H    GLU   4           HN       GLU   4  37.145 -13.080  23.595
   17    HA   GLU   4           HA       GLU   4  34.649 -13.575  22.164
   18    HB2  GLU   4           HB2      GLU   4  34.114 -12.620  24.450
   19    HB3  GLU   4           HB1      GLU   4  34.959 -11.156  23.947
   20    HG2  GLU   4           HG2      GLU   4  32.790 -12.331  22.220
   21    HG3  GLU   4           HG1      GLU   4  32.375 -11.303  23.590
   22    H    THR   5           HN       THR   5  34.787 -12.789  20.184
   23    HA   THR   5           HA       THR   5  36.254 -10.321  19.642
   24    HB   THR   5           HB       THR   5  37.921 -12.161  19.391
   25    HG1  THR   5           HG1      THR   5  38.700 -11.108  17.749
   26   HG21  THR   5          HG21      THR   5  37.651 -13.850  17.730
   27   HG22  THR   5          HG22      THR   5  36.228 -13.058  17.053
   28   HG23  THR   5          HG23      THR   5  36.138 -13.831  18.637
   29    H    LEU   6           HN       LEU   6  35.687  -9.343  17.646
   30    HA   LEU   6           HA       LEU   6  33.181 -10.405  16.490
   31    HB2  LEU   6           HB2      LEU   6  34.218  -7.559  16.559
   32    HB3  LEU   6           HB1      LEU   6  32.680  -8.079  15.871
   33    HG   LEU   6           HG       LEU   6  33.481  -8.463  18.771
   34   HD11  LEU   6          HD11      LEU   6  31.513  -6.499  17.560
   35   HD12  LEU   6          HD12      LEU   6  33.137  -6.070  18.098
   36   HD13  LEU   6          HD13      LEU   6  31.943  -6.645  19.265
   37   HD21  LEU   6          HD21      LEU   6  30.966  -8.889  18.953
   38   HD22  LEU   6          HD22      LEU   6  31.889 -10.141  18.125
   39   HD23  LEU   6          HD23      LEU   6  30.946  -8.980  17.191
   40    H    CYS   7           HN       CYS   7  33.248 -11.103  14.455
   41    HA   CYS   7           HA       CYS   7  34.893  -9.808  12.464
   42    HB2  CYS   7           HB2      CYS   7  36.469 -11.401  13.625
   43    HB3  CYS   7           HB1      CYS   7  35.446 -12.721  13.057
   44    H    GLY   8           HN       GLY   8  34.036 -10.060  10.453
   45    HA2  GLY   8           HA2      GLY   8  32.885 -11.299   8.756
   46    HA3  GLY   8           HA1      GLY   8  32.079 -12.219  10.021
   47    H    ALA   9           HN       ALA   9  30.018 -11.802   9.200
   48    HA   ALA   9           HA       ALA   9  28.997  -9.269   8.531
   49    HB1  ALA   9           HB1      ALA   9  27.783 -11.895   9.282
   50    HB2  ALA   9           HB2      ALA   9  27.608 -10.961   7.796
   51    HB3  ALA   9           HB3      ALA   9  26.749 -10.465   9.257
   52    H    GLU  10           HN       GLU  10  29.180 -10.988  11.608
   53    HA   GLU  10           HA       GLU  10  27.503  -9.316  13.116
   54    HB2  GLU  10           HB2      GLU  10  29.925 -10.949  13.893
   55    HB3  GLU  10           HB1      GLU  10  28.894 -10.128  15.065
   56    HG2  GLU  10           HG2      GLU  10  26.966 -11.406  14.362
   57    HG3  GLU  10           HG1      GLU  10  27.867 -12.111  13.020
   58    H    LEU  11           HN       LEU  11  30.973  -9.095  12.387
   59    HA   LEU  11           HA       LEU  11  31.519  -6.872  14.034
   60    HB2  LEU  11           HB2      LEU  11  33.313  -8.232  13.097
   61    HB3  LEU  11           HB1      LEU  11  32.851  -7.758  11.463
   62    HG   LEU  11           HG       LEU  11  33.360  -5.399  11.998
   63   HD11  LEU  11          HD11      LEU  11  32.915  -5.285  14.348
   64   HD12  LEU  11          HD12      LEU  11  34.648  -5.009  14.168
   65   HD13  LEU  11          HD13      LEU  11  34.056  -6.584  14.696
   66   HD21  LEU  11          HD21      LEU  11  35.158  -6.670  11.033
   67   HD22  LEU  11          HD22      LEU  11  35.526  -7.436  12.578
   68   HD23  LEU  11          HD23      LEU  11  35.849  -5.720  12.344
   69    H    VAL  12           HN       VAL  12  30.624  -7.083  10.597
   70    HA   VAL  12           HA       VAL  12  30.686  -4.327  10.069
   71    HB   VAL  12           HB       VAL  12  29.255  -6.641   8.783
   72   HG11  VAL  12          HG11      VAL  12  29.125  -3.681   8.108
   73   HG12  VAL  12          HG12      VAL  12  27.770  -4.781   8.365
   74   HG13  VAL  12          HG13      VAL  12  28.772  -4.940   6.924
   75   HG21  VAL  12          HG21      VAL  12  30.841  -6.018   6.946
   76   HG22  VAL  12          HG22      VAL  12  31.654  -6.490   8.439
   77   HG23  VAL  12          HG23      VAL  12  31.521  -4.784   8.007
   78    H    ASP  13           HN       ASP  13  28.031  -6.443  11.080
   79    HA   ASP  13           HA       ASP  13  25.990  -4.501  11.083
   80    HB2  ASP  13           HB2      ASP  13  26.343  -7.114  12.549
   81    HB3  ASP  13           HB1      ASP  13  24.895  -6.122  12.732
   82    H    ALA  14           HN       ALA  14  28.319  -5.506  13.545
   83    HA   ALA  14           HA       ALA  14  27.241  -4.066  15.709
   84    HB1  ALA  14           HB1      ALA  14  30.187  -4.540  15.248
   85    HB2  ALA  14           HB2      ALA  14  29.089  -5.819  15.772
   86    HB3  ALA  14           HB3      ALA  14  29.336  -4.397  16.786
   87    H    LEU  15           HN       LEU  15  29.500  -3.141  13.142
   88    HA   LEU  15           HA       LEU  15  30.200  -0.601  14.143
   89    HB2  LEU  15           HB2      LEU  15  30.074  -1.709  11.335
   90    HB3  LEU  15           HB1      LEU  15  30.680  -0.093  11.700
   91    HG   LEU  15           HG       LEU  15  31.760  -2.579  13.049
   92   HD11  LEU  15          HD11      LEU  15  33.592  -2.537  11.449
   93   HD12  LEU  15          HD12      LEU  15  32.920  -1.112  10.657
   94   HD13  LEU  15          HD13      LEU  15  32.076  -2.658  10.554
   95   HD21  LEU  15          HD21      LEU  15  32.279  -0.580  14.264
   96   HD22  LEU  15          HD22      LEU  15  32.637   0.312  12.786
   97   HD23  LEU  15          HD23      LEU  15  33.727  -0.959  13.335
   98    H    GLN  16           HN       GLN  16  27.553  -1.639  12.008
   99    HA   GLN  16           HA       GLN  16  26.533   0.954  11.518
  100    HB2  GLN  16           HB2      GLN  16  25.987  -1.079  10.173
  101    HB3  GLN  16           HB1      GLN  16  25.019  -1.665  11.527
  102    HG2  GLN  16           HG2      GLN  16  23.582  -0.522   9.916
  103    HG3  GLN  16           HG1      GLN  16  23.654   0.395  11.418
  104   HE21  GLN  16          HE21      GLN  16  23.730   2.591  10.923
  105   HE22  GLN  16          HE22      GLN  16  24.656   3.273   9.673
  106    H    PHE  17           HN       PHE  17  25.850  -1.492  13.980
  107    HA   PHE  17           HA       PHE  17  23.650  -0.234  15.202
  108    HB2  PHE  17           HB2      PHE  17  24.128  -2.498  15.770
  109    HB3  PHE  17           HB1      PHE  17  25.771  -2.098  16.273
  110    HD1  PHE  17           HD1      PHE  17  22.173  -1.724  17.141
  111    HD2  PHE  17           HD2      PHE  17  26.239  -1.166  18.431
  112    HE1  PHE  17           HE1      PHE  17  21.381  -1.274  19.451
  113    HE2  PHE  17           HE2      PHE  17  25.444  -0.726  20.738
  114    HZ   PHE  17           HZ       PHE  17  23.017  -0.779  21.249
  115    H    VAL  18           HN       VAL  18  27.116  -0.090  16.047
  116    HA   VAL  18           HA       VAL  18  26.813   1.689  18.214
  117    HB   VAL  18           HB       VAL  18  29.173   1.139  16.407
  118   HG11  VAL  18          HG11      VAL  18  29.499   3.306  17.437
  119   HG12  VAL  18          HG12      VAL  18  30.487   2.134  18.309
  120   HG13  VAL  18          HG13      VAL  18  28.961   2.687  18.998
  121   HG21  VAL  18          HG21      VAL  18  29.922  -0.256  18.283
  122   HG22  VAL  18          HG22      VAL  18  28.325  -0.776  17.749
  123   HG23  VAL  18          HG23      VAL  18  28.494   0.196  19.211
  124    H    CYS  19           HN       CYS  19  27.676   2.274  14.818
  125    HA   CYS  19           HA       CYS  19  27.919   5.100  15.065
  126    HB2  CYS  19           HB2      CYS  19  27.386   3.357  12.643
  127    HB3  CYS  19           HB1      CYS  19  27.755   5.072  12.584
  128    H    GLY  20           HN       GLY  20  25.248   2.971  14.250
  129    HA2  GLY  20           HA2      GLY  20  22.986   3.350  14.109
  130    HA3  GLY  20           HA1      GLY  20  23.267   4.768  15.115
  131    H    ASP  21           HN       ASP  21  22.345   6.462  14.177
  132    HA   ASP  21           HA       ASP  21  21.718   6.733  11.462
  133    HB2  ASP  21           HB2      ASP  21  22.072   8.787  13.650
  134    HB3  ASP  21           HB1      ASP  21  21.505   9.196  12.032
  135    H    ARG  22           HN       ARG  22  24.594   7.645  13.275
  136    HA   ARG  22           HA       ARG  22  25.792   9.304  11.341
  137    HB2  ARG  22           HB2      ARG  22  27.017   7.508  13.447
  138    HB3  ARG  22           HB1      ARG  22  27.930   8.679  12.495
  139    HG2  ARG  22           HG2      ARG  22  26.627  10.512  13.373
  140    HG3  ARG  22           HG1      ARG  22  25.515   9.403  14.173
  141    HD2  ARG  22           HD2      ARG  22  28.474   9.602  14.792
  142    HD3  ARG  22           HD1      ARG  22  27.207  10.386  15.731
  143    HE   ARG  22           HE       ARG  22  26.542   7.682  15.586
  144   HH11  ARG  22          HH11      ARG  22  29.126   9.668  16.831
  145   HH12  ARG  22          HH12      ARG  22  29.509   8.572  18.113
  146   HH21  ARG  22          HH21      ARG  22  27.072   6.267  17.272
  147   HH22  ARG  22          HH22      ARG  22  28.358   6.662  18.361
  148    H    GLY  23           HN       GLY  23  25.832   5.787  11.786
  149    HA2  GLY  23           HA2      GLY  23  26.405   4.089  10.339
  150    HA3  GLY  23           HA1      GLY  23  26.334   5.273   9.037
  151    H    PHE  24           HN       PHE  24  28.211   3.766   8.390
  152    HA   PHE  24           HA       PHE  24  30.678   5.172   9.020
  153    HB2  PHE  24           HB2      PHE  24  31.926   3.193   9.653
  154    HB3  PHE  24           HB1      PHE  24  30.545   3.362  10.733
  155    HD1  PHE  24           HD1      PHE  24  32.167   1.312   8.225
  156    HD2  PHE  24           HD2      PHE  24  28.479   1.979  10.323
  157    HE1  PHE  24           HE1      PHE  24  31.369  -0.932   7.541
  158    HE2  PHE  24           HE2      PHE  24  27.685  -0.267   9.646
  159    HZ   PHE  24           HZ       PHE  24  29.130  -1.722   8.254
  160    H    TYR  25           HN       TYR  25  32.462   4.490   7.575
  161    HA   TYR  25           HA       TYR  25  31.632   3.038   5.169
  162    HB2  TYR  25           HB2      TYR  25  32.211   4.811   3.661
  163    HB3  TYR  25           HB1      TYR  25  31.086   5.486   4.840
  164    HD1  TYR  25           HD1      TYR  25  34.543   5.446   3.633
  165    HD2  TYR  25           HD2      TYR  25  31.886   6.987   6.634
  166    HE1  TYR  25           HE1      TYR  25  36.247   7.121   4.277
  167    HE2  TYR  25           HE2      TYR  25  33.591   8.671   7.277
  168    HH   TYR  25           HH       TYR  25  35.999   8.998   7.130
  169    H    PHE  26           HN       PHE  26  33.524   2.802   3.646
  170    HA   PHE  26           HA       PHE  26  36.012   2.494   5.212
  171    HB2  PHE  26           HB2      PHE  26  35.022   0.892   2.838
  172    HB3  PHE  26           HB1      PHE  26  36.571   0.659   3.647
  173    HD1  PHE  26           HD1      PHE  26  32.969   0.106   3.810
  174    HD2  PHE  26           HD2      PHE  26  36.649  -0.115   6.016
  175    HE1  PHE  26           HE1      PHE  26  31.873  -1.350   5.494
  176    HE2  PHE  26           HE2      PHE  26  35.552  -1.570   7.698
  177    HZ   PHE  26           HZ       PHE  26  33.165  -2.187   7.438
  178    H    ASN  27           HN       ASN  27  38.009   2.870   4.137
  179    HA   ASN  27           HA       ASN  27  38.106   5.218   2.616
  180    HB2  ASN  27           HB2      ASN  27  40.139   3.016   3.007
  181    HB3  ASN  27           HB1      ASN  27  40.491   4.515   2.149
  182   HD21  ASN  27          HD21      ASN  27  41.794   3.762   4.631
  183   HD22  ASN  27          HD22      ASN  27  41.338   4.896   5.809
  184    H    LYS  28           HN       LYS  28  38.560   5.606   0.434
  185    HA   LYS  28           HA       LYS  28  37.202   3.959  -1.389
  186    HB2  LYS  28           HB2      LYS  28  39.177   6.201  -1.821
  187    HB3  LYS  28           HB1      LYS  28  38.304   5.413  -3.136
  188    HG2  LYS  28           HG2      LYS  28  36.159   6.015  -2.086
  189    HG3  LYS  28           HG1      LYS  28  37.024   6.799  -0.761
  190    HD2  LYS  28           HD2      LYS  28  38.065   8.362  -2.364
  191    HD3  LYS  28           HD1      LYS  28  37.194   7.583  -3.687
  192    HE2  LYS  28           HE2      LYS  28  35.048   8.186  -2.645
  193    HE3  LYS  28           HE1      LYS  28  35.905   8.950  -1.307
  194    HZ1  LYS  28           HZ1      LYS  28  35.902   9.766  -4.156
  195    HZ2  LYS  28           HZ2      LYS  28  37.002  10.382  -3.018
  196    HZ3  LYS  28           HZ3      LYS  28  35.337  10.648  -2.823
  197    HA   PRO  29           HA       PRO  29  40.222   0.944  -2.519
  198    HB2  PRO  29           HB2      PRO  29  39.629   0.558  -5.169
  199    HB3  PRO  29           HB1      PRO  29  38.640  -0.075  -3.840
  200    HG2  PRO  29           HG2      PRO  29  38.220   2.331  -5.540
  201    HG3  PRO  29           HG1      PRO  29  37.041   1.159  -4.924
  202    HD2  PRO  29           HD2      PRO  29  37.403   3.616  -3.798
  203    HD3  PRO  29           HD1      PRO  29  36.878   2.197  -2.865
  204    H    THR  30           HN       THR  30  40.088   3.975  -4.187
  205    HA   THR  30           HA       THR  30  42.273   3.723  -5.941
  206    HB   THR  30           HB       THR  30  41.280   6.182  -4.479
  207    HG1  THR  30           HG1      THR  30  40.114   6.478  -6.406
  208   HG21  THR  30          HG21      THR  30  42.319   7.367  -6.426
  209   HG22  THR  30          HG22      THR  30  43.028   5.832  -6.927
  210   HG23  THR  30          HG23      THR  30  43.495   6.559  -5.389
  211    H    GLY  31           HN       GLY  31  44.425   3.703  -5.633
  212    HA2  GLY  31           HA2      GLY  31  46.325   4.726  -4.392
  213    HA3  GLY  31           HA1      GLY  31  45.435   4.336  -2.922
  214    H    TYR  32           HN       TYR  32  45.650   2.255  -5.754
  215    HA   TYR  32           HA       TYR  32  46.425   0.009  -4.204
  216    HB2  TYR  32           HB2      TYR  32  46.356   0.495  -7.182
  217    HB3  TYR  32           HB1      TYR  32  46.805  -1.056  -6.472
  218    HD1  TYR  32           HD1      TYR  32  44.069   1.272  -7.167
  219    HD2  TYR  32           HD2      TYR  32  45.171  -2.345  -5.126
  220    HE1  TYR  32           HE1      TYR  32  41.672   0.692  -6.896
  221    HE2  TYR  32           HE2      TYR  32  42.775  -2.923  -4.855
  222    HH   TYR  32           HH       TYR  32  40.649  -2.427  -5.794
  223    H    GLY  33           HN       GLY  33  48.387  -0.970  -3.925
  224    HA2  GLY  33           HA2      GLY  33  50.730   0.665  -4.147
  225    HA3  GLY  33           HA1      GLY  33  50.674  -1.002  -3.581
  226    H    SER  34           HN       SER  34  52.704   0.043  -5.273
  227    HA   SER  34           HA       SER  34  52.151  -1.429  -7.782
  228    HB2  SER  34           HB2      SER  34  53.766   0.048  -8.882
  229    HB3  SER  34           HB1      SER  34  52.464   0.986  -8.157
  230    HG   SER  34           HG       SER  34  55.146   0.866  -7.532
  231    H    SER  35           HN       SER  35  54.224  -1.003  -5.041
  232    HA   SER  35           HA       SER  35  56.557  -2.279  -5.971
  233    HB2  SER  35           HB2      SER  35  56.515  -1.005  -3.894
  234    HB3  SER  35           HB1      SER  35  55.375  -2.149  -3.189
  235    HG   SER  35           HG       SER  35  57.631  -2.509  -2.649
  236    H    SER  36           HN       SER  36  53.689  -3.564  -4.314
  237    HA   SER  36           HA       SER  36  54.356  -6.226  -5.378
  238    HB2  SER  36           HB2      SER  36  53.703  -7.243  -3.213
  239    HB3  SER  36           HB1      SER  36  55.136  -6.231  -3.071
  240    HG   SER  36           HG       SER  36  54.068  -4.978  -1.775
  241    H    ARG  37           HN       ARG  37  52.321  -3.950  -5.844
  242    HA   ARG  37           HA       ARG  37  50.111  -3.777  -6.435
  243    HB2  ARG  37           HB2      ARG  37  50.279  -6.800  -6.484
  244    HB3  ARG  37           HB1      ARG  37  49.011  -5.824  -7.225
  245    HG2  ARG  37           HG2      ARG  37  50.734  -4.699  -8.624
  246    HG3  ARG  37           HG1      ARG  37  51.958  -5.766  -7.936
  247    HD2  ARG  37           HD2      ARG  37  51.267  -6.732 -10.032
  248    HD3  ARG  37           HD1      ARG  37  50.581  -7.720  -8.744
  249    HE   ARG  37           HE       ARG  37  48.463  -7.028  -9.396
  250   HH11  ARG  37          HH11      ARG  37  50.899  -5.002 -10.858
  251   HH12  ARG  37          HH12      ARG  37  49.773  -4.203 -11.902
  252   HH21  ARG  37          HH21      ARG  37  47.021  -5.967 -10.771
  253   HH22  ARG  37          HH22      ARG  37  47.596  -4.742 -11.853
  254    H    ARG  38           HN       ARG  38  50.546  -3.489  -3.753
  255    HA   ARG  38           HA       ARG  38  49.032  -5.211  -2.090
  256    HB2  ARG  38           HB2      ARG  38  49.856  -2.319  -1.775
  257    HB3  ARG  38           HB1      ARG  38  49.059  -3.253  -0.508
  258    HG2  ARG  38           HG2      ARG  38  50.884  -4.904  -0.560
  259    HG3  ARG  38           HG1      ARG  38  51.676  -3.991  -1.846
  260    HD2  ARG  38           HD2      ARG  38  51.878  -2.045  -0.360
  261    HD3  ARG  38           HD1      ARG  38  51.060  -2.930   0.924
  262    HE   ARG  38           HE       ARG  38  53.297  -4.426   0.079
  263   HH11  ARG  38          HH11      ARG  38  52.508  -1.444   1.710
  264   HH12  ARG  38          HH12      ARG  38  53.959  -1.439   2.652
  265   HH21  ARG  38          HH21      ARG  38  55.181  -4.391   1.329
  266   HH22  ARG  38          HH22      ARG  38  55.462  -3.093   2.440
  267    H    ALA  39           HN       ALA  39  46.928  -5.148  -1.420
  268    HA   ALA  39           HA       ALA  39  45.167  -3.123  -2.659
  269    HB1  ALA  39           HB1      ALA  39  44.419  -6.031  -2.316
  270    HB2  ALA  39           HB2      ALA  39  45.091  -5.383  -3.814
  271    HB3  ALA  39           HB3      ALA  39  43.545  -4.786  -3.209
  272    HA   PRO  40           HA       PRO  40  44.511  -3.429   1.932
  273    HB2  PRO  40           HB2      PRO  40  44.576  -0.736   2.391
  274    HB3  PRO  40           HB1      PRO  40  46.029  -1.755   2.372
  275    HG2  PRO  40           HG2      PRO  40  44.953   0.048   0.264
  276    HG3  PRO  40           HG1      PRO  40  46.631  -0.248   0.752
  277    HD2  PRO  40           HD2      PRO  40  45.493  -1.384  -1.473
  278    HD3  PRO  40           HD1      PRO  40  46.823  -2.135  -0.566
  279    H    GLN  41           HN       GLN  41  42.397  -4.123   0.864
  280    HA   GLN  41           HA       GLN  41  40.413  -1.990   0.643
  281    HB2  GLN  41           HB2      GLN  41  40.282  -4.961   0.107
  282    HB3  GLN  41           HB1      GLN  41  38.897  -3.879  -0.038
  283    HG2  GLN  41           HG2      GLN  41  40.006  -2.578  -1.748
  284    HG3  GLN  41           HG1      GLN  41  41.510  -3.464  -1.510
  285   HE21  GLN  41          HE21      GLN  41  39.766  -3.257  -3.983
  286   HE22  GLN  41          HE22      GLN  41  39.406  -4.865  -4.392
  287    H    THR  42           HN       THR  42  41.743  -3.296   3.189
  288    HA   THR  42           HA       THR  42  39.299  -3.146   4.777
  289    HB   THR  42           HB       THR  42  39.485  -5.531   4.247
  290    HG1  THR  42           HG1      THR  42  39.180  -6.114   6.276
  291   HG21  THR  42          HG21      THR  42  41.842  -5.719   3.762
  292   HG22  THR  42          HG22      THR  42  41.489  -6.776   5.129
  293   HG23  THR  42          HG23      THR  42  42.270  -5.217   5.398
  294    H    GLY  43           HN       GLY  43  39.674  -2.630   6.962
  295    HA2  GLY  43           HA2      GLY  43  42.429  -2.308   7.874
  296    HA3  GLY  43           HA1      GLY  43  41.486  -0.830   7.704
  297    H    ILE  44           HN       ILE  44  39.313  -0.869   8.832
  298    HA   ILE  44           HA       ILE  44  39.687  -1.339  11.586
  299    HB   ILE  44           HB       ILE  44  37.349  -0.709  11.823
  300   HG12  ILE  44          HG12      ILE  44  37.210  -0.971   8.802
  301   HG13  ILE  44          HG11      ILE  44  36.450  -2.068   9.953
  302   HG21  ILE  44          HG21      ILE  44  39.069   1.026  11.264
  303   HG22  ILE  44          HG22      ILE  44  37.444   1.459  10.730
  304   HG23  ILE  44          HG23      ILE  44  38.622   0.855   9.565
  305   HD11  ILE  44          HD11      ILE  44  34.711  -0.589   9.384
  306   HD12  ILE  44          HD12      ILE  44  35.778   0.813   9.398
  307   HD13  ILE  44          HD13      ILE  44  35.306   0.050  10.916
  308    H    VAL  45           HN       VAL  45  38.237  -3.255   9.034
  309    HA   VAL  45           HA       VAL  45  36.876  -5.130  10.641
  310    HB   VAL  45           HB       VAL  45  38.049  -5.340   7.872
  311   HG11  VAL  45          HG11      VAL  45  36.417  -7.310   9.488
  312   HG12  VAL  45          HG12      VAL  45  37.966  -7.591   8.692
  313   HG13  VAL  45          HG13      VAL  45  36.505  -7.368   7.728
  314   HG21  VAL  45          HG21      VAL  45  35.267  -4.919   8.997
  315   HG22  VAL  45          HG22      VAL  45  35.585  -5.274   7.298
  316   HG23  VAL  45          HG23      VAL  45  36.205  -3.788   8.020
  317    H    ASP  46           HN       ASP  46  40.129  -5.175   9.236
  318    HA   ASP  46           HA       ASP  46  40.866  -7.704  10.250
  319    HB2  ASP  46           HB2      ASP  46  42.506  -5.314   9.402
  320    HB3  ASP  46           HB1      ASP  46  43.219  -6.848   9.895
  321    H    GLU  47           HN       GLU  47  41.182  -4.423  11.579
  322    HA   GLU  47           HA       GLU  47  42.839  -5.070  13.752
  323    HB2  GLU  47           HB2      GLU  47  40.720  -2.946  13.397
  324    HB3  GLU  47           HB1      GLU  47  41.780  -3.021  14.804
  325    HG2  GLU  47           HG2      GLU  47  43.744  -2.758  13.424
  326    HG3  GLU  47           HG1      GLU  47  42.790  -2.918  11.950
  327    H    CYS  48           HN       CYS  48  39.260  -4.825  13.649
  328    HA   CYS  48           HA       CYS  48  38.934  -5.747  16.343
  329    HB2  CYS  48           HB2      CYS  48  36.964  -5.564  14.061
  330    HB3  CYS  48           HB1      CYS  48  36.554  -5.987  15.712
  331    H    CYS  49           HN       CYS  49  38.734  -7.292  13.161
  332    HA   CYS  49           HA       CYS  49  37.741  -9.778  13.983
  333    HB2  CYS  49           HB2      CYS  49  37.802  -9.078  11.624
  334    HB3  CYS  49           HB1      CYS  49  39.563  -9.176  11.639
  335    H    PHE  50           HN       PHE  50  41.097  -8.684  13.531
  336    HA   PHE  50           HA       PHE  50  42.094 -11.203  14.564
  337    HB2  PHE  50           HB2      PHE  50  43.379  -8.714  13.470
  338    HB3  PHE  50           HB1      PHE  50  44.346  -9.972  14.247
  339    HD1  PHE  50           HD1      PHE  50  42.006  -9.201  11.481
  340    HD2  PHE  50           HD2      PHE  50  44.750 -12.074  13.116
  341    HE1  PHE  50           HE1      PHE  50  41.921 -10.478   9.362
  342    HE2  PHE  50           HE2      PHE  50  44.669 -13.357  10.994
  343    HZ   PHE  50           HZ       PHE  50  43.256 -12.559   9.116
  344    H    ARG  51           HN       ARG  51  42.851  -7.811  15.366
  345    HA   ARG  51           HA       ARG  51  43.547  -8.506  18.083
  346    HB2  ARG  51           HB2      ARG  51  43.383  -5.853  16.645
  347    HB3  ARG  51           HB1      ARG  51  43.919  -6.042  18.315
  348    HG2  ARG  51           HG2      ARG  51  45.707  -7.573  17.564
  349    HG3  ARG  51           HG1      ARG  51  45.183  -7.357  15.894
  350    HD2  ARG  51           HD2      ARG  51  45.622  -4.937  16.067
  351    HD3  ARG  51           HD1      ARG  51  46.151  -5.153  17.732
  352    HE   ARG  51           HE       ARG  51  47.667  -6.864  16.089
  353   HH11  ARG  51          HH11      ARG  51  47.177  -3.463  16.702
  354   HH12  ARG  51          HH12      ARG  51  48.790  -3.029  16.248
  355   HH21  ARG  51          HH21      ARG  51  49.767  -6.264  15.507
  356   HH22  ARG  51          HH22      ARG  51  50.246  -4.600  15.576
  357    H    SER  52           HN       SER  52  42.590  -7.304  19.941
  358    HA   SER  52           HA       SER  52  39.671  -7.342  19.708
  359    HB2  SER  52           HB2      SER  52  40.652  -8.580  21.565
  360    HB3  SER  52           HB1      SER  52  41.499  -7.135  22.112
  361    HG   SER  52           HG       SER  52  38.715  -7.655  22.052
  362    H    CYS  53           HN       CYS  53  39.032  -5.437  18.794
  363    HA   CYS  53           HA       CYS  53  40.166  -2.915  19.687
  364    HB2  CYS  53           HB2      CYS  53  38.730  -1.918  17.989
  365    HB3  CYS  53           HB1      CYS  53  39.584  -3.295  17.303
  366    H    ASP  54           HN       ASP  54  39.283  -1.541  21.120
  367    HA   ASP  54           HA       ASP  54  37.151  -2.425  22.807
  368    HB2  ASP  54           HB2      ASP  54  38.654   0.186  22.606
  369    HB3  ASP  54           HB1      ASP  54  37.400  -0.114  23.807
  370    H    LEU  55           HN       LEU  55  35.116  -1.428  23.144
  371    HA   LEU  55           HA       LEU  55  33.691  -0.800  20.787
  372    HB2  LEU  55           HB2      LEU  55  33.018  -0.435  23.712
  373    HB3  LEU  55           HB1      LEU  55  31.878  -0.100  22.408
  374    HG   LEU  55           HG       LEU  55  33.287  -2.762  22.720
  375   HD11  LEU  55          HD11      LEU  55  31.295  -3.598  23.797
  376   HD12  LEU  55          HD12      LEU  55  30.458  -2.064  23.558
  377   HD13  LEU  55          HD13      LEU  55  31.810  -2.166  24.687
  378   HD21  LEU  55          HD21      LEU  55  32.472  -2.469  20.490
  379   HD22  LEU  55          HD22      LEU  55  30.979  -1.721  21.056
  380   HD23  LEU  55          HD23      LEU  55  31.252  -3.445  21.306
  381    H    ARG  56           HN       ARG  56  35.076   1.231  23.339
  382    HA   ARG  56           HA       ARG  56  33.955   3.678  22.531
  383    HB2  ARG  56           HB2      ARG  56  35.102   3.358  24.682
  384    HB3  ARG  56           HB1      ARG  56  36.638   3.174  23.837
  385    HG2  ARG  56           HG2      ARG  56  36.460   5.441  22.944
  386    HG3  ARG  56           HG1      ARG  56  34.872   5.635  23.689
  387    HD2  ARG  56           HD2      ARG  56  36.567   6.699  25.094
  388    HD3  ARG  56           HD1      ARG  56  35.906   5.291  25.922
  389    HE   ARG  56           HE       ARG  56  37.983   4.264  25.748
  390   HH11  ARG  56          HH11      ARG  56  37.837   7.056  23.659
  391   HH12  ARG  56          HH12      ARG  56  39.529   7.015  23.295
  392   HH21  ARG  56          HH21      ARG  56  40.184   4.240  25.252
  393   HH22  ARG  56          HH22      ARG  56  40.848   5.433  24.188
  394    H    ARG  57           HN       ARG  57  37.060   2.151  21.601
  395    HA   ARG  57           HA       ARG  57  37.892   4.212  19.879
  396    HB2  ARG  57           HB2      ARG  57  39.423   2.531  20.745
  397    HB3  ARG  57           HB1      ARG  57  38.540   1.259  19.899
  398    HG2  ARG  57           HG2      ARG  57  39.058   2.325  17.748
  399    HG3  ARG  57           HG1      ARG  57  39.932   3.600  18.593
  400    HD2  ARG  57           HD2      ARG  57  40.607   0.689  18.916
  401    HD3  ARG  57           HD1      ARG  57  41.349   1.685  17.666
  402    HE   ARG  57           HE       ARG  57  41.903   1.757  20.504
  403   HH11  ARG  57          HH11      ARG  57  41.952   3.556  17.510
  404   HH12  ARG  57          HH12      ARG  57  43.198   4.632  18.044
  405   HH21  ARG  57          HH21      ARG  57  43.531   3.176  21.163
  406   HH22  ARG  57          HH22      ARG  57  44.086   4.421  20.093
  407    H    LEU  58           HN       LEU  58  35.982   1.277  19.396
  408    HA   LEU  58           HA       LEU  58  35.847   1.271  16.611
  409    HB2  LEU  58           HB2      LEU  58  34.932  -0.433  18.375
  410    HB3  LEU  58           HB1      LEU  58  33.459   0.537  18.279
  411    HG   LEU  58           HG       LEU  58  33.713   0.285  15.708
  412   HD11  LEU  58          HD11      LEU  58  35.032  -1.492  14.887
  413   HD12  LEU  58          HD12      LEU  58  35.221  -2.212  16.483
  414   HD13  LEU  58          HD13      LEU  58  36.081  -0.732  16.080
  415   HD21  LEU  58          HD21      LEU  58  32.956  -1.966  17.584
  416   HD22  LEU  58          HD22      LEU  58  32.663  -2.043  15.846
  417   HD23  LEU  58          HD23      LEU  58  31.889  -0.789  16.818
  418    H    ASP  59           HN       ASP  59  34.121   3.206  18.979
  419    HA   ASP  59           HA       ASP  59  32.045   4.165  17.355
  420    HB2  ASP  59           HB2      ASP  59  32.312   4.483  19.851
  421    HB3  ASP  59           HB1      ASP  59  33.474   5.758  19.486
  422    H    MET  60           HN       MET  60  35.420   5.109  17.607
  423    HA   MET  60           HA       MET  60  35.212   7.544  16.154
  424    HB2  MET  60           HB2      MET  60  37.535   5.696  16.702
  425    HB3  MET  60           HB1      MET  60  37.702   7.233  15.853
  426    HG2  MET  60           HG2      MET  60  36.589   8.345  17.832
  427    HG3  MET  60           HG1      MET  60  36.705   6.806  18.681
  428    HE1  MET  60           HE1      MET  60  39.156   6.008  19.930
  429    HE2  MET  60           HE2      MET  60  40.423   6.021  18.706
  430    HE3  MET  60           HE3      MET  60  38.822   5.412  18.298
  431    H    TYR  61           HN       TYR  61  34.913   4.315  15.133
  432    HA   TYR  61           HA       TYR  61  36.104   4.630  12.545
  433    HB2  TYR  61           HB2      TYR  61  34.296   2.541  13.758
  434    HB3  TYR  61           HB1      TYR  61  34.872   2.429  12.096
  435    HD1  TYR  61           HD1      TYR  61  37.426   4.086  13.860
  436    HD2  TYR  61           HD2      TYR  61  35.632   0.193  13.480
  437    HE1  TYR  61           HE1      TYR  61  39.488   3.051  14.727
  438    HE2  TYR  61           HE2      TYR  61  37.707  -0.836  14.352
  439    HH   TYR  61           HH       TYR  61  39.691   0.042  15.912
  440    H    CYS  62           HN       CYS  62  33.122   5.506  13.956
  441    HA   CYS  62           HA       CYS  62  31.385   5.340  11.746
  442    HB2  CYS  62           HB2      CYS  62  31.396   7.327  14.033
  443    HB3  CYS  62           HB1      CYS  62  30.030   6.974  12.974
  444    H    ALA  63           HN       ALA  63  30.638   7.079  10.381
  445    HA   ALA  63           HA       ALA  63  32.755   8.548   9.219
  446    HB1  ALA  63           HB1      ALA  63  31.278   8.961   7.519
  447    HB2  ALA  63           HB2      ALA  63  29.941   9.299   8.618
  448    HB3  ALA  63           HB3      ALA  63  30.410   7.632   8.284
  449    HA   PRO  64           HA       PRO  64  32.837  12.473  11.183
  450    HB2  PRO  64           HB2      PRO  64  31.875  13.722   8.644
  451    HB3  PRO  64           HB1      PRO  64  33.321  14.091   9.605
  452    HG2  PRO  64           HG2      PRO  64  33.486  12.749   7.318
  453    HG3  PRO  64           HG1      PRO  64  34.531  12.364   8.696
  454    HD2  PRO  64           HD2      PRO  64  32.171  10.847   7.648
  455    HD3  PRO  64           HD1      PRO  64  33.642  10.255   8.451
  456    H    LEU  65           HN       LEU  65  31.471  13.791  12.343
  457    HA   LEU  65           HA       LEU  65  28.676  13.205  12.333
  458    HB2  LEU  65           HB2      LEU  65  30.213  15.396  13.751
  459    HB3  LEU  65           HB1      LEU  65  28.555  14.912  14.109
  460    HG   LEU  65           HG       LEU  65  30.957  13.066  14.269
  461   HD11  LEU  65          HD11      LEU  65  31.142  14.698  16.031
  462   HD12  LEU  65          HD12      LEU  65  30.496  13.223  16.750
  463   HD13  LEU  65          HD13      LEU  65  29.421  14.576  16.398
  464   HD21  LEU  65          HD21      LEU  65  29.026  11.737  13.874
  465   HD22  LEU  65          HD22      LEU  65  28.009  12.763  14.886
  466   HD23  LEU  65          HD23      LEU  65  29.218  11.714  15.627
  467    H    LYS  66           HN       LYS  66  26.943  14.484  11.738
  468    HA   LYS  66           HA       LYS  66  25.807  15.884  10.307
  469    HB2  LYS  66           HB2      LYS  66  27.965  17.801  11.218
  470    HB3  LYS  66           HB1      LYS  66  26.427  18.255  10.489
  471    HG2  LYS  66           HG2      LYS  66  26.660  16.645  13.041
  472    HG3  LYS  66           HG1      LYS  66  26.443  18.394  13.002
  473    HD2  LYS  66           HD2      LYS  66  24.347  18.071  11.691
  474    HD3  LYS  66           HD1      LYS  66  24.548  16.326  11.843
  475    HE2  LYS  66           HE2      LYS  66  24.464  16.516  14.293
  476    HE3  LYS  66           HE1      LYS  66  24.273  18.264  14.155
  477    HZ1  LYS  66           HZ1      LYS  66  22.416  16.285  12.956
  478    HZ2  LYS  66           HZ2      LYS  66  22.212  17.970  13.021
  479    HZ3  LYS  66           HZ3      LYS  66  22.157  17.049  14.447
  480    HA   PRO  67           HA       PRO  67  29.024  15.053   6.980
  481    HB2  PRO  67           HB2      PRO  67  26.595  13.849   5.744
  482    HB3  PRO  67           HB1      PRO  67  28.244  13.203   5.850
  483    HG2  PRO  67           HG2      PRO  67  26.304  12.212   7.351
  484    HG3  PRO  67           HG1      PRO  67  27.942  12.422   8.000
  485    HD2  PRO  67           HD2      PRO  67  25.502  14.121   8.455
  486    HD3  PRO  67           HD1      PRO  67  26.762  13.622   9.606
  487    H    ALA  68           HN       ALA  68  29.320  16.401   5.248
  488    HA   ALA  68           HA       ALA  68  28.982  18.218   3.880
  489    HB1  ALA  68           HB1      ALA  68  27.654  16.423   2.730
  490    HB2  ALA  68           HB2      ALA  68  27.086  18.060   2.406
  491    HB3  ALA  68           HB3      ALA  68  26.218  17.036   3.550
  492    H    LYS  69           HN       LYS  69  28.167  18.406   6.764
  493    HA   LYS  69           HA       LYS  69  26.500  20.822   6.483
  494    HB2  LYS  69           HB2      LYS  69  26.171  18.582   8.470
  495    HB3  LYS  69           HB1      LYS  69  25.478  20.184   8.724
  496    HG2  LYS  69           HG2      LYS  69  24.257  19.991   6.587
  497    HG3  LYS  69           HG1      LYS  69  24.951  18.390   6.335
  498    HD2  LYS  69           HD2      LYS  69  23.879  17.585   8.400
  499    HD3  LYS  69           HD1      LYS  69  23.196  19.189   8.675
  500    HE2  LYS  69           HE2      LYS  69  21.955  19.032   6.551
  501    HE3  LYS  69           HE1      LYS  69  22.642  17.432   6.265
  502    HZ1  LYS  69           HZ1      LYS  69  21.609  16.682   8.332
  503    HZ2  LYS  69           HZ2      LYS  69  20.452  17.247   7.225
  504    HZ3  LYS  69           HZ3      LYS  69  20.908  18.212   8.546
  505    H    SER  70           HN       SER  70  29.002  19.067   8.187
  506    HA   SER  70           HA       SER  70  29.530  20.924  10.241
  507    HB2  SER  70           HB2      SER  70  31.358  18.968   8.836
  508    HB3  SER  70           HB1      SER  70  31.799  19.869  10.284
  509    HG   SER  70           HG       SER  70  29.928  18.914  11.280
  510    H    ALA  71           HN       ALA  71  30.711  20.675   6.916
  511    HA   ALA  71           HA       ALA  71  32.084  23.269   7.262
  512    HB1  ALA  71           HB1      ALA  71  32.510  21.172   5.120
  513    HB2  ALA  71           HB2      ALA  71  33.523  21.377   6.549
  514    HB3  ALA  71           HB3      ALA  71  33.443  22.653   5.333
  Start of MODEL   19
    1    H1   GLY   1           HT1      GLY   1  32.465 -21.502  12.153
    2    H2   GLY   1           HT2      GLY   1  32.036 -21.911  13.744
    3    H3   GLY   1           HT3      GLY   1  33.672 -21.730  13.322
    4    HA2  GLY   1           HA2      GLY   1  32.488 -19.348  12.612
    5    HA3  GLY   1           HA1      GLY   1  31.816 -19.766  14.189
    6    H    GLY   2           HN       GLY   2  33.427 -17.579  14.035
    7    HA2  GLY   2           HA2      GLY   2  36.183 -18.213  14.596
    8    HA3  GLY   2           HA1      GLY   2  35.426 -16.630  14.733
    9    HA   PRO   3           HA       PRO   3  36.037 -18.603  18.975
   10    HB2  PRO   3           HB2      PRO   3  38.074 -17.030  19.876
   11    HB3  PRO   3           HB1      PRO   3  38.344 -18.532  18.972
   12    HG2  PRO   3           HG2      PRO   3  38.460 -15.713  18.033
   13    HG3  PRO   3           HG1      PRO   3  39.487 -17.091  17.607
   14    HD2  PRO   3           HD2      PRO   3  37.442 -16.159  16.010
   15    HD3  PRO   3           HD1      PRO   3  38.040 -17.832  15.975
   16    H    GLU   4           HN       GLU   4  33.903 -17.225  18.639
   17    HA   GLU   4           HA       GLU   4  32.457 -15.661  19.496
   18    HB2  GLU   4           HB2      GLU   4  34.591 -15.544  21.641
   19    HB3  GLU   4           HB1      GLU   4  32.988 -14.823  21.778
   20    HG2  GLU   4           HG2      GLU   4  31.957 -17.038  21.458
   21    HG3  GLU   4           HG1      GLU   4  33.557 -17.764  21.313
   22    H    THR   5           HN       THR   5  34.003 -14.693  17.456
   23    HA   THR   5           HA       THR   5  34.556 -11.923  18.335
   24    HB   THR   5           HB       THR   5  36.300 -11.799  16.606
   25    HG1  THR   5           HG1      THR   5  36.551 -13.360  15.221
   26   HG21  THR   5          HG21      THR   5  37.958 -13.042  17.776
   27   HG22  THR   5          HG22      THR   5  36.789 -14.255  18.298
   28   HG23  THR   5          HG23      THR   5  36.744 -12.632  18.987
   29    H    LEU   6           HN       LEU   6  34.228 -10.291  16.658
   30    HA   LEU   6           HA       LEU   6  31.973 -11.033  14.909
   31    HB2  LEU   6           HB2      LEU   6  32.915  -8.292  15.791
   32    HB3  LEU   6           HB1      LEU   6  31.439  -8.656  14.898
   33    HG   LEU   6           HG       LEU   6  32.084  -9.726  17.662
   34   HD11  LEU   6          HD11      LEU   6  30.065  -7.608  16.878
   35   HD12  LEU   6          HD12      LEU   6  31.664  -7.233  17.522
   36   HD13  LEU   6          HD13      LEU   6  30.501  -8.119  18.508
   37   HD21  LEU   6          HD21      LEU   6  30.609 -11.230  16.500
   38   HD22  LEU   6          HD22      LEU   6  29.660  -9.892  15.852
   39   HD23  LEU   6          HD23      LEU   6  29.597 -10.264  17.574
   40    H    CYS   7           HN       CYS   7  32.620 -11.547  12.907
   41    HA   CYS   7           HA       CYS   7  34.499  -9.724  11.551
   42    HB2  CYS   7           HB2      CYS   7  34.504 -12.745  11.356
   43    HB3  CYS   7           HB1      CYS   7  35.519 -11.652  10.417
   44    H    GLY   8           HN       GLY   8  34.275  -9.694   9.221
   45    HA2  GLY   8           HA2      GLY   8  33.032  -9.541   7.290
   46    HA3  GLY   8           HA1      GLY   8  32.300 -11.067   7.777
   47    H    ALA   9           HN       ALA   9  30.165 -10.907   7.739
   48    HA   ALA   9           HA       ALA   9  28.698  -8.511   7.803
   49    HB1  ALA   9           HB1      ALA   9  28.048 -11.409   7.994
   50    HB2  ALA   9           HB2      ALA   9  27.429 -10.185   6.885
   51    HB3  ALA   9           HB3      ALA   9  26.815 -10.270   8.536
   52    H    GLU  10           HN       GLU  10  29.628 -10.767  10.365
   53    HA   GLU  10           HA       GLU  10  27.980  -9.750  12.407
   54    HB2  GLU  10           HB2      GLU  10  30.675 -11.113  12.480
   55    HB3  GLU  10           HB1      GLU  10  29.758 -10.719  13.933
   56    HG2  GLU  10           HG2      GLU  10  27.901 -12.096  13.204
   57    HG3  GLU  10           HG1      GLU  10  28.670 -12.379  11.643
   58    H    LEU  11           HN       LEU  11  31.236  -8.830  11.349
   59    HA   LEU  11           HA       LEU  11  31.687  -6.911  13.388
   60    HB2  LEU  11           HB2      LEU  11  33.516  -7.838  12.048
   61    HB3  LEU  11           HB1      LEU  11  32.858  -7.080  10.600
   62    HG   LEU  11           HG       LEU  11  33.126  -4.851  11.686
   63   HD11  LEU  11          HD11      LEU  11  33.003  -5.395  14.012
   64   HD12  LEU  11          HD12      LEU  11  34.649  -4.829  13.732
   65   HD13  LEU  11          HD13      LEU  11  34.322  -6.556  13.879
   66   HD21  LEU  11          HD21      LEU  11  35.719  -6.406  11.759
   67   HD22  LEU  11          HD22      LEU  11  35.487  -4.708  11.342
   68   HD23  LEU  11          HD23      LEU  11  34.910  -5.969  10.254
   69    H    VAL  12           HN       VAL  12  30.343  -6.692  10.120
   70    HA   VAL  12           HA       VAL  12  30.140  -3.909   9.968
   71    HB   VAL  12           HB       VAL  12  28.586  -6.145   8.676
   72   HG11  VAL  12          HG11      VAL  12  27.721  -4.267   7.149
   73   HG12  VAL  12          HG12      VAL  12  28.245  -3.138   8.398
   74   HG13  VAL  12          HG13      VAL  12  26.993  -4.328   8.754
   75   HG21  VAL  12          HG21      VAL  12  30.497  -4.059   7.586
   76   HG22  VAL  12          HG22      VAL  12  29.830  -5.437   6.711
   77   HG23  VAL  12          HG23      VAL  12  30.960  -5.700   8.039
   78    H    ASP  13           HN       ASP  13  27.870  -6.335  11.203
   79    HA   ASP  13           HA       ASP  13  25.713  -4.615  11.751
   80    HB2  ASP  13           HB2      ASP  13  25.606  -7.110  11.765
   81    HB3  ASP  13           HB1      ASP  13  26.509  -7.105  13.278
   82    H    ALA  14           HN       ALA  14  28.480  -5.616  13.755
   83    HA   ALA  14           HA       ALA  14  27.694  -4.294  16.117
   84    HB1  ALA  14           HB1      ALA  14  29.684  -5.975  15.565
   85    HB2  ALA  14           HB2      ALA  14  29.759  -4.869  16.937
   86    HB3  ALA  14           HB3      ALA  14  30.592  -4.469  15.434
   87    H    LEU  15           HN       LEU  15  29.633  -3.205  13.350
   88    HA   LEU  15           HA       LEU  15  30.380  -0.697  14.397
   89    HB2  LEU  15           HB2      LEU  15  30.018  -1.711  11.574
   90    HB3  LEU  15           HB1      LEU  15  30.583  -0.078  11.925
   91    HG   LEU  15           HG       LEU  15  31.910  -2.481  13.176
   92   HD11  LEU  15          HD11      LEU  15  31.852  -2.619  10.621
   93   HD12  LEU  15          HD12      LEU  15  33.460  -2.588  11.349
   94   HD13  LEU  15          HD13      LEU  15  32.797  -1.128  10.613
   95   HD21  LEU  15          HD21      LEU  15  32.946   0.274  12.435
   96   HD22  LEU  15          HD22      LEU  15  33.761  -0.929  13.431
   97   HD23  LEU  15          HD23      LEU  15  32.310  -0.130  14.027
   98    H    GLN  16           HN       GLN  16  27.559  -1.710  12.492
   99    HA   GLN  16           HA       GLN  16  26.426   0.876  12.215
  100    HB2  GLN  16           HB2      GLN  16  25.219  -1.891  12.109
  101    HB3  GLN  16           HB1      GLN  16  24.297  -0.422  11.783
  102    HG2  GLN  16           HG2      GLN  16  25.741   0.157   9.937
  103    HG3  GLN  16           HG1      GLN  16  26.857  -1.149  10.334
  104   HE21  GLN  16          HE21      GLN  16  25.305  -0.751   7.795
  105   HE22  GLN  16          HE22      GLN  16  24.371  -2.156   7.614
  106    H    PHE  17           HN       PHE  17  26.056  -1.682  14.627
  107    HA   PHE  17           HA       PHE  17  23.956  -0.554  16.112
  108    HB2  PHE  17           HB2      PHE  17  24.537  -2.804  16.572
  109    HB3  PHE  17           HB1      PHE  17  26.226  -2.390  16.871
  110    HD1  PHE  17           HD1      PHE  17  22.767  -2.133  18.211
  111    HD2  PHE  17           HD2      PHE  17  26.957  -1.499  18.976
  112    HE1  PHE  17           HE1      PHE  17  22.274  -1.767  20.615
  113    HE2  PHE  17           HE2      PHE  17  26.455  -1.143  21.380
  114    HZ   PHE  17           HZ       PHE  17  24.118  -1.275  22.199
  115    H    VAL  18           HN       VAL  18  27.479  -0.272  16.552
  116    HA   VAL  18           HA       VAL  18  27.377   1.427  18.799
  117    HB   VAL  18           HB       VAL  18  29.498   1.110  16.666
  118   HG11  VAL  18          HG11      VAL  18  29.551   2.484  19.361
  119   HG12  VAL  18          HG12      VAL  18  29.804   3.238  17.786
  120   HG13  VAL  18          HG13      VAL  18  30.992   2.100  18.419
  121   HG21  VAL  18          HG21      VAL  18  30.582  -0.296  18.391
  122   HG22  VAL  18          HG22      VAL  18  29.002  -0.937  17.946
  123   HG23  VAL  18          HG23      VAL  18  29.198  -0.050  19.456
  124    H    CYS  19           HN       CYS  19  27.587   2.124  15.325
  125    HA   CYS  19           HA       CYS  19  27.744   4.954  15.621
  126    HB2  CYS  19           HB2      CYS  19  26.817   3.289  13.263
  127    HB3  CYS  19           HB1      CYS  19  27.216   5.004  13.211
  128    H    GLY  20           HN       GLY  20  25.158   2.706  15.884
  129    HA2  GLY  20           HA2      GLY  20  22.991   3.120  16.603
  130    HA3  GLY  20           HA1      GLY  20  23.296   4.847  16.436
  131    H    ASP  21           HN       ASP  21  23.304   2.052  14.214
  132    HA   ASP  21           HA       ASP  21  22.298   1.720  12.177
  133    HB2  ASP  21           HB2      ASP  21  20.319   3.761  13.221
  134    HB3  ASP  21           HB1      ASP  21  20.062   2.683  11.855
  135    H    ARG  22           HN       ARG  22  24.447   3.503  12.196
  136    HA   ARG  22           HA       ARG  22  23.667   5.343  10.043
  137    HB2  ARG  22           HB2      ARG  22  25.565   5.917  12.334
  138    HB3  ARG  22           HB1      ARG  22  25.356   6.956  10.928
  139    HG2  ARG  22           HG2      ARG  22  22.943   7.148  11.492
  140    HG3  ARG  22           HG1      ARG  22  23.240   6.198  12.946
  141    HD2  ARG  22           HD2      ARG  22  24.979   7.895  13.607
  142    HD3  ARG  22           HD1      ARG  22  24.445   8.884  12.250
  143    HE   ARG  22           HE       ARG  22  22.225   8.159  13.834
  144   HH11  ARG  22          HH11      ARG  22  25.073  10.165  13.869
  145   HH12  ARG  22          HH12      ARG  22  24.386  11.338  14.938
  146   HH21  ARG  22          HH21      ARG  22  21.340   9.726  15.245
  147   HH22  ARG  22          HH22      ARG  22  22.295  11.095  15.711
  148    H    GLY  23           HN       GLY  23  24.645   4.749   8.271
  149    HA2  GLY  23           HA2      GLY  23  26.679   2.833   8.047
  150    HA3  GLY  23           HA1      GLY  23  26.213   3.963   6.778
  151    H    PHE  24           HN       PHE  24  28.875   3.054   7.398
  152    HA   PHE  24           HA       PHE  24  30.124   5.634   8.112
  153    HB2  PHE  24           HB2      PHE  24  32.066   4.024   8.884
  154    HB3  PHE  24           HB1      PHE  24  30.719   4.376   9.965
  155    HD1  PHE  24           HD1      PHE  24  32.327   1.845   7.859
  156    HD2  PHE  24           HD2      PHE  24  28.920   2.726  10.314
  157    HE1  PHE  24           HE1      PHE  24  31.747  -0.560   7.918
  158    HE2  PHE  24           HE2      PHE  24  28.341   0.322  10.376
  159    HZ   PHE  24           HZ       PHE  24  29.751  -1.324   9.178
  160    H    TYR  25           HN       TYR  25  31.914   6.254   6.939
  161    HA   TYR  25           HA       TYR  25  32.051   5.397   4.258
  162    HB2  TYR  25           HB2      TYR  25  33.985   6.864   4.076
  163    HB3  TYR  25           HB1      TYR  25  32.736   7.649   5.043
  164    HD1  TYR  25           HD1      TYR  25  36.058   6.068   5.090
  165    HD2  TYR  25           HD2      TYR  25  32.976   7.885   7.474
  166    HE1  TYR  25           HE1      TYR  25  37.645   6.276   6.985
  167    HE2  TYR  25           HE2      TYR  25  34.563   8.092   9.365
  168    HH   TYR  25           HH       TYR  25  37.308   8.246   9.450
  169    H    PHE  26           HN       PHE  26  33.870   4.494   7.125
  170    HA   PHE  26           HA       PHE  26  35.372   2.805   7.524
  171    HB2  PHE  26           HB2      PHE  26  33.598   1.411   6.505
  172    HB3  PHE  26           HB1      PHE  26  34.305   1.689   4.918
  173    HD1  PHE  26           HD1      PHE  26  34.951   0.230   8.275
  174    HD2  PHE  26           HD2      PHE  26  36.212   0.480   4.179
  175    HE1  PHE  26           HE1      PHE  26  36.541  -1.634   8.651
  176    HE2  PHE  26           HE2      PHE  26  37.803  -1.383   4.553
  177    HZ   PHE  26           HZ       PHE  26  37.967  -2.439   6.789
  178    H    ASN  27           HN       ASN  27  37.469   2.017   6.901
  179    HA   ASN  27           HA       ASN  27  39.529   2.179   5.901
  180    HB2  ASN  27           HB2      ASN  27  38.094   1.529   3.881
  181    HB3  ASN  27           HB1      ASN  27  38.145   3.236   3.444
  182   HD21  ASN  27          HD21      ASN  27  39.514   2.974   1.587
  183   HD22  ASN  27          HD22      ASN  27  41.131   2.474   1.714
  184    H    LYS  28           HN       LYS  28  40.211   3.835   7.273
  185    HA   LYS  28           HA       LYS  28  39.660   6.579   6.788
  186    HB2  LYS  28           HB2      LYS  28  41.771   5.181   8.431
  187    HB3  LYS  28           HB1      LYS  28  41.643   6.937   8.343
  188    HG2  LYS  28           HG2      LYS  28  39.310   6.807   9.128
  189    HG3  LYS  28           HG1      LYS  28  39.442   5.051   9.229
  190    HD2  LYS  28           HD2      LYS  28  41.264   5.280  10.878
  191    HD3  LYS  28           HD1      LYS  28  41.133   7.037  10.777
  192    HE2  LYS  28           HE2      LYS  28  38.802   6.916  11.571
  193    HE3  LYS  28           HE1      LYS  28  38.925   5.159  11.670
  194    HZ1  LYS  28           HZ1      LYS  28  40.799   5.480  13.232
  195    HZ2  LYS  28           HZ2      LYS  28  39.318   6.071  13.822
  196    HZ3  LYS  28           HZ3      LYS  28  40.488   7.148  13.222
  197    HA   PRO  29           HA       PRO  29  42.424   7.863   3.618
  198    HB2  PRO  29           HB2      PRO  29  43.644   9.769   5.573
  199    HB3  PRO  29           HB1      PRO  29  42.957  10.084   3.968
  200    HG2  PRO  29           HG2      PRO  29  41.631  10.737   6.164
  201    HG3  PRO  29           HG1      PRO  29  40.788  10.086   4.746
  202    HD2  PRO  29           HD2      PRO  29  41.447   8.741   7.333
  203    HD3  PRO  29           HD1      PRO  29  40.033   8.534   6.277
  204    H    THR  30           HN       THR  30  43.848   7.302   6.807
  205    HA   THR  30           HA       THR  30  46.135   5.985   5.515
  206    HB   THR  30           HB       THR  30  46.820   8.323   6.055
  207    HG1  THR  30           HG1      THR  30  48.592   7.220   6.239
  208   HG21  THR  30          HG21      THR  30  46.400   7.469   8.929
  209   HG22  THR  30          HG22      THR  30  45.290   8.517   8.047
  210   HG23  THR  30          HG23      THR  30  46.943   9.046   8.357
  211    H    GLY  31           HN       GLY  31  47.048   4.324   6.728
  212    HA2  GLY  31           HA2      GLY  31  45.866   3.755   9.365
  213    HA3  GLY  31           HA1      GLY  31  45.775   2.530   8.103
  214    H    TYR  32           HN       TYR  32  48.554   4.600   8.204
  215    HA   TYR  32           HA       TYR  32  50.176   2.302   9.095
  216    HB2  TYR  32           HB2      TYR  32  50.914   4.738   7.456
  217    HB3  TYR  32           HB1      TYR  32  52.051   3.490   7.963
  218    HD1  TYR  32           HD1      TYR  32  49.217   4.292   5.762
  219    HD2  TYR  32           HD2      TYR  32  51.938   1.221   7.036
  220    HE1  TYR  32           HE1      TYR  32  48.557   2.900   3.818
  221    HE2  TYR  32           HE2      TYR  32  51.277  -0.171   5.093
  222    HH   TYR  32           HH       TYR  32  49.712   0.990   2.449
  223    H    GLY  33           HN       GLY  33  51.195   2.405  10.991
  224    HA2  GLY  33           HA2      GLY  33  51.030   4.841  12.577
  225    HA3  GLY  33           HA1      GLY  33  51.584   3.265  13.132
  226    H    SER  34           HN       SER  34  53.163   4.998  14.088
  227    HA   SER  34           HA       SER  34  55.425   5.321  12.212
  228    HB2  SER  34           HB2      SER  34  56.154   7.186  13.649
  229    HB3  SER  34           HB1      SER  34  54.541   7.466  12.999
  230    HG   SER  34           HG       SER  34  55.374   7.099  15.584
  231    H    SER  35           HN       SER  35  54.450   3.193  14.384
  232    HA   SER  35           HA       SER  35  57.129   2.476  15.173
  233    HB2  SER  35           HB2      SER  35  56.597   3.990  16.977
  234    HB3  SER  35           HB1      SER  35  55.027   3.227  17.211
  235    HG   SER  35           HG       SER  35  57.601   2.326  17.852
  236    H    SER  36           HN       SER  36  57.323   0.322  15.429
  237    HA   SER  36           HA       SER  36  55.258  -1.388  14.522
  238    HB2  SER  36           HB2      SER  36  56.766  -3.200  15.030
  239    HB3  SER  36           HB1      SER  36  57.719  -1.869  14.380
  240    HG   SER  36           HG       SER  36  58.666  -2.710  16.268
  241    H    ARG  37           HN       ARG  37  54.094  -2.994  15.657
  242    HA   ARG  37           HA       ARG  37  52.731  -3.740  17.344
  243    HB2  ARG  37           HB2      ARG  37  55.061  -2.860  19.069
  244    HB3  ARG  37           HB1      ARG  37  53.741  -3.911  19.585
  245    HG2  ARG  37           HG2      ARG  37  54.351  -5.560  17.876
  246    HG3  ARG  37           HG1      ARG  37  55.638  -4.502  17.297
  247    HD2  ARG  37           HD2      ARG  37  56.611  -6.162  18.772
  248    HD3  ARG  37           HD1      ARG  37  56.672  -4.593  19.566
  249    HE   ARG  37           HE       ARG  37  54.289  -5.990  20.273
  250   HH11  ARG  37          HH11      ARG  37  57.730  -5.878  20.821
  251   HH12  ARG  37          HH12      ARG  37  57.622  -6.552  22.410
  252   HH21  ARG  37          HH21      ARG  37  54.174  -6.870  22.358
  253   HH22  ARG  37          HH22      ARG  37  55.623  -7.111  23.276
  254    H    ARG  38           HN       ARG  38  52.979  -0.708  16.593
  255    HA   ARG  38           HA       ARG  38  51.214   0.188  18.771
  256    HB2  ARG  38           HB2      ARG  38  53.520   1.760  17.600
  257    HB3  ARG  38           HB1      ARG  38  52.300   2.424  18.687
  258    HG2  ARG  38           HG2      ARG  38  52.933   0.661  20.365
  259    HG3  ARG  38           HG1      ARG  38  54.256   0.190  19.295
  260    HD2  ARG  38           HD2      ARG  38  55.143   1.728  20.929
  261    HD3  ARG  38           HD1      ARG  38  55.074   2.562  19.380
  262    HE   ARG  38           HE       ARG  38  52.680   3.015  20.841
  263   HH11  ARG  38          HH11      ARG  38  56.063   3.853  20.733
  264   HH12  ARG  38          HH12      ARG  38  55.829   5.398  21.472
  265   HH21  ARG  38          HH21      ARG  38  52.401   5.046  21.809
  266   HH22  ARG  38          HH22      ARG  38  53.770   6.070  22.078
  267    H    ALA  39           HN       ALA  39  49.690   1.774  18.149
  268    HA   ALA  39           HA       ALA  39  48.093   2.596  16.715
  269    HB1  ALA  39           HB1      ALA  39  50.579   3.111  15.068
  270    HB2  ALA  39           HB2      ALA  39  49.843   4.211  16.233
  271    HB3  ALA  39           HB3      ALA  39  48.994   3.811  14.740
  272    HA   PRO  40           HA       PRO  40  48.259  -1.266  14.078
  273    HB2  PRO  40           HB2      PRO  40  46.193  -2.588  15.274
  274    HB3  PRO  40           HB1      PRO  40  47.872  -2.712  15.834
  275    HG2  PRO  40           HG2      PRO  40  45.620  -1.118  16.937
  276    HG3  PRO  40           HG1      PRO  40  46.917  -1.978  17.780
  277    HD2  PRO  40           HD2      PRO  40  46.901   0.751  17.363
  278    HD3  PRO  40           HD1      PRO  40  48.376  -0.207  17.615
  279    H    GLN  41           HN       GLN  41  47.434   0.776  12.826
  280    HA   GLN  41           HA       GLN  41  44.519   0.613  12.408
  281    HB2  GLN  41           HB2      GLN  41  46.531   2.765  11.733
  282    HB3  GLN  41           HB1      GLN  41  44.853   2.792  11.191
  283    HG2  GLN  41           HG2      GLN  41  44.047   2.811  13.469
  284    HG3  GLN  41           HG1      GLN  41  45.674   2.555  14.096
  285   HE21  GLN  41          HE21      GLN  41  43.830   4.881  14.589
  286   HE22  GLN  41          HE22      GLN  41  44.693   6.251  14.081
  287    H    THR  42           HN       THR  42  46.838  -1.122  11.300
  288    HA   THR  42           HA       THR  42  47.122  -0.645   8.552
  289    HB   THR  42           HB       THR  42  47.146  -3.272  10.052
  290    HG1  THR  42           HG1      THR  42  49.128  -1.368   9.374
  291   HG21  THR  42          HG21      THR  42  46.904  -3.726   7.708
  292   HG22  THR  42          HG22      THR  42  48.608  -3.957   8.100
  293   HG23  THR  42          HG23      THR  42  48.083  -2.484   7.286
  294    H    GLY  43           HN       GLY  43  44.779  -2.654  10.301
  295    HA2  GLY  43           HA2      GLY  43  42.945  -2.397   8.014
  296    HA3  GLY  43           HA1      GLY  43  43.327  -4.010   8.606
  297    H    ILE  44           HN       ILE  44  41.104  -1.557   8.824
  298    HA   ILE  44           HA       ILE  44  40.463  -1.468  11.560
  299    HB   ILE  44           HB       ILE  44  38.806  -1.063   9.070
  300   HG12  ILE  44          HG12      ILE  44  39.806   0.933  11.118
  301   HG13  ILE  44          HG11      ILE  44  40.701   0.526   9.652
  302   HG21  ILE  44          HG21      ILE  44  37.246   0.115  10.762
  303   HG22  ILE  44          HG22      ILE  44  38.063  -0.869  11.975
  304   HG23  ILE  44          HG23      ILE  44  37.187  -1.643  10.661
  305   HD11  ILE  44          HD11      ILE  44  38.671   1.157   8.313
  306   HD12  ILE  44          HD12      ILE  44  39.373   2.508   9.203
  307   HD13  ILE  44          HD13      ILE  44  37.918   1.717   9.806
  308    H    VAL  45           HN       VAL  45  39.223  -3.515   8.930
  309    HA   VAL  45           HA       VAL  45  37.434  -4.994  10.556
  310    HB   VAL  45           HB       VAL  45  38.688  -5.572   7.875
  311   HG11  VAL  45          HG11      VAL  45  36.900  -7.375   7.761
  312   HG12  VAL  45          HG12      VAL  45  36.690  -7.173   9.499
  313   HG13  VAL  45          HG13      VAL  45  38.237  -7.730   8.856
  314   HG21  VAL  45          HG21      VAL  45  36.974  -3.718   8.171
  315   HG22  VAL  45          HG22      VAL  45  35.823  -4.963   8.656
  316   HG23  VAL  45          HG23      VAL  45  36.509  -4.982   7.031
  317    H    ASP  46           HN       ASP  46  40.742  -5.602   9.467
  318    HA   ASP  46           HA       ASP  46  40.991  -8.181  10.581
  319    HB2  ASP  46           HB2      ASP  46  43.029  -6.068   9.899
  320    HB3  ASP  46           HB1      ASP  46  43.465  -7.675  10.478
  321    H    GLU  47           HN       GLU  47  41.633  -4.953  11.921
  322    HA   GLU  47           HA       GLU  47  42.941  -5.783  14.267
  323    HB2  GLU  47           HB2      GLU  47  42.896  -3.453  13.486
  324    HB3  GLU  47           HB1      GLU  47  41.166  -3.377  13.818
  325    HG2  GLU  47           HG2      GLU  47  42.430  -2.384  15.671
  326    HG3  GLU  47           HG1      GLU  47  41.613  -3.849  16.210
  327    H    CYS  48           HN       CYS  48  39.492  -4.979  13.755
  328    HA   CYS  48           HA       CYS  48  38.704  -5.760  16.396
  329    HB2  CYS  48           HB2      CYS  48  37.091  -5.318  13.881
  330    HB3  CYS  48           HB1      CYS  48  36.409  -5.645  15.466
  331    H    CYS  49           HN       CYS  49  38.641  -7.355  13.232
  332    HA   CYS  49           HA       CYS  49  37.169  -9.625  13.972
  333    HB2  CYS  49           HB2      CYS  49  37.631  -9.012  11.626
  334    HB3  CYS  49           HB1      CYS  49  39.333  -9.392  11.865
  335    H    PHE  50           HN       PHE  50  40.697  -9.112  13.862
  336    HA   PHE  50           HA       PHE  50  41.164 -11.709  15.053
  337    HB2  PHE  50           HB2      PHE  50  42.938  -9.464  14.115
  338    HB3  PHE  50           HB1      PHE  50  43.597 -10.839  15.009
  339    HD1  PHE  50           HD1      PHE  50  41.738  -9.805  11.972
  340    HD2  PHE  50           HD2      PHE  50  43.842 -12.984  13.952
  341    HE1  PHE  50           HE1      PHE  50  41.724 -11.113   9.867
  342    HE2  PHE  50           HE2      PHE  50  43.832 -14.298  11.848
  343    HZ   PHE  50           HZ       PHE  50  42.774 -13.366   9.805
  344    H    ARG  51           HN       ARG  51  42.339  -8.454  15.928
  345    HA   ARG  51           HA       ARG  51  42.567  -9.192  18.713
  346    HB2  ARG  51           HB2      ARG  51  43.023  -6.580  17.263
  347    HB3  ARG  51           HB1      ARG  51  43.313  -6.821  18.988
  348    HG2  ARG  51           HG2      ARG  51  44.935  -8.582  18.509
  349    HG3  ARG  51           HG1      ARG  51  44.599  -8.455  16.783
  350    HD2  ARG  51           HD2      ARG  51  46.628  -7.215  17.286
  351    HD3  ARG  51           HD1      ARG  51  45.353  -6.084  16.846
  352    HE   ARG  51           HE       ARG  51  45.393  -6.458  19.662
  353   HH11  ARG  51          HH11      ARG  51  47.153  -4.975  17.044
  354   HH12  ARG  51          HH12      ARG  51  47.813  -3.721  18.035
  355   HH21  ARG  51          HH21      ARG  51  46.271  -4.805  20.940
  356   HH22  ARG  51          HH22      ARG  51  47.318  -3.624  20.228
  357    H    SER  52           HN       SER  52  41.579  -7.857  20.440
  358    HA   SER  52           HA       SER  52  38.755  -7.391  19.837
  359    HB2  SER  52           HB2      SER  52  39.254  -8.740  21.799
  360    HB3  SER  52           HB1      SER  52  40.285  -7.468  22.449
  361    HG   SER  52           HG       SER  52  38.495  -6.829  23.354
  362    H    CYS  53           HN       CYS  53  38.831  -5.424  18.707
  363    HA   CYS  53           HA       CYS  53  40.200  -3.124  19.726
  364    HB2  CYS  53           HB2      CYS  53  39.008  -1.918  17.949
  365    HB3  CYS  53           HB1      CYS  53  39.713  -3.402  17.329
  366    H    ASP  54           HN       ASP  54  39.406  -1.385  20.858
  367    HA   ASP  54           HA       ASP  54  37.291  -1.863  22.684
  368    HB2  ASP  54           HB2      ASP  54  38.817   0.633  21.944
  369    HB3  ASP  54           HB1      ASP  54  37.588   0.602  23.206
  370    H    LEU  55           HN       LEU  55  35.193  -1.214  22.723
  371    HA   LEU  55           HA       LEU  55  33.870  -0.691  20.272
  372    HB2  LEU  55           HB2      LEU  55  32.954  -0.493  23.146
  373    HB3  LEU  55           HB1      LEU  55  31.880  -0.260  21.765
  374    HG   LEU  55           HG       LEU  55  33.564  -2.749  22.162
  375   HD11  LEU  55          HD11      LEU  55  32.031  -2.727  23.998
  376   HD12  LEU  55          HD12      LEU  55  31.302  -3.771  22.778
  377   HD13  LEU  55          HD13      LEU  55  30.719  -2.119  22.987
  378   HD21  LEU  55          HD21      LEU  55  31.761  -3.631  20.554
  379   HD22  LEU  55          HD22      LEU  55  32.936  -2.511  19.869
  380   HD23  LEU  55          HD23      LEU  55  31.320  -1.945  20.293
  381    H    ARG  56           HN       ARG  56  34.844   1.379  22.970
  382    HA   ARG  56           HA       ARG  56  33.530   3.724  22.183
  383    HB2  ARG  56           HB2      ARG  56  34.622   3.447  24.375
  384    HB3  ARG  56           HB1      ARG  56  36.200   3.448  23.586
  385    HG2  ARG  56           HG2      ARG  56  35.836   5.717  22.769
  386    HG3  ARG  56           HG1      ARG  56  34.199   5.719  23.427
  387    HD2  ARG  56           HD2      ARG  56  35.069   5.500  25.694
  388    HD3  ARG  56           HD1      ARG  56  36.714   5.382  25.078
  389    HE   ARG  56           HE       ARG  56  35.718   7.777  24.107
  390   HH11  ARG  56          HH11      ARG  56  36.237   6.286  27.215
  391   HH12  ARG  56          HH12      ARG  56  36.512   7.788  28.025
  392   HH21  ARG  56          HH21      ARG  56  36.086   9.732  25.191
  393   HH22  ARG  56          HH22      ARG  56  36.428   9.726  26.890
  394    H    ARG  57           HN       ARG  57  36.840   2.585  21.395
  395    HA   ARG  57           HA       ARG  57  37.530   4.772  19.771
  396    HB2  ARG  57           HB2      ARG  57  39.099   3.071  20.756
  397    HB3  ARG  57           HB1      ARG  57  38.531   1.933  19.531
  398    HG2  ARG  57           HG2      ARG  57  39.297   3.345  17.754
  399    HG3  ARG  57           HG1      ARG  57  39.638   4.661  18.876
  400    HD2  ARG  57           HD2      ARG  57  41.738   3.604  18.394
  401    HD3  ARG  57           HD1      ARG  57  41.275   3.142  20.029
  402    HE   ARG  57           HE       ARG  57  40.314   1.196  18.224
  403   HH11  ARG  57          HH11      ARG  57  43.297   2.442  19.539
  404   HH12  ARG  57          HH12      ARG  57  44.134   0.936  19.388
  405   HH21  ARG  57          HH21      ARG  57  41.436  -0.762  18.039
  406   HH22  ARG  57          HH22      ARG  57  43.088  -0.867  18.545
  407    H    LEU  58           HN       LEU  58  35.920   1.702  19.121
  408    HA   LEU  58           HA       LEU  58  35.969   1.759  16.324
  409    HB2  LEU  58           HB2      LEU  58  35.116  -0.072  18.014
  410    HB3  LEU  58           HB1      LEU  58  33.561   0.726  17.775
  411    HG   LEU  58           HG       LEU  58  34.041   0.524  15.251
  412   HD11  LEU  58          HD11      LEU  58  35.561  -1.363  14.683
  413   HD12  LEU  58          HD12      LEU  58  36.040  -1.453  16.379
  414   HD13  LEU  58          HD13      LEU  58  36.422  -0.022  15.431
  415   HD21  LEU  58          HD21      LEU  58  33.380  -1.942  15.281
  416   HD22  LEU  58          HD22      LEU  58  32.343  -0.863  16.218
  417   HD23  LEU  58          HD23      LEU  58  33.541  -1.866  17.037
  418    H    ASP  59           HN       ASP  59  33.935   3.440  18.624
  419    HA   ASP  59           HA       ASP  59  31.833   4.224  16.947
  420    HB2  ASP  59           HB2      ASP  59  31.943   4.563  19.426
  421    HB3  ASP  59           HB1      ASP  59  33.074   5.886  19.146
  422    H    MET  60           HN       MET  60  35.102   5.451  17.258
  423    HA   MET  60           HA       MET  60  34.767   7.906  15.904
  424    HB2  MET  60           HB2      MET  60  37.168   6.092  16.212
  425    HB3  MET  60           HB1      MET  60  37.244   7.686  15.463
  426    HG2  MET  60           HG2      MET  60  36.449   8.740  17.505
  427    HG3  MET  60           HG1      MET  60  36.199   7.166  18.260
  428    HE1  MET  60           HE1      MET  60  39.346   8.451  15.992
  429    HE2  MET  60           HE2      MET  60  40.067   9.369  17.314
  430    HE3  MET  60           HE3      MET  60  38.416   9.718  16.806
  431    H    TYR  61           HN       TYR  61  34.767   4.654  14.765
  432    HA   TYR  61           HA       TYR  61  35.615   5.232  12.090
  433    HB2  TYR  61           HB2      TYR  61  34.248   2.837  13.340
  434    HB3  TYR  61           HB1      TYR  61  34.760   2.884  11.653
  435    HD1  TYR  61           HD1      TYR  61  37.113   4.885  13.237
  436    HD2  TYR  61           HD2      TYR  61  35.911   0.757  13.039
  437    HE1  TYR  61           HE1      TYR  61  39.351   4.201  13.999
  438    HE2  TYR  61           HE2      TYR  61  38.167   0.080  13.806
  439    HH   TYR  61           HH       TYR  61  40.072   1.002  14.977
  440    H    CYS  62           HN       CYS  62  32.760   5.759  13.818
  441    HA   CYS  62           HA       CYS  62  30.815   5.303  11.819
  442    HB2  CYS  62           HB2      CYS  62  30.797   7.245  14.141
  443    HB3  CYS  62           HB1      CYS  62  29.387   6.746  13.203
  444    H    ALA  63           HN       ALA  63  29.605   6.991  10.682
  445    HA   ALA  63           HA       ALA  63  31.371   9.210   9.846
  446    HB1  ALA  63           HB1      ALA  63  31.042   7.570   8.077
  447    HB2  ALA  63           HB2      ALA  63  30.269   9.101   7.670
  448    HB3  ALA  63           HB3      ALA  63  29.293   7.741   8.227
  449    HA   PRO  64           HA       PRO  64  27.799  11.252  11.958
  450    HB2  PRO  64           HB2      PRO  64  29.695  13.533  11.623
  451    HB3  PRO  64           HB1      PRO  64  28.803  13.010  13.066
  452    HG2  PRO  64           HG2      PRO  64  31.406  12.568  12.845
  453    HG3  PRO  64           HG1      PRO  64  30.331  11.360  13.577
  454    HD2  PRO  64           HD2      PRO  64  31.567  11.367  10.839
  455    HD3  PRO  64           HD1      PRO  64  31.282  10.006  11.945
  456    H    LEU  65           HN       LEU  65  26.150  12.397  11.030
  457    HA   LEU  65           HA       LEU  65  26.295  12.965   8.206
  458    HB2  LEU  65           HB2      LEU  65  24.083  13.470  10.213
  459    HB3  LEU  65           HB1      LEU  65  23.924  13.587   8.460
  460    HG   LEU  65           HG       LEU  65  24.754  11.075   9.945
  461   HD11  LEU  65          HD11      LEU  65  22.099  11.976   8.804
  462   HD12  LEU  65          HD12      LEU  65  22.449  11.488  10.464
  463   HD13  LEU  65          HD13      LEU  65  22.463  10.288   9.168
  464   HD21  LEU  65          HD21      LEU  65  24.191  11.735   7.045
  465   HD22  LEU  65          HD22      LEU  65  24.139  10.080   7.652
  466   HD23  LEU  65          HD23      LEU  65  25.641  11.001   7.731
  467    H    LYS  66           HN       LYS  66  26.089  14.979   7.197
  468    HA   LYS  66           HA       LYS  66  26.522  17.327   8.945
  469    HB2  LYS  66           HB2      LYS  66  27.742  16.781   6.227
  470    HB3  LYS  66           HB1      LYS  66  28.001  18.221   7.210
  471    HG2  LYS  66           HG2      LYS  66  29.130  16.980   8.912
  472    HG3  LYS  66           HG1      LYS  66  28.624  15.438   8.222
  473    HD2  LYS  66           HD2      LYS  66  29.987  15.786   6.269
  474    HD3  LYS  66           HD1      LYS  66  30.399  17.422   6.789
  475    HE2  LYS  66           HE2      LYS  66  32.239  15.875   7.324
  476    HE3  LYS  66           HE1      LYS  66  31.504  16.482   8.807
  477    HZ1  LYS  66           HZ1      LYS  66  30.472  14.485   9.223
  478    HZ2  LYS  66           HZ2      LYS  66  31.935  13.963   8.536
  479    HZ3  LYS  66           HZ3      LYS  66  30.517  13.987   7.603
  480    HA   PRO  67           HA       PRO  67  22.829  17.924   6.143
  481    HB2  PRO  67           HB2      PRO  67  21.114  18.718   8.115
  482    HB3  PRO  67           HB1      PRO  67  21.361  17.017   7.672
  483    HG2  PRO  67           HG2      PRO  67  22.496  18.565   9.951
  484    HG3  PRO  67           HG1      PRO  67  21.896  16.899   9.903
  485    HD2  PRO  67           HD2      PRO  67  24.560  17.521   9.835
  486    HD3  PRO  67           HD1      PRO  67  23.885  16.061   9.078
  487    H    ALA  68           HN       ALA  68  21.939  19.922   5.463
  488    HA   ALA  68           HA       ALA  68  23.563  22.193   5.804
  489    HB1  ALA  68           HB1      ALA  68  21.441  23.356   4.800
  490    HB2  ALA  68           HB2      ALA  68  20.861  21.702   4.608
  491    HB3  ALA  68           HB3      ALA  68  22.353  22.210   3.818
  492    H    LYS  69           HN       LYS  69  20.479  21.281   7.267
  493    HA   LYS  69           HA       LYS  69  19.987  23.685   8.651
  494    HB2  LYS  69           HB2      LYS  69  18.299  21.912   8.347
  495    HB3  LYS  69           HB1      LYS  69  19.205  20.869   9.443
  496    HG2  LYS  69           HG2      LYS  69  18.951  22.561  11.240
  497    HG3  LYS  69           HG1      LYS  69  17.997  23.562  10.146
  498    HD2  LYS  69           HD2      LYS  69  17.266  20.713  10.871
  499    HD3  LYS  69           HD1      LYS  69  16.622  22.127  11.706
  500    HE2  LYS  69           HE2      LYS  69  15.778  22.981   9.510
  501    HE3  LYS  69           HE1      LYS  69  16.314  21.478   8.760
  502    HZ1  LYS  69           HZ1      LYS  69  14.726  20.261   9.832
  503    HZ2  LYS  69           HZ2      LYS  69  13.890  21.724   9.622
  504    HZ3  LYS  69           HZ3      LYS  69  14.585  21.350  11.126
  505    H    SER  70           HN       SER  70  21.683  20.723   9.638
  506    HA   SER  70           HA       SER  70  23.115  20.290  11.383
  507    HB2  SER  70           HB2      SER  70  23.636  23.258  11.112
  508    HB3  SER  70           HB1      SER  70  24.648  22.126  12.003
  509    HG   SER  70           HG       SER  70  24.846  22.711   9.495
  510    H    ALA  71           HN       ALA  71  20.383  20.795  12.053
  511    HA   ALA  71           HA       ALA  71  20.710  21.344  14.875
  512    HB1  ALA  71           HB1      ALA  71  18.842  23.098  13.260
  513    HB2  ALA  71           HB2      ALA  71  20.400  23.621  13.898
  514    HB3  ALA  71           HB3      ALA  71  19.106  23.159  15.002
  Start of MODEL   20
    1    H1   GLY   1           HT1      GLY   1  30.191 -12.531  18.230
    2    H2   GLY   1           HT2      GLY   1  29.494 -13.022  16.761
    3    H3   GLY   1           HT3      GLY   1  31.181 -12.867  16.895
    4    HA2  GLY   1           HA2      GLY   1  29.712 -14.742  18.632
    5    HA3  GLY   1           HA1      GLY   1  30.166 -15.207  16.992
    6    H    GLY   2           HN       GLY   2  31.269 -16.671  18.939
    7    HA2  GLY   2           HA2      GLY   2  33.317 -17.495  19.602
    8    HA3  GLY   2           HA1      GLY   2  34.061 -16.282  18.564
    9    HA   PRO   3           HA       PRO   3  34.933 -15.088  22.957
   10    HB2  PRO   3           HB2      PRO   3  37.597 -14.609  22.569
   11    HB3  PRO   3           HB1      PRO   3  36.945 -16.210  22.965
   12    HG2  PRO   3           HG2      PRO   3  37.820 -15.117  20.344
   13    HG3  PRO   3           HG1      PRO   3  38.003 -16.749  21.009
   14    HD2  PRO   3           HD2      PRO   3  36.083 -16.065  19.155
   15    HD3  PRO   3           HD1      PRO   3  35.915 -17.414  20.301
   16    H    GLU   4           HN       GLU   4  33.528 -13.286  21.939
   17    HA   GLU   4           HA       GLU   4  33.185 -11.052  21.536
   18    HB2  GLU   4           HB2      GLU   4  35.959 -10.813  22.724
   19    HB3  GLU   4           HB1      GLU   4  34.814  -9.489  22.513
   20    HG2  GLU   4           HG2      GLU   4  34.262 -11.979  24.153
   21    HG3  GLU   4           HG1      GLU   4  34.804 -10.443  24.830
   22    H    THR   5           HN       THR   5  34.011 -12.518  19.323
   23    HA   THR   5           HA       THR   5  35.869 -10.689  17.947
   24    HB   THR   5           HB       THR   5  35.148 -13.560  17.307
   25    HG1  THR   5           HG1      THR   5  36.554 -13.176  19.117
   26   HG21  THR   5          HG21      THR   5  35.603 -12.513  15.241
   27   HG22  THR   5          HG22      THR   5  37.143 -13.227  15.712
   28   HG23  THR   5          HG23      THR   5  36.870 -11.501  15.931
   29    H    LEU   6           HN       LEU   6  35.076  -9.438  16.381
   30    HA   LEU   6           HA       LEU   6  32.438 -10.144  15.234
   31    HB2  LEU   6           HB2      LEU   6  33.573  -7.366  15.659
   32    HB3  LEU   6           HB1      LEU   6  31.965  -7.766  15.054
   33    HG   LEU   6           HG       LEU   6  33.031  -8.500  17.797
   34   HD11  LEU   6          HD11      LEU   6  31.490  -6.812  18.636
   35   HD12  LEU   6          HD12      LEU   6  30.910  -6.482  17.006
   36   HD13  LEU   6          HD13      LEU   6  32.562  -6.062  17.453
   37   HD21  LEU   6          HD21      LEU   6  30.369  -8.922  16.413
   38   HD22  LEU   6          HD22      LEU   6  30.570  -9.053  18.158
   39   HD23  LEU   6          HD23      LEU   6  31.437 -10.151  17.087
   40    H    CYS   7           HN       CYS   7  32.986 -11.057  13.322
   41    HA   CYS   7           HA       CYS   7  34.586  -9.396  11.475
   42    HB2  CYS   7           HB2      CYS   7  34.655 -12.416  11.703
   43    HB3  CYS   7           HB1      CYS   7  35.529 -11.451  10.513
   44    H    GLY   8           HN       GLY   8  34.073  -9.692   9.217
   45    HA2  GLY   8           HA2      GLY   8  32.603  -9.846   7.455
   46    HA3  GLY   8           HA1      GLY   8  31.994 -11.303   8.236
   47    H    ALA   9           HN       ALA   9  29.865 -11.203   8.490
   48    HA   ALA   9           HA       ALA   9  28.311  -8.871   8.348
   49    HB1  ALA   9           HB1      ALA   9  27.828 -11.692   9.183
   50    HB2  ALA   9           HB2      ALA   9  27.031 -10.735   7.935
   51    HB3  ALA   9           HB3      ALA   9  26.621 -10.485   9.634
   52    H    GLU  10           HN       GLU  10  29.690 -10.591  11.106
   53    HA   GLU  10           HA       GLU  10  28.307  -9.288  13.170
   54    HB2  GLU  10           HB2      GLU  10  31.087 -10.471  13.047
   55    HB3  GLU  10           HB1      GLU  10  30.377  -9.848  14.533
   56    HG2  GLU  10           HG2      GLU  10  28.555 -11.428  14.406
   57    HG3  GLU  10           HG1      GLU  10  29.067 -11.960  12.805
   58    H    LEU  11           HN       LEU  11  31.311  -8.412  11.487
   59    HA   LEU  11           HA       LEU  11  31.913  -6.140  13.049
   60    HB2  LEU  11           HB2      LEU  11  33.588  -7.141  11.598
   61    HB3  LEU  11           HB1      LEU  11  32.610  -6.782  10.174
   62    HG   LEU  11           HG       LEU  11  32.808  -4.364  10.645
   63   HD11  LEU  11          HD11      LEU  11  33.002  -4.306  13.023
   64   HD12  LEU  11          HD12      LEU  11  34.548  -3.723  12.406
   65   HD13  LEU  11          HD13      LEU  11  34.405  -5.376  13.006
   66   HD21  LEU  11          HD21      LEU  11  35.070  -4.118   9.943
   67   HD22  LEU  11          HD22      LEU  11  34.545  -5.675   9.301
   68   HD23  LEU  11          HD23      LEU  11  35.556  -5.612  10.745
   69    H    VAL  12           HN       VAL  12  30.154  -6.484   9.981
   70    HA   VAL  12           HA       VAL  12  29.627  -3.755   9.588
   71    HB   VAL  12           HB       VAL  12  28.298  -6.279   8.632
   72   HG11  VAL  12          HG11      VAL  12  27.450  -3.396   8.208
   73   HG12  VAL  12          HG12      VAL  12  26.454  -4.749   8.737
   74   HG13  VAL  12          HG13      VAL  12  27.024  -4.675   7.071
   75   HG21  VAL  12          HG21      VAL  12  29.147  -5.360   6.445
   76   HG22  VAL  12          HG22      VAL  12  30.420  -5.733   7.607
   77   HG23  VAL  12          HG23      VAL  12  29.924  -4.061   7.351
   78    H    ASP  13           HN       ASP  13  27.703  -6.296  11.152
   79    HA   ASP  13           HA       ASP  13  25.463  -4.706  11.767
   80    HB2  ASP  13           HB2      ASP  13  26.572  -7.222  13.016
   81    HB3  ASP  13           HB1      ASP  13  25.067  -6.475  13.553
   82    H    ALA  14           HN       ALA  14  28.436  -5.398  13.562
   83    HA   ALA  14           HA       ALA  14  27.709  -4.117  15.968
   84    HB1  ALA  14           HB1      ALA  14  29.708  -5.667  15.497
   85    HB2  ALA  14           HB2      ALA  14  29.974  -4.300  16.583
   86    HB3  ALA  14           HB3      ALA  14  30.525  -4.219  14.909
   87    H    LEU  15           HN       LEU  15  29.335  -2.926  13.048
   88    HA   LEU  15           HA       LEU  15  29.936  -0.341  13.990
   89    HB2  LEU  15           HB2      LEU  15  29.412  -1.405  11.211
   90    HB3  LEU  15           HB1      LEU  15  29.927   0.253  11.522
   91    HG   LEU  15           HG       LEU  15  31.441  -2.161  12.545
   92   HD11  LEU  15          HD11      LEU  15  32.169  -0.479  10.137
   93   HD12  LEU  15          HD12      LEU  15  31.268  -1.988   9.992
   94   HD13  LEU  15          HD13      LEU  15  32.897  -1.997  10.665
   95   HD21  LEU  15          HD21      LEU  15  31.970  -0.171  13.782
   96   HD22  LEU  15          HD22      LEU  15  32.016   0.803  12.314
   97   HD23  LEU  15          HD23      LEU  15  33.273  -0.389  12.623
   98    H    GLN  16           HN       GLN  16  27.073  -1.629  12.348
   99    HA   GLN  16           HA       GLN  16  25.688   0.837  12.117
  100    HB2  GLN  16           HB2      GLN  16  25.112  -1.241  10.861
  101    HB3  GLN  16           HB1      GLN  16  24.502  -1.935  12.364
  102    HG2  GLN  16           HG2      GLN  16  22.895  -0.080  12.572
  103    HG3  GLN  16           HG1      GLN  16  23.503   0.622  11.077
  104   HE21  GLN  16          HE21      GLN  16  20.863   0.081  10.936
  105   HE22  GLN  16          HE22      GLN  16  20.552  -1.346  10.071
  106    H    PHE  17           HN       PHE  17  25.818  -1.638  14.639
  107    HA   PHE  17           HA       PHE  17  23.752  -0.665  16.280
  108    HB2  PHE  17           HB2      PHE  17  24.604  -2.823  16.765
  109    HB3  PHE  17           HB1      PHE  17  26.263  -2.233  16.877
  110    HD1  PHE  17           HD1      PHE  17  22.950  -2.279  18.541
  111    HD2  PHE  17           HD2      PHE  17  27.094  -1.148  18.866
  112    HE1  PHE  17           HE1      PHE  17  22.644  -1.860  20.967
  113    HE2  PHE  17           HE2      PHE  17  26.778  -0.741  21.295
  114    HZ   PHE  17           HZ       PHE  17  24.557  -1.093  22.345
  115    H    VAL  18           HN       VAL  18  27.249   0.005  16.321
  116    HA   VAL  18           HA       VAL  18  27.222   1.761  18.521
  117    HB   VAL  18           HB       VAL  18  29.099   1.563  16.157
  118   HG11  VAL  18          HG11      VAL  18  29.246   3.197  18.695
  119   HG12  VAL  18          HG12      VAL  18  29.344   3.784  17.034
  120   HG13  VAL  18          HG13      VAL  18  30.662   2.826  17.712
  121   HG21  VAL  18          HG21      VAL  18  29.125  -0.422  17.531
  122   HG22  VAL  18          HG22      VAL  18  29.156   0.538  19.009
  123   HG23  VAL  18          HG23      VAL  18  30.559   0.518  17.942
  124    H    CYS  19           HN       CYS  19  27.081   2.422  15.026
  125    HA   CYS  19           HA       CYS  19  26.367   5.224  15.622
  126    HB2  CYS  19           HB2      CYS  19  27.246   3.905  13.041
  127    HB3  CYS  19           HB1      CYS  19  26.837   5.600  13.216
  128    H    GLY  20           HN       GLY  20  25.481   3.130  12.893
  129    HA2  GLY  20           HA2      GLY  20  23.451   2.650  11.940
  130    HA3  GLY  20           HA1      GLY  20  22.776   2.796  13.560
  131    H    ASP  21           HN       ASP  21  24.467   5.414  11.988
  132    HA   ASP  21           HA       ASP  21  21.960   6.743  11.275
  133    HB2  ASP  21           HB2      ASP  21  23.130   8.811  12.538
  134    HB3  ASP  21           HB1      ASP  21  21.967   7.738  13.322
  135    H    ARG  22           HN       ARG  22  25.197   8.061  11.876
  136    HA   ARG  22           HA       ARG  22  25.312   9.462   9.434
  137    HB2  ARG  22           HB2      ARG  22  27.494   8.606  11.344
  138    HB3  ARG  22           HB1      ARG  22  27.759   9.679   9.970
  139    HG2  ARG  22           HG2      ARG  22  25.989  11.198  10.887
  140    HG3  ARG  22           HG1      ARG  22  25.903  10.166  12.314
  141    HD2  ARG  22           HD2      ARG  22  27.393  12.006  12.815
  142    HD3  ARG  22           HD1      ARG  22  28.361  10.546  12.662
  143    HE   ARG  22           HE       ARG  22  29.348  11.456  10.758
  144   HH11  ARG  22          HH11      ARG  22  26.490  13.225  11.654
  145   HH12  ARG  22          HH12      ARG  22  26.771  14.497  10.529
  146   HH21  ARG  22          HH21      ARG  22  29.704  13.142   9.276
  147   HH22  ARG  22          HH22      ARG  22  28.581  14.458   9.183
  148    H    GLY  23           HN       GLY  23  26.550   6.294  10.408
  149    HA2  GLY  23           HA2      GLY  23  26.605   4.499   8.784
  150    HA3  GLY  23           HA1      GLY  23  27.022   5.688   7.556
  151    H    PHE  24           HN       PHE  24  28.617   3.592   7.571
  152    HA   PHE  24           HA       PHE  24  31.141   4.665   8.590
  153    HB2  PHE  24           HB2      PHE  24  31.769   2.422   9.502
  154    HB3  PHE  24           HB1      PHE  24  30.463   3.200  10.397
  155    HD1  PHE  24           HD1      PHE  24  31.365   0.471   8.099
  156    HD2  PHE  24           HD2      PHE  24  28.155   2.394  10.208
  157    HE1  PHE  24           HE1      PHE  24  29.902  -1.473   7.651
  158    HE2  PHE  24           HE2      PHE  24  26.689   0.446   9.763
  159    HZ   PHE  24           HZ       PHE  24  27.566  -1.487   8.481
  160    H    TYR  25           HN       TYR  25  32.975   3.887   7.487
  161    HA   TYR  25           HA       TYR  25  32.616   1.979   5.315
  162    HB2  TYR  25           HB2      TYR  25  33.277   3.478   3.554
  163    HB3  TYR  25           HB1      TYR  25  31.919   4.221   4.399
  164    HD1  TYR  25           HD1      TYR  25  35.531   4.378   3.752
  165    HD2  TYR  25           HD2      TYR  25  32.251   6.147   5.889
  166    HE1  TYR  25           HE1      TYR  25  36.927   6.364   4.250
  167    HE2  TYR  25           HE2      TYR  25  33.650   8.132   6.386
  168    HH   TYR  25           HH       TYR  25  36.746   8.625   4.886
  169    H    PHE  26           HN       PHE  26  34.697   1.527   4.208
  170    HA   PHE  26           HA       PHE  26  37.019   2.110   5.946
  171    HB2  PHE  26           HB2      PHE  26  36.300  -0.513   4.617
  172    HB3  PHE  26           HB1      PHE  26  37.836  -0.186   5.423
  173    HD1  PHE  26           HD1      PHE  26  34.208  -0.662   5.899
  174    HD2  PHE  26           HD2      PHE  26  37.981   0.034   7.847
  175    HE1  PHE  26           HE1      PHE  26  33.182  -1.216   8.087
  176    HE2  PHE  26           HE2      PHE  26  36.950  -0.527  10.029
  177    HZ   PHE  26           HZ       PHE  26  34.554  -1.145  10.152
  178    H    ASN  27           HN       ASN  27  38.899   2.637   4.933
  179    HA   ASN  27           HA       ASN  27  38.739   3.227   2.089
  180    HB2  ASN  27           HB2      ASN  27  40.814   4.411   2.406
  181    HB3  ASN  27           HB1      ASN  27  39.747   4.812   3.752
  182   HD21  ASN  27          HD21      ASN  27  42.536   5.110   4.079
  183   HD22  ASN  27          HD22      ASN  27  43.101   3.923   5.152
  184    H    LYS  28           HN       LYS  28  40.959   2.817   0.895
  185    HA   LYS  28           HA       LYS  28  41.242  -0.044   0.789
  186    HB2  LYS  28           HB2      LYS  28  42.591   2.154  -0.793
  187    HB3  LYS  28           HB1      LYS  28  42.750   0.432  -1.133
  188    HG2  LYS  28           HG2      LYS  28  40.092   1.873  -1.038
  189    HG3  LYS  28           HG1      LYS  28  40.999   1.599  -2.525
  190    HD2  LYS  28           HD2      LYS  28  40.965  -0.856  -2.032
  191    HD3  LYS  28           HD1      LYS  28  39.925  -0.527  -0.651
  192    HE2  LYS  28           HE2      LYS  28  38.249   0.493  -2.134
  193    HE3  LYS  28           HE1      LYS  28  39.282   0.164  -3.526
  194    HZ1  LYS  28           HZ1      LYS  28  38.261  -1.923  -1.679
  195    HZ2  LYS  28           HZ2      LYS  28  39.105  -2.168  -3.133
  196    HZ3  LYS  28           HZ3      LYS  28  37.534  -1.524  -3.158
  197    HA   PRO  29           HA       PRO  29  44.846  -0.446   3.281
  198    HB2  PRO  29           HB2      PRO  29  46.146  -2.478   1.971
  199    HB3  PRO  29           HB1      PRO  29  44.719  -2.723   2.996
  200    HG2  PRO  29           HG2      PRO  29  44.921  -2.553   0.028
  201    HG3  PRO  29           HG1      PRO  29  43.927  -3.621   1.035
  202    HD2  PRO  29           HD2      PRO  29  42.916  -1.417  -0.189
  203    HD3  PRO  29           HD1      PRO  29  42.288  -2.018   1.359
  204    H    THR  30           HN       THR  30  45.253  -0.033  -0.187
  205    HA   THR  30           HA       THR  30  47.862   1.260   0.317
  206    HB   THR  30           HB       THR  30  47.014  -0.312  -2.131
  207    HG1  THR  30           HG1      THR  30  48.685  -1.698  -1.405
  208   HG21  THR  30          HG21      THR  30  49.612   1.089  -1.447
  209   HG22  THR  30          HG22      THR  30  48.462   1.594  -2.683
  210   HG23  THR  30          HG23      THR  30  49.341   0.077  -2.865
  211    H    GLY  31           HN       GLY  31  47.970   3.345  -0.259
  212    HA2  GLY  31           HA2      GLY  31  47.527   4.881  -2.219
  213    HA3  GLY  31           HA1      GLY  31  45.841   4.416  -2.003
  214    H    TYR  32           HN       TYR  32  46.994   4.398   1.041
  215    HA   TYR  32           HA       TYR  32  46.513   7.255   1.460
  216    HB2  TYR  32           HB2      TYR  32  45.520   4.943   3.134
  217    HB3  TYR  32           HB1      TYR  32  45.358   6.638   3.566
  218    HD1  TYR  32           HD1      TYR  32  44.196   3.963   1.347
  219    HD2  TYR  32           HD2      TYR  32  43.883   8.142   2.289
  220    HE1  TYR  32           HE1      TYR  32  42.144   4.120  -0.037
  221    HE2  TYR  32           HE2      TYR  32  41.831   8.300   0.904
  222    HH   TYR  32           HH       TYR  32  40.167   5.543  -0.233
  223    H    GLY  33           HN       GLY  33  47.724   8.266   3.053
  224    HA2  GLY  33           HA2      GLY  33  49.261   8.371   4.846
  225    HA3  GLY  33           HA1      GLY  33  49.621   6.664   4.608
  226    H    SER  34           HN       SER  34  51.577   8.722   4.897
  227    HA   SER  34           HA       SER  34  52.763   8.784   2.189
  228    HB2  SER  34           HB2      SER  34  53.183  10.642   4.538
  229    HB3  SER  34           HB1      SER  34  54.103  10.706   3.038
  230    HG   SER  34           HG       SER  34  51.275  10.897   3.249
  231    H    SER  35           HN       SER  35  52.871   7.005   4.892
  232    HA   SER  35           HA       SER  35  55.665   6.280   4.466
  233    HB2  SER  35           HB2      SER  35  55.823   7.862   6.293
  234    HB3  SER  35           HB1      SER  35  54.504   7.066   7.148
  235    HG   SER  35           HG       SER  35  55.800   5.367   7.569
  236    H    SER  36           HN       SER  36  55.773   4.148   4.258
  237    HA   SER  36           HA       SER  36  53.567   2.438   4.708
  238    HB2  SER  36           HB2      SER  36  55.089   0.626   4.125
  239    HB3  SER  36           HB1      SER  36  55.335   1.986   3.034
  240    HG   SER  36           HG       SER  36  57.275   1.013   3.989
  241    H    ARG  37           HN       ARG  37  56.263   3.394   6.667
  242    HA   ARG  37           HA       ARG  37  56.232   1.312   8.568
  243    HB2  ARG  37           HB2      ARG  37  58.055   2.965   8.405
  244    HB3  ARG  37           HB1      ARG  37  56.959   4.220   8.983
  245    HG2  ARG  37           HG2      ARG  37  56.634   2.991  11.087
  246    HG3  ARG  37           HG1      ARG  37  57.696   1.705  10.510
  247    HD2  ARG  37           HD2      ARG  37  59.560   3.299  10.358
  248    HD3  ARG  37           HD1      ARG  37  58.504   4.598  10.906
  249    HE   ARG  37           HE       ARG  37  58.419   2.537  12.817
  250   HH11  ARG  37          HH11      ARG  37  60.627   4.848  11.457
  251   HH12  ARG  37          HH12      ARG  37  61.569   4.986  12.895
  252   HH21  ARG  37          HH21      ARG  37  59.666   2.726  14.705
  253   HH22  ARG  37          HH22      ARG  37  61.032   3.790  14.732
  254    H    ARG  38           HN       ARG  38  54.507   4.413   8.453
  255    HA   ARG  38           HA       ARG  38  53.185   4.104  10.951
  256    HB2  ARG  38           HB2      ARG  38  53.434   6.287   9.841
  257    HB3  ARG  38           HB1      ARG  38  52.373   5.744   8.540
  258    HG2  ARG  38           HG2      ARG  38  50.520   5.480  10.086
  259    HG3  ARG  38           HG1      ARG  38  51.566   5.836  11.462
  260    HD2  ARG  38           HD2      ARG  38  50.286   7.830  10.871
  261    HD3  ARG  38           HD1      ARG  38  51.991   8.093  10.519
  262    HE   ARG  38           HE       ARG  38  50.610   7.088   8.229
  263   HH11  ARG  38          HH11      ARG  38  51.141   9.913  10.181
  264   HH12  ARG  38          HH12      ARG  38  50.845  11.017   8.890
  265   HH21  ARG  38          HH21      ARG  38  50.221   8.551   6.537
  266   HH22  ARG  38          HH22      ARG  38  50.326  10.255   6.829
  267    H    ALA  39           HN       ALA  39  52.308   3.309   7.617
  268    HA   ALA  39           HA       ALA  39  50.092   1.664   8.677
  269    HB1  ALA  39           HB1      ALA  39  50.063   3.532   6.305
  270    HB2  ALA  39           HB2      ALA  39  49.001   3.548   7.714
  271    HB3  ALA  39           HB3      ALA  39  48.871   2.251   6.525
  272    HA   PRO  40           HA       PRO  40  52.862  -0.809   5.910
  273    HB2  PRO  40           HB2      PRO  40  53.401  -2.805   7.682
  274    HB3  PRO  40           HB1      PRO  40  54.338  -1.300   7.613
  275    HG2  PRO  40           HG2      PRO  40  52.250  -2.145   9.538
  276    HG3  PRO  40           HG1      PRO  40  53.695  -1.156   9.796
  277    HD2  PRO  40           HD2      PRO  40  51.102  -0.154   9.524
  278    HD3  PRO  40           HD1      PRO  40  52.587   0.790   9.302
  279    H    GLN  41           HN       GLN  41  50.538  -0.963   5.026
  280    HA   GLN  41           HA       GLN  41  48.752  -2.227   4.321
  281    HB2  GLN  41           HB2      GLN  41  50.673  -4.465   5.006
  282    HB3  GLN  41           HB1      GLN  41  49.209  -4.645   4.039
  283    HG2  GLN  41           HG2      GLN  41  50.864  -4.353   2.403
  284    HG3  GLN  41           HG1      GLN  41  50.218  -2.724   2.592
  285   HE21  GLN  41          HE21      GLN  41  52.036  -1.388   2.334
  286   HE22  GLN  41          HE22      GLN  41  53.480  -1.564   3.209
  287    H    THR  42           HN       THR  42  48.381  -1.312   6.855
  288    HA   THR  42           HA       THR  42  47.276  -3.627   8.323
  289    HB   THR  42           HB       THR  42  48.063  -0.899   9.358
  290    HG1  THR  42           HG1      THR  42  49.920  -1.917   9.243
  291   HG21  THR  42          HG21      THR  42  47.657  -1.989  11.585
  292   HG22  THR  42          HG22      THR  42  46.942  -3.352  10.726
  293   HG23  THR  42          HG23      THR  42  46.197  -1.758  10.625
  294    H    GLY  43           HN       GLY  43  45.127  -3.729   8.648
  295    HA2  GLY  43           HA2      GLY  43  43.502  -1.393   7.872
  296    HA3  GLY  43           HA1      GLY  43  43.023  -3.058   7.551
  297    H    ILE  44           HN       ILE  44  41.996  -0.700   9.277
  298    HA   ILE  44           HA       ILE  44  42.073  -1.428  11.989
  299    HB   ILE  44           HB       ILE  44  40.132   0.002  12.266
  300   HG12  ILE  44          HG12      ILE  44  39.954   0.024   9.239
  301   HG13  ILE  44          HG11      ILE  44  38.880  -0.906  10.275
  302   HG21  ILE  44          HG21      ILE  44  42.432   0.955  11.678
  303   HG22  ILE  44          HG22      ILE  44  41.051   2.018  11.398
  304   HG23  ILE  44          HG23      ILE  44  41.800   1.174  10.042
  305   HD11  ILE  44          HD11      ILE  44  37.914   1.008  11.231
  306   HD12  ILE  44          HD12      ILE  44  38.065   1.416   9.526
  307   HD13  ILE  44          HD13      ILE  44  39.211   2.061  10.681
  308    H    VAL  45           HN       VAL  45  40.230  -2.664   9.316
  309    HA   VAL  45           HA       VAL  45  38.157  -3.952  10.747
  310    HB   VAL  45           HB       VAL  45  39.442  -4.520   8.073
  311   HG11  VAL  45          HG11      VAL  45  37.205  -5.946   9.525
  312   HG12  VAL  45          HG12      VAL  45  38.611  -6.649   8.723
  313   HG13  VAL  45          HG13      VAL  45  37.306  -5.942   7.765
  314   HG21  VAL  45          HG21      VAL  45  36.903  -3.183   9.040
  315   HG22  VAL  45          HG22      VAL  45  37.075  -3.747   7.378
  316   HG23  VAL  45          HG23      VAL  45  38.169  -2.518   8.008
  317    H    ASP  46           HN       ASP  46  41.343  -5.094   9.667
  318    HA   ASP  46           HA       ASP  46  41.075  -7.729  10.668
  319    HB2  ASP  46           HB2      ASP  46  43.475  -6.035   9.981
  320    HB3  ASP  46           HB1      ASP  46  43.621  -7.697  10.549
  321    H    GLU  47           HN       GLU  47  42.090  -4.691  12.110
  322    HA   GLU  47           HA       GLU  47  43.388  -5.711  14.395
  323    HB2  GLU  47           HB2      GLU  47  41.788  -3.164  13.982
  324    HB3  GLU  47           HB1      GLU  47  42.765  -3.491  15.413
  325    HG2  GLU  47           HG2      GLU  47  43.802  -3.436  12.567
  326    HG3  GLU  47           HG1      GLU  47  44.017  -2.148  13.752
  327    H    CYS  48           HN       CYS  48  39.994  -4.641  14.024
  328    HA   CYS  48           HA       CYS  48  39.214  -5.598  16.624
  329    HB2  CYS  48           HB2      CYS  48  37.605  -4.766  14.207
  330    HB3  CYS  48           HB1      CYS  48  36.910  -5.215  15.746
  331    H    CYS  49           HN       CYS  49  38.972  -6.867  13.324
  332    HA   CYS  49           HA       CYS  49  37.351  -9.076  13.885
  333    HB2  CYS  49           HB2      CYS  49  37.809  -8.321  11.595
  334    HB3  CYS  49           HB1      CYS  49  39.501  -8.789  11.775
  335    H    PHE  50           HN       PHE  50  40.892  -8.827  13.766
  336    HA   PHE  50           HA       PHE  50  41.184 -11.540  14.725
  337    HB2  PHE  50           HB2      PHE  50  43.137  -9.392  13.931
  338    HB3  PHE  50           HB1      PHE  50  43.673 -10.903  14.672
  339    HD1  PHE  50           HD1      PHE  50  41.854  -9.411  11.783
  340    HD2  PHE  50           HD2      PHE  50  43.683 -12.940  13.412
  341    HE1  PHE  50           HE1      PHE  50  41.667 -10.515   9.574
  342    HE2  PHE  50           HE2      PHE  50  43.501 -14.053  11.204
  343    HZ   PHE  50           HZ       PHE  50  42.496 -12.845   9.286
  344    H    ARG  51           HN       ARG  51  42.622  -8.456  15.814
  345    HA   ARG  51           HA       ARG  51  42.889  -9.437  18.519
  346    HB2  ARG  51           HB2      ARG  51  43.389  -6.688  17.363
  347    HB3  ARG  51           HB1      ARG  51  43.841  -7.216  18.981
  348    HG2  ARG  51           HG2      ARG  51  45.231  -9.017  17.972
  349    HG3  ARG  51           HG1      ARG  51  44.831  -8.397  16.369
  350    HD2  ARG  51           HD2      ARG  51  46.963  -7.459  16.983
  351    HD3  ARG  51           HD1      ARG  51  45.774  -6.169  17.091
  352    HE   ARG  51           HE       ARG  51  46.106  -6.116  19.397
  353   HH11  ARG  51          HH11      ARG  51  47.489  -8.982  17.991
  354   HH12  ARG  51          HH12      ARG  51  48.303  -9.449  19.433
  355   HH21  ARG  51          HH21      ARG  51  47.183  -6.749  21.293
  356   HH22  ARG  51          HH22      ARG  51  48.136  -8.195  21.302
  357    H    SER  52           HN       SER  52  42.019  -8.222  20.378
  358    HA   SER  52           HA       SER  52  39.199  -7.618  19.944
  359    HB2  SER  52           HB2      SER  52  39.754  -9.094  21.793
  360    HB3  SER  52           HB1      SER  52  40.850  -7.891  22.468
  361    HG   SER  52           HG       SER  52  38.301  -8.154  22.958
  362    H    CYS  53           HN       CYS  53  38.628  -5.602  19.459
  363    HA   CYS  53           HA       CYS  53  40.190  -3.371  20.614
  364    HB2  CYS  53           HB2      CYS  53  39.517  -2.042  18.742
  365    HB3  CYS  53           HB1      CYS  53  40.079  -3.576  18.097
  366    H    ASP  54           HN       ASP  54  39.183  -1.859  21.840
  367    HA   ASP  54           HA       ASP  54  36.725  -2.480  23.071
  368    HB2  ASP  54           HB2      ASP  54  38.372   0.046  22.995
  369    HB3  ASP  54           HB1      ASP  54  36.897  -0.098  23.945
  370    H    LEU  55           HN       LEU  55  34.683  -1.558  22.898
  371    HA   LEU  55           HA       LEU  55  33.827  -0.887  20.276
  372    HB2  LEU  55           HB2      LEU  55  32.460  -0.697  22.965
  373    HB3  LEU  55           HB1      LEU  55  31.652  -0.333  21.439
  374    HG   LEU  55           HG       LEU  55  33.064  -2.957  21.972
  375   HD11  LEU  55          HD11      LEU  55  30.954  -3.923  22.545
  376   HD12  LEU  55          HD12      LEU  55  30.079  -2.462  22.081
  377   HD13  LEU  55          HD13      LEU  55  31.093  -2.463  23.524
  378   HD21  LEU  55          HD21      LEU  55  31.194  -1.901  19.837
  379   HD22  LEU  55          HD22      LEU  55  31.462  -3.627  20.073
  380   HD23  LEU  55          HD23      LEU  55  32.807  -2.580  19.628
  381    H    ARG  56           HN       ARG  56  34.638   1.019  23.122
  382    HA   ARG  56           HA       ARG  56  33.565   3.473  22.378
  383    HB2  ARG  56           HB2      ARG  56  34.550   3.060  24.591
  384    HB3  ARG  56           HB1      ARG  56  36.150   2.927  23.863
  385    HG2  ARG  56           HG2      ARG  56  35.869   5.172  24.783
  386    HG3  ARG  56           HG1      ARG  56  35.923   5.269  23.028
  387    HD2  ARG  56           HD2      ARG  56  33.523   5.458  22.890
  388    HD3  ARG  56           HD1      ARG  56  33.351   5.123  24.610
  389    HE   ARG  56           HE       ARG  56  34.972   7.374  24.395
  390   HH11  ARG  56          HH11      ARG  56  31.764   6.378  23.507
  391   HH12  ARG  56          HH12      ARG  56  31.097   7.963  23.639
  392   HH21  ARG  56          HH21      ARG  56  34.084   9.456  24.567
  393   HH22  ARG  56          HH22      ARG  56  32.402   9.705  24.238
  394    H    ARG  57           HN       ARG  57  36.790   2.145  21.667
  395    HA   ARG  57           HA       ARG  57  37.533   4.381  20.012
  396    HB2  ARG  57           HB2      ARG  57  39.519   3.050  19.486
  397    HB3  ARG  57           HB1      ARG  57  39.215   3.038  21.223
  398    HG2  ARG  57           HG2      ARG  57  38.167   0.856  21.072
  399    HG3  ARG  57           HG1      ARG  57  38.319   0.858  19.315
  400    HD2  ARG  57           HD2      ARG  57  40.663   1.028  21.218
  401    HD3  ARG  57           HD1      ARG  57  40.096  -0.471  20.489
  402    HE   ARG  57           HE       ARG  57  40.527   1.387  18.427
  403   HH11  ARG  57          HH11      ARG  57  42.279  -0.373  20.855
  404   HH12  ARG  57          HH12      ARG  57  43.736  -0.446  19.934
  405   HH21  ARG  57          HH21      ARG  57  42.449   1.285  17.222
  406   HH22  ARG  57          HH22      ARG  57  43.837   0.487  17.882
  407    H    LEU  58           HN       LEU  58  35.830   1.418  19.558
  408    HA   LEU  58           HA       LEU  58  36.302   0.996  16.821
  409    HB2  LEU  58           HB2      LEU  58  35.274  -0.704  18.278
  410    HB3  LEU  58           HB1      LEU  58  33.841   0.306  18.439
  411    HG   LEU  58           HG       LEU  58  33.535   0.212  15.968
  412   HD11  LEU  58          HD11      LEU  58  35.790  -0.187  15.234
  413   HD12  LEU  58          HD12      LEU  58  34.844  -1.601  14.779
  414   HD13  LEU  58          HD13      LEU  58  35.900  -1.658  16.190
  415   HD21  LEU  58          HD21      LEU  58  33.702  -2.434  17.431
  416   HD22  LEU  58          HD22      LEU  58  32.864  -2.196  15.895
  417   HD23  LEU  58          HD23      LEU  58  32.304  -1.361  17.349
  418    H    ASP  59           HN       ASP  59  34.083   3.080  18.550
  419    HA   ASP  59           HA       ASP  59  32.273   3.738  16.552
  420    HB2  ASP  59           HB2      ASP  59  32.249   4.491  18.975
  421    HB3  ASP  59           HB1      ASP  59  33.416   5.727  18.514
  422    H    MET  60           HN       MET  60  35.630   4.523  16.816
  423    HA   MET  60           HA       MET  60  35.667   6.832  15.161
  424    HB2  MET  60           HB2      MET  60  37.786   4.800  15.875
  425    HB3  MET  60           HB1      MET  60  38.111   6.220  14.889
  426    HG2  MET  60           HG2      MET  60  37.124   7.617  16.769
  427    HG3  MET  60           HG1      MET  60  37.123   6.151  17.750
  428    HE1  MET  60           HE1      MET  60  40.729   5.190  18.235
  429    HE2  MET  60           HE2      MET  60  39.604   4.551  17.040
  430    HE3  MET  60           HE3      MET  60  39.027   4.962  18.654
  431    H    TYR  61           HN       TYR  61  34.954   3.633  14.446
  432    HA   TYR  61           HA       TYR  61  36.156   3.401  11.880
  433    HB2  TYR  61           HB2      TYR  61  34.006   1.906  13.360
  434    HB3  TYR  61           HB1      TYR  61  34.310   1.575  11.651
  435    HD1  TYR  61           HD1      TYR  61  37.041   2.703  13.845
  436    HD2  TYR  61           HD2      TYR  61  35.078  -0.725  12.153
  437    HE1  TYR  61           HE1      TYR  61  38.965   1.312  14.467
  438    HE2  TYR  61           HE2      TYR  61  37.022  -2.129  12.776
  439    HH   TYR  61           HH       TYR  61  39.976  -0.722  14.064
  440    H    CYS  62           HN       CYS  62  33.150   4.694  13.096
  441    HA   CYS  62           HA       CYS  62  31.779   4.844  10.616
  442    HB2  CYS  62           HB2      CYS  62  31.473   6.353  13.209
  443    HB3  CYS  62           HB1      CYS  62  30.411   6.606  11.824
  444    H    ALA  63           HN       ALA  63  31.213   6.901   9.508
  445    HA   ALA  63           HA       ALA  63  33.525   8.247   8.656
  446    HB1  ALA  63           HB1      ALA  63  30.896   9.555   8.217
  447    HB2  ALA  63           HB2      ALA  63  31.066   7.913   7.604
  448    HB3  ALA  63           HB3      ALA  63  32.175   9.173   7.065
  449    HA   PRO  64           HA       PRO  64  34.194  11.678  11.296
  450    HB2  PRO  64           HB2      PRO  64  33.532  13.506   9.023
  451    HB3  PRO  64           HB1      PRO  64  34.982  13.452  10.045
  452    HG2  PRO  64           HG2      PRO  64  35.007  12.530   7.548
  453    HG3  PRO  64           HG1      PRO  64  35.937  11.751   8.840
  454    HD2  PRO  64           HD2      PRO  64  33.417  10.814   7.522
  455    HD3  PRO  64           HD1      PRO  64  34.744   9.880   8.238
  456    H    LEU  65           HN       LEU  65  32.999  12.865  12.723
  457    HA   LEU  65           HA       LEU  65  30.229  13.564  11.965
  458    HB2  LEU  65           HB2      LEU  65  29.581  13.047  14.314
  459    HB3  LEU  65           HB1      LEU  65  30.148  11.630  13.432
  460    HG   LEU  65           HG       LEU  65  32.437  12.855  14.590
  461   HD11  LEU  65          HD11      LEU  65  30.667  13.926  16.089
  462   HD12  LEU  65          HD12      LEU  65  31.917  12.995  16.914
  463   HD13  LEU  65          HD13      LEU  65  30.315  12.298  16.669
  464   HD21  LEU  65          HD21      LEU  65  32.711  10.710  15.599
  465   HD22  LEU  65          HD22      LEU  65  31.872  10.404  14.078
  466   HD23  LEU  65          HD23      LEU  65  30.974  10.407  15.597
  467    H    LYS  66           HN       LYS  66  32.804  15.113  12.072
  468    HA   LYS  66           HA       LYS  66  31.843  17.250  13.864
  469    HB2  LYS  66           HB2      LYS  66  34.306  17.815  14.186
  470    HB3  LYS  66           HB1      LYS  66  33.721  16.373  15.018
  471    HG2  LYS  66           HG2      LYS  66  34.564  14.981  13.124
  472    HG3  LYS  66           HG1      LYS  66  35.221  16.436  12.382
  473    HD2  LYS  66           HD2      LYS  66  35.929  15.529  15.170
  474    HD3  LYS  66           HD1      LYS  66  36.858  15.077  13.744
  475    HE2  LYS  66           HE2      LYS  66  37.180  17.490  13.223
  476    HE3  LYS  66           HE1      LYS  66  36.326  17.902  14.709
  477    HZ1  LYS  66           HZ1      LYS  66  38.808  17.854  14.870
  478    HZ2  LYS  66           HZ2      LYS  66  38.730  16.172  14.654
  479    HZ3  LYS  66           HZ3      LYS  66  37.997  16.892  16.006
  480    HA   PRO  67           HA       PRO  67  32.261  18.646   9.422
  481    HB2  PRO  67           HB2      PRO  67  29.942  20.272  10.342
  482    HB3  PRO  67           HB1      PRO  67  30.143  19.330   8.852
  483    HG2  PRO  67           HG2      PRO  67  28.566  18.478  10.811
  484    HG3  PRO  67           HG1      PRO  67  29.550  17.348   9.862
  485    HD2  PRO  67           HD2      PRO  67  30.017  18.378  12.645
  486    HD3  PRO  67           HD1      PRO  67  30.315  16.762  11.970
  487    H    ALA  68           HN       ALA  68  33.229  20.542   8.739
  488    HA   ALA  68           HA       ALA  68  34.558  22.153  10.618
  489    HB1  ALA  68           HB1      ALA  68  35.330  21.819   8.291
  490    HB2  ALA  68           HB2      ALA  68  35.217  23.527   8.711
  491    HB3  ALA  68           HB3      ALA  68  33.966  22.780   7.719
  492    H    LYS  69           HN       LYS  69  31.585  22.669   8.789
  493    HA   LYS  69           HA       LYS  69  31.159  25.364   9.483
  494    HB2  LYS  69           HB2      LYS  69  29.241  23.143   8.763
  495    HB3  LYS  69           HB1      LYS  69  28.730  24.811   9.021
  496    HG2  LYS  69           HG2      LYS  69  30.174  25.590   7.232
  497    HG3  LYS  69           HG1      LYS  69  30.868  23.980   7.040
  498    HD2  LYS  69           HD2      LYS  69  29.204  24.287   5.307
  499    HD3  LYS  69           HD1      LYS  69  28.568  23.131   6.478
  500    HE2  LYS  69           HE2      LYS  69  27.259  24.892   7.557
  501    HE3  LYS  69           HE1      LYS  69  27.946  26.099   6.470
  502    HZ1  LYS  69           HZ1      LYS  69  26.587  23.742   5.358
  503    HZ2  LYS  69           HZ2      LYS  69  26.776  25.290   4.687
  504    HZ3  LYS  69           HZ3      LYS  69  25.660  25.036   5.943
  505    H    SER  70           HN       SER  70  30.268  22.349  11.105
  506    HA   SER  70           HA       SER  70  28.648  23.473  13.124
  507    HB2  SER  70           HB2      SER  70  28.664  21.074  12.689
  508    HB3  SER  70           HB1      SER  70  30.358  20.974  13.162
  509    HG   SER  70           HG       SER  70  28.571  20.499  14.772
  510    H    ALA  71           HN       ALA  71  29.096  24.321  15.109
  511    HA   ALA  71           HA       ALA  71  30.296  25.318  16.795
  512    HB1  ALA  71           HB1      ALA  71  31.265  22.933  16.860
  513    HB2  ALA  71           HB2      ALA  71  32.213  24.218  17.608
  514    HB3  ALA  71           HB3      ALA  71  32.653  23.614  16.011